USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=18 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 Set 1.1: A 369 ASN : amide:sc= -2.46 K(o=-2.5,f=-0.76) USER MOD Set 1.2: A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 365 SER OG : rot 180:sc= 0 USER MOD Single : A 368 MET CE :methyl 180:sc= 0 (180deg=0) 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 180:sc= 0 USER MOD Single : A 382 SER OG : rot -172:sc= 0.298 USER MOD Single : A 386 HIS : no HD1:sc= -7.01! C(o=-7!,f=-6.1!) USER MOD Single : A 387 TYR OH : rot 157:sc= -5.98! USER MOD Single : A 389 THR OG1 : rot 175:sc= -0.952 USER MOD Single : A 391 LYS NZ :NH3+ 180:sc=-0.00172 (180deg=-0.00172) USER MOD Single : A 392 LYS NZ :NH3+ -149:sc= -0.139 (180deg=-0.719) USER MOD Single : A 394 THR OG1 : rot -130:sc= -0.329 USER MOD Single : A 399 ASN : amide:sc= -0.686 K(o=-0.69,f=-0.11) USER MOD Single : A 400 SER OG : rot -0:sc= -1.59! USER MOD Single : A 404 CYS SG : rot -79:sc= -8.11! USER MOD Single : A 410 THR OG1 : rot 143:sc= 0.901 USER MOD Single : A 414 THR OG1 : rot -26:sc= 0.599 USER MOD Single : A 419 ASN : amide:sc= 0.0272 K(o=0.027,f=-3!) USER MOD Single : A 421 LYS NZ :NH3+ -121:sc= -0.294 (180deg=-3.12!) USER MOD Single : A 430 ASN : amide:sc= -0.656 K(o=-0.66,f=-3.3) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.00236) USER MOD Single : A 437 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 441 TYR OH : rot 130:sc= -1.49 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.0787 X(o=-0.079,f=-0.11) USER MOD Single : A 451 SER OG : rot 180:sc= 0 USER MOD Single : A 453 SER OG : rot 180:sc= -1.23! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 364 -2.850 -11.769 11.254 1.00 0.00 N ATOM 2 CA GLY A 364 -3.521 -11.710 12.581 1.00 0.00 C ATOM 3 C GLY A 364 -4.975 -11.291 12.481 1.00 0.00 C ATOM 4 O GLY A 364 -5.876 -12.104 12.685 1.00 0.00 O ATOM 0 HA2 GLY A 364 -3.461 -12.688 13.058 1.00 0.00 H new ATOM 0 HA3 GLY A 364 -2.988 -11.009 13.223 1.00 0.00 H new ATOM 10 N SER A 365 -5.203 -10.019 12.170 1.00 0.00 N ATOM 11 CA SER A 365 -6.557 -9.495 12.047 1.00 0.00 C ATOM 12 C SER A 365 -6.923 -9.257 10.585 1.00 0.00 C ATOM 13 O SER A 365 -7.964 -9.716 10.113 1.00 0.00 O ATOM 14 CB SER A 365 -6.697 -8.192 12.835 1.00 0.00 C ATOM 15 OG SER A 365 -7.583 -8.351 13.930 1.00 0.00 O ATOM 0 H SER A 365 -4.468 -9.333 11.999 1.00 0.00 H new ATOM 0 HA SER A 365 -7.241 -10.237 12.457 1.00 0.00 H new ATOM 0 HB2 SER A 365 -5.719 -7.876 13.197 1.00 0.00 H new ATOM 0 HB3 SER A 365 -7.064 -7.403 12.178 1.00 0.00 H new ATOM 0 HG SER A 365 -7.654 -7.505 14.419 1.00 0.00 H new ATOM 21 N LEU A 366 -6.062 -8.536 9.874 1.00 0.00 N ATOM 22 CA LEU A 366 -6.298 -8.236 8.467 1.00 0.00 C ATOM 23 C LEU A 366 -7.590 -7.444 8.291 1.00 0.00 C ATOM 24 O LEU A 366 -8.497 -7.525 9.120 1.00 0.00 O ATOM 25 CB LEU A 366 -6.365 -9.528 7.651 1.00 0.00 C ATOM 26 CG LEU A 366 -5.098 -9.861 6.861 1.00 0.00 C ATOM 27 CD1 LEU A 366 -4.872 -8.842 5.755 1.00 0.00 C ATOM 28 CD2 LEU A 366 -3.894 -9.918 7.790 1.00 0.00 C ATOM 0 H LEU A 366 -5.196 -8.149 10.249 1.00 0.00 H new ATOM 0 HA LEU A 366 -5.467 -7.630 8.106 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -6.582 -10.356 8.326 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -7.201 -9.457 6.955 1.00 0.00 H new ATOM 0 HG LEU A 366 -5.227 -10.841 6.401 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -3.966 -9.097 5.205 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -5.723 -8.849 5.075 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -4.764 -7.849 6.192 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -3.000 -10.156 7.213 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -3.765 -8.952 8.278 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -4.054 -10.687 8.546 1.00 0.00 H new ATOM 40 N ASP A 367 -7.666 -6.681 7.207 1.00 0.00 N ATOM 41 CA ASP A 367 -8.848 -5.878 6.921 1.00 0.00 C ATOM 42 C ASP A 367 -9.612 -6.450 5.734 1.00 0.00 C ATOM 43 O ASP A 367 -9.312 -7.547 5.263 1.00 0.00 O ATOM 44 CB ASP A 367 -8.451 -4.428 6.642 1.00 0.00 C ATOM 45 CG ASP A 367 -8.023 -3.696 7.898 1.00 0.00 C ATOM 46 OD1 ASP A 367 -7.423 -4.339 8.785 1.00 0.00 O ATOM 47 OD2 ASP A 367 -8.287 -2.479 7.995 1.00 0.00 O ATOM 0 H ASP A 367 -6.923 -6.602 6.512 1.00 0.00 H new ATOM 0 HA ASP A 367 -9.498 -5.903 7.796 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.636 -4.410 5.918 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -9.292 -3.904 6.188 1.00 0.00 H new ATOM 52 N MET A 368 -10.603 -5.706 5.253 1.00 0.00 N ATOM 53 CA MET A 368 -11.403 -6.154 4.121 1.00 0.00 C ATOM 54 C MET A 368 -11.028 -5.402 2.846 1.00 0.00 C ATOM 55 O MET A 368 -10.821 -6.010 1.796 1.00 0.00 O ATOM 56 CB MET A 368 -12.891 -5.971 4.428 1.00 0.00 C ATOM 57 CG MET A 368 -13.406 -6.914 5.505 1.00 0.00 C ATOM 58 SD MET A 368 -13.626 -6.098 7.097 1.00 0.00 S ATOM 59 CE MET A 368 -12.686 -7.182 8.171 1.00 0.00 C ATOM 0 H MET A 368 -10.869 -4.795 5.628 1.00 0.00 H new ATOM 0 HA MET A 368 -11.199 -7.212 3.957 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.066 -4.942 4.743 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.465 -6.127 3.514 1.00 0.00 H new ATOM 0 HG2 MET A 368 -14.357 -7.340 5.185 1.00 0.00 H new ATOM 0 HG3 MET A 368 -12.708 -7.743 5.620 1.00 0.00 H new ATOM 0 HE1 MET A 368 -12.728 -6.807 9.194 1.00 0.00 H new ATOM 0 HE2 MET A 368 -13.109 -8.186 8.135 1.00 0.00 H new ATOM 0 HE3 MET A 368 -11.648 -7.213 7.838 1.00 0.00 H new ATOM 69 N ASN A 369 -10.938 -4.079 2.943 1.00 0.00 N ATOM 70 CA ASN A 369 -10.584 -3.255 1.791 1.00 0.00 C ATOM 71 C ASN A 369 -9.402 -2.340 2.102 1.00 0.00 C ATOM 72 O ASN A 369 -9.576 -1.149 2.360 1.00 0.00 O ATOM 73 CB ASN A 369 -11.786 -2.417 1.361 1.00 0.00 C ATOM 74 CG ASN A 369 -12.508 -3.006 0.164 1.00 0.00 C ATOM 75 OD1 ASN A 369 -13.721 -3.220 0.201 1.00 0.00 O ATOM 76 ND2 ASN A 369 -11.767 -3.274 -0.905 1.00 0.00 N ATOM 0 H ASN A 369 -11.104 -3.556 3.803 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.292 -3.921 0.979 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -12.482 -2.332 2.195 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.453 -1.408 1.120 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -12.199 -3.673 -1.738 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -10.766 -3.081 -0.893 1.00 0.00 H new ATOM 83 N ALA A 370 -8.202 -2.904 2.057 1.00 0.00 N ATOM 84 CA ALA A 370 -6.983 -2.141 2.312 1.00 0.00 C ATOM 85 C ALA A 370 -6.539 -1.393 1.068 1.00 0.00 C ATOM 86 O ALA A 370 -6.436 -0.170 1.066 1.00 0.00 O ATOM 87 CB ALA A 370 -5.864 -3.043 2.797 1.00 0.00 C ATOM 0 H ALA A 370 -8.045 -3.889 1.846 1.00 0.00 H new ATOM 0 HA ALA A 370 -7.210 -1.417 3.094 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -4.969 -2.447 2.979 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.167 -3.534 3.722 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.650 -3.797 2.039 1.00 0.00 H new ATOM 93 N LYS A 371 -6.294 -2.143 0.003 1.00 0.00 N ATOM 94 CA LYS A 371 -5.881 -1.554 -1.263 1.00 0.00 C ATOM 95 C LYS A 371 -6.940 -0.564 -1.732 1.00 0.00 C ATOM 96 O LYS A 371 -6.665 0.352 -2.497 1.00 0.00 O ATOM 97 CB LYS A 371 -5.668 -2.649 -2.312 1.00 0.00 C ATOM 98 CG LYS A 371 -6.932 -3.418 -2.659 1.00 0.00 C ATOM 99 CD LYS A 371 -7.177 -4.562 -1.686 1.00 0.00 C ATOM 100 CE LYS A 371 -8.040 -5.648 -2.311 1.00 0.00 C ATOM 101 NZ LYS A 371 -9.493 -5.346 -2.184 1.00 0.00 N ATOM 0 H LYS A 371 -6.374 -3.160 -0.010 1.00 0.00 H new ATOM 0 HA LYS A 371 -4.938 -1.026 -1.124 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.268 -2.197 -3.220 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.917 -3.349 -1.946 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.786 -2.740 -2.647 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -6.852 -3.812 -3.672 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.223 -4.988 -1.375 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -7.664 -4.180 -0.788 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -7.782 -5.755 -3.365 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -7.825 -6.603 -1.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -10.046 -6.110 -2.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -9.745 -5.269 -1.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -9.704 -4.447 -2.663 1.00 0.00 H new ATOM 115 N ARG A 372 -8.146 -0.759 -1.225 1.00 0.00 N ATOM 116 CA ARG A 372 -9.263 0.114 -1.549 1.00 0.00 C ATOM 117 C ARG A 372 -9.265 1.325 -0.629 1.00 0.00 C ATOM 118 O ARG A 372 -9.218 2.468 -1.086 1.00 0.00 O ATOM 119 CB ARG A 372 -10.592 -0.638 -1.435 1.00 0.00 C ATOM 120 CG ARG A 372 -11.811 0.273 -1.400 1.00 0.00 C ATOM 121 CD ARG A 372 -12.586 0.225 -2.708 1.00 0.00 C ATOM 122 NE ARG A 372 -13.839 0.969 -2.623 1.00 0.00 N ATOM 123 CZ ARG A 372 -14.969 0.456 -2.145 1.00 0.00 C ATOM 124 NH1 ARG A 372 -15.008 -0.807 -1.748 1.00 0.00 N ATOM 125 NH2 ARG A 372 -16.061 1.205 -2.073 1.00 0.00 N ATOM 0 H ARG A 372 -8.378 -1.518 -0.584 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.148 0.451 -2.579 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.685 -1.322 -2.278 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.578 -1.246 -0.531 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.464 -0.024 -0.579 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.495 1.297 -1.202 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -11.972 0.637 -3.509 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -12.796 -0.812 -2.968 1.00 0.00 H new ATOM 0 HE ARG A 372 -13.848 1.936 -2.948 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -14.171 -1.387 -1.809 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -15.875 -1.200 -1.381 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -16.035 2.176 -2.384 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -16.927 0.810 -1.706 1.00 0.00 H new ATOM 139 N GLN A 373 -9.324 1.069 0.670 1.00 0.00 N ATOM 140 CA GLN A 373 -9.337 2.141 1.653 1.00 0.00 C ATOM 141 C GLN A 373 -8.095 3.018 1.507 1.00 0.00 C ATOM 142 O GLN A 373 -8.158 4.233 1.675 1.00 0.00 O ATOM 143 CB GLN A 373 -9.426 1.553 3.058 1.00 0.00 C ATOM 144 CG GLN A 373 -9.491 2.600 4.151 1.00 0.00 C ATOM 145 CD GLN A 373 -10.645 2.369 5.108 1.00 0.00 C ATOM 146 OE1 GLN A 373 -10.482 1.750 6.160 1.00 0.00 O ATOM 147 NE2 GLN A 373 -11.822 2.866 4.745 1.00 0.00 N ATOM 0 H GLN A 373 -9.364 0.130 1.066 1.00 0.00 H new ATOM 0 HA GLN A 373 -10.211 2.769 1.482 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -10.310 0.918 3.122 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.561 0.913 3.230 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -8.554 2.597 4.709 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.590 3.587 3.699 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -11.912 3.373 3.864 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -12.636 2.741 5.347 1.00 0.00 H new ATOM 156 N LEU A 374 -6.971 2.387 1.182 1.00 0.00 N ATOM 157 CA LEU A 374 -5.706 3.085 0.991 1.00 0.00 C ATOM 158 C LEU A 374 -5.739 3.879 -0.312 1.00 0.00 C ATOM 159 O LEU A 374 -5.615 5.104 -0.307 1.00 0.00 O ATOM 160 CB LEU A 374 -4.555 2.071 0.982 1.00 0.00 C ATOM 161 CG LEU A 374 -3.146 2.659 1.126 1.00 0.00 C ATOM 162 CD1 LEU A 374 -2.620 3.150 -0.209 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.130 3.779 2.154 1.00 0.00 C ATOM 0 H LEU A 374 -6.912 1.378 1.044 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.549 3.784 1.813 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.716 1.360 1.792 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.600 1.508 0.050 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.487 1.864 1.476 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -1.619 3.562 -0.077 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -2.580 2.318 -0.912 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.282 3.923 -0.599 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.120 4.181 2.239 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.810 4.571 1.840 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.448 3.390 3.121 1.00 0.00 H new ATOM 175 N TYR A 375 -5.921 3.174 -1.428 1.00 0.00 N ATOM 176 CA TYR A 375 -5.986 3.828 -2.736 1.00 0.00 C ATOM 177 C TYR A 375 -6.873 5.052 -2.653 1.00 0.00 C ATOM 178 O TYR A 375 -6.632 6.071 -3.298 1.00 0.00 O ATOM 179 CB TYR A 375 -6.543 2.874 -3.786 1.00 0.00 C ATOM 180 CG TYR A 375 -6.228 3.274 -5.211 1.00 0.00 C ATOM 181 CD1 TYR A 375 -5.019 3.878 -5.536 1.00 0.00 C ATOM 182 CD2 TYR A 375 -7.140 3.039 -6.234 1.00 0.00 C ATOM 183 CE1 TYR A 375 -4.729 4.237 -6.839 1.00 0.00 C ATOM 184 CE2 TYR A 375 -6.857 3.397 -7.538 1.00 0.00 C ATOM 185 CZ TYR A 375 -5.652 3.995 -7.835 1.00 0.00 C ATOM 186 OH TYR A 375 -5.367 4.349 -9.134 1.00 0.00 O ATOM 0 H TYR A 375 -6.025 2.160 -1.454 1.00 0.00 H new ATOM 0 HA TYR A 375 -4.977 4.122 -3.025 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -6.144 1.876 -3.603 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.625 2.812 -3.668 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.295 4.070 -4.758 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -8.085 2.569 -6.005 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -3.785 4.705 -7.076 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.577 3.209 -8.321 1.00 0.00 H new ATOM 0 HH TYR A 375 -6.121 4.109 -9.712 1.00 0.00 H new ATOM 196 N SER A 376 -7.894 4.928 -1.827 1.00 0.00 N ATOM 197 CA SER A 376 -8.840 6.011 -1.602 1.00 0.00 C ATOM 198 C SER A 376 -8.237 7.037 -0.653 1.00 0.00 C ATOM 199 O SER A 376 -8.237 8.238 -0.925 1.00 0.00 O ATOM 200 CB SER A 376 -10.141 5.464 -1.015 1.00 0.00 C ATOM 201 OG SER A 376 -10.893 6.494 -0.394 1.00 0.00 O ATOM 0 H SER A 376 -8.093 4.081 -1.295 1.00 0.00 H new ATOM 0 HA SER A 376 -9.058 6.490 -2.557 1.00 0.00 H new ATOM 0 HB2 SER A 376 -10.734 5.002 -1.804 1.00 0.00 H new ATOM 0 HB3 SER A 376 -9.916 4.684 -0.287 1.00 0.00 H new ATOM 0 HG SER A 376 -11.721 6.119 -0.028 1.00 0.00 H new ATOM 207 N LEU A 377 -7.732 6.538 0.468 1.00 0.00 N ATOM 208 CA LEU A 377 -7.126 7.371 1.491 1.00 0.00 C ATOM 209 C LEU A 377 -5.928 8.136 0.946 1.00 0.00 C ATOM 210 O LEU A 377 -5.895 9.366 0.984 1.00 0.00 O ATOM 211 CB LEU A 377 -6.689 6.498 2.668 1.00 0.00 C ATOM 212 CG LEU A 377 -7.806 6.110 3.636 1.00 0.00 C ATOM 213 CD1 LEU A 377 -7.457 4.818 4.358 1.00 0.00 C ATOM 214 CD2 LEU A 377 -8.054 7.230 4.635 1.00 0.00 C ATOM 0 H LEU A 377 -7.733 5.543 0.691 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.868 8.098 1.823 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.236 5.587 2.276 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.914 7.026 3.224 1.00 0.00 H new ATOM 0 HG LEU A 377 -8.720 5.949 3.065 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -8.263 4.555 5.044 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -7.325 4.018 3.629 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -6.532 4.953 4.919 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -8.852 6.939 5.318 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -7.143 7.420 5.202 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -8.345 8.135 4.102 1.00 0.00 H new ATOM 226 N ILE A 378 -4.940 7.402 0.454 1.00 0.00 N ATOM 227 CA ILE A 378 -3.735 8.018 -0.078 1.00 0.00 C ATOM 228 C ILE A 378 -3.685 7.940 -1.601 1.00 0.00 C ATOM 229 O ILE A 378 -3.368 8.923 -2.271 1.00 0.00 O ATOM 230 CB ILE A 378 -2.506 7.288 0.493 1.00 0.00 C ATOM 231 CG1 ILE A 378 -2.340 7.613 1.974 1.00 0.00 C ATOM 232 CG2 ILE A 378 -1.254 7.636 -0.288 1.00 0.00 C ATOM 233 CD1 ILE A 378 -1.251 6.811 2.654 1.00 0.00 C ATOM 0 H ILE A 378 -4.950 6.383 0.413 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.738 9.069 0.211 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.666 6.214 0.394 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -2.118 8.675 2.081 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -3.286 7.432 2.485 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.401 7.107 0.137 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -1.381 7.342 -1.330 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -1.078 8.710 -0.233 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -1.191 7.096 3.704 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.481 5.748 2.579 1.00 0.00 H new ATOM 0 HD13 ILE A 378 -0.295 7.011 2.169 1.00 0.00 H new ATOM 245 N GLY A 379 -3.966 6.762 -2.135 1.00 0.00 N ATOM 246 CA GLY A 379 -3.915 6.569 -3.569 1.00 0.00 C ATOM 247 C GLY A 379 -4.501 7.720 -4.355 1.00 0.00 C ATOM 248 O GLY A 379 -5.684 8.036 -4.220 1.00 0.00 O ATOM 0 H GLY A 379 -4.229 5.934 -1.600 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.878 6.424 -3.871 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -4.452 5.655 -3.824 1.00 0.00 H new ATOM 252 N TYR A 380 -3.675 8.334 -5.200 1.00 0.00 N ATOM 253 CA TYR A 380 -4.124 9.437 -6.038 1.00 0.00 C ATOM 254 C TYR A 380 -3.421 9.405 -7.397 1.00 0.00 C ATOM 255 O TYR A 380 -2.870 8.378 -7.791 1.00 0.00 O ATOM 256 CB TYR A 380 -3.938 10.788 -5.331 1.00 0.00 C ATOM 257 CG TYR A 380 -2.512 11.141 -4.971 1.00 0.00 C ATOM 258 CD1 TYR A 380 -1.586 11.456 -5.951 1.00 0.00 C ATOM 259 CD2 TYR A 380 -2.101 11.187 -3.645 1.00 0.00 C ATOM 260 CE1 TYR A 380 -0.289 11.802 -5.627 1.00 0.00 C ATOM 261 CE2 TYR A 380 -0.806 11.537 -3.312 1.00 0.00 C ATOM 262 CZ TYR A 380 0.096 11.842 -4.306 1.00 0.00 C ATOM 263 OH TYR A 380 1.386 12.189 -3.978 1.00 0.00 O ATOM 0 H TYR A 380 -2.693 8.085 -5.320 1.00 0.00 H new ATOM 0 HA TYR A 380 -5.193 9.315 -6.216 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -4.338 11.573 -5.973 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -4.535 10.787 -4.419 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -1.884 11.431 -6.989 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -2.804 10.945 -2.862 1.00 0.00 H new ATOM 0 HE1 TYR A 380 0.420 12.040 -6.406 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -0.503 11.571 -2.276 1.00 0.00 H new ATOM 0 HH TYR A 380 1.492 12.170 -3.004 1.00 0.00 H new ATOM 273 N ALA A 381 -3.475 10.515 -8.127 1.00 0.00 N ATOM 274 CA ALA A 381 -2.878 10.587 -9.461 1.00 0.00 C ATOM 275 C ALA A 381 -1.359 10.375 -9.462 1.00 0.00 C ATOM 276 O ALA A 381 -0.866 9.419 -10.062 1.00 0.00 O ATOM 277 CB ALA A 381 -3.213 11.918 -10.118 1.00 0.00 C ATOM 0 H ALA A 381 -3.925 11.377 -7.820 1.00 0.00 H new ATOM 0 HA ALA A 381 -3.311 9.766 -10.033 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -2.762 11.958 -11.110 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -4.295 12.018 -10.207 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -2.822 12.733 -9.509 1.00 0.00 H new ATOM 283 N SER A 382 -0.617 11.283 -8.830 1.00 0.00 N ATOM 284 CA SER A 382 0.845 11.198 -8.810 1.00 0.00 C ATOM 285 C SER A 382 1.387 10.364 -7.646 1.00 0.00 C ATOM 286 O SER A 382 2.552 10.509 -7.275 1.00 0.00 O ATOM 287 CB SER A 382 1.446 12.604 -8.750 1.00 0.00 C ATOM 288 OG SER A 382 2.604 12.700 -9.562 1.00 0.00 O ATOM 0 H SER A 382 -1.001 12.083 -8.327 1.00 0.00 H new ATOM 0 HA SER A 382 1.139 10.692 -9.730 1.00 0.00 H new ATOM 0 HB2 SER A 382 0.706 13.333 -9.079 1.00 0.00 H new ATOM 0 HB3 SER A 382 1.700 12.851 -7.719 1.00 0.00 H new ATOM 0 HG SER A 382 3.040 13.564 -9.409 1.00 0.00 H new ATOM 294 N LEU A 383 0.562 9.499 -7.066 1.00 0.00 N ATOM 295 CA LEU A 383 1.018 8.674 -5.948 1.00 0.00 C ATOM 296 C LEU A 383 1.424 7.276 -6.414 1.00 0.00 C ATOM 297 O LEU A 383 2.062 6.531 -5.673 1.00 0.00 O ATOM 298 CB LEU A 383 -0.061 8.573 -4.871 1.00 0.00 C ATOM 299 CG LEU A 383 0.415 7.957 -3.555 1.00 0.00 C ATOM 300 CD1 LEU A 383 0.131 8.886 -2.390 1.00 0.00 C ATOM 301 CD2 LEU A 383 -0.241 6.607 -3.330 1.00 0.00 C ATOM 0 H LEU A 383 -0.408 9.350 -7.343 1.00 0.00 H new ATOM 0 HA LEU A 383 1.896 9.160 -5.523 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -0.452 9.571 -4.671 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -0.889 7.978 -5.258 1.00 0.00 H new ATOM 0 HG LEU A 383 1.493 7.811 -3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.478 8.426 -1.465 1.00 0.00 H new ATOM 0 HD12 LEU A 383 0.652 9.831 -2.543 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -0.941 9.069 -2.324 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.110 6.184 -2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -1.323 6.730 -3.291 1.00 0.00 H new ATOM 0 HD23 LEU A 383 0.018 5.935 -4.148 1.00 0.00 H new ATOM 313 N ARG A 384 1.061 6.948 -7.650 1.00 0.00 N ATOM 314 CA ARG A 384 1.384 5.654 -8.257 1.00 0.00 C ATOM 315 C ARG A 384 1.714 4.573 -7.225 1.00 0.00 C ATOM 316 O ARG A 384 2.734 3.892 -7.345 1.00 0.00 O ATOM 317 CB ARG A 384 2.564 5.810 -9.218 1.00 0.00 C ATOM 318 CG ARG A 384 2.448 4.956 -10.470 1.00 0.00 C ATOM 319 CD ARG A 384 3.323 3.717 -10.380 1.00 0.00 C ATOM 320 NE ARG A 384 4.075 3.487 -11.611 1.00 0.00 N ATOM 321 CZ ARG A 384 4.976 2.520 -11.754 1.00 0.00 C ATOM 322 NH1 ARG A 384 5.237 1.699 -10.745 1.00 0.00 N ATOM 323 NH2 ARG A 384 5.617 2.375 -12.905 1.00 0.00 N ATOM 0 H ARG A 384 0.534 7.570 -8.263 1.00 0.00 H new ATOM 0 HA ARG A 384 0.492 5.330 -8.793 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.648 6.857 -9.509 1.00 0.00 H new ATOM 0 HB3 ARG A 384 3.484 5.550 -8.695 1.00 0.00 H new ATOM 0 HG2 ARG A 384 1.409 4.660 -10.615 1.00 0.00 H new ATOM 0 HG3 ARG A 384 2.736 5.544 -11.341 1.00 0.00 H new ATOM 0 HD2 ARG A 384 4.017 3.823 -9.546 1.00 0.00 H new ATOM 0 HD3 ARG A 384 2.700 2.848 -10.168 1.00 0.00 H new ATOM 0 HE ARG A 384 3.899 4.103 -12.405 1.00 0.00 H new ATOM 0 HH11 ARG A 384 4.746 1.809 -9.858 1.00 0.00 H new ATOM 0 HH12 ARG A 384 5.929 0.958 -10.857 1.00 0.00 H new ATOM 0 HH21 ARG A 384 5.419 3.006 -13.682 1.00 0.00 H new ATOM 0 HH22 ARG A 384 6.308 1.633 -13.014 1.00 0.00 H new ATOM 337 N LEU A 385 0.851 4.395 -6.229 1.00 0.00 N ATOM 338 CA LEU A 385 1.078 3.370 -5.217 1.00 0.00 C ATOM 339 C LEU A 385 0.963 1.986 -5.849 1.00 0.00 C ATOM 340 O LEU A 385 0.184 1.790 -6.782 1.00 0.00 O ATOM 341 CB LEU A 385 0.079 3.521 -4.065 1.00 0.00 C ATOM 342 CG LEU A 385 -1.359 3.821 -4.481 1.00 0.00 C ATOM 343 CD1 LEU A 385 -1.799 2.902 -5.608 1.00 0.00 C ATOM 344 CD2 LEU A 385 -2.279 3.684 -3.283 1.00 0.00 C ATOM 0 H LEU A 385 -0.002 4.940 -6.102 1.00 0.00 H new ATOM 0 HA LEU A 385 2.083 3.490 -4.812 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.086 2.603 -3.478 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.424 4.321 -3.410 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.412 4.846 -4.849 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -2.827 3.135 -5.887 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.147 3.046 -6.470 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.739 1.865 -5.277 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.304 3.899 -3.585 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.221 2.667 -2.894 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -1.974 4.387 -2.508 1.00 0.00 H new ATOM 356 N HIS A 386 1.738 1.025 -5.353 1.00 0.00 N ATOM 357 CA HIS A 386 1.697 -0.328 -5.900 1.00 0.00 C ATOM 358 C HIS A 386 2.102 -1.363 -4.860 1.00 0.00 C ATOM 359 O HIS A 386 2.693 -1.031 -3.832 1.00 0.00 O ATOM 360 CB HIS A 386 2.600 -0.446 -7.131 1.00 0.00 C ATOM 361 CG HIS A 386 4.068 -0.368 -6.830 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.823 -1.456 -6.428 1.00 0.00 N ATOM 363 CD2 HIS A 386 4.930 0.674 -6.904 1.00 0.00 C ATOM 364 CE1 HIS A 386 6.080 -1.082 -6.272 1.00 0.00 C ATOM 365 NE2 HIS A 386 6.171 0.204 -6.554 1.00 0.00 N ATOM 0 H HIS A 386 2.394 1.155 -4.583 1.00 0.00 H new ATOM 0 HA HIS A 386 0.667 -0.526 -6.196 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.393 -1.393 -7.629 1.00 0.00 H new ATOM 0 HB3 HIS A 386 2.342 0.347 -7.833 1.00 0.00 H new ATOM 0 HD2 HIS A 386 4.686 1.687 -7.186 1.00 0.00 H new ATOM 0 HE1 HIS A 386 6.895 -1.720 -5.966 1.00 0.00 H new ATOM 0 HE2 HIS A 386 7.026 0.759 -6.518 1.00 0.00 H new ATOM 374 N TYR A 387 1.775 -2.619 -5.140 1.00 0.00 N ATOM 375 CA TYR A 387 2.097 -3.714 -4.238 1.00 0.00 C ATOM 376 C TYR A 387 3.186 -4.600 -4.834 1.00 0.00 C ATOM 377 O TYR A 387 2.988 -5.251 -5.860 1.00 0.00 O ATOM 378 CB TYR A 387 0.836 -4.525 -3.934 1.00 0.00 C ATOM 379 CG TYR A 387 -0.350 -3.651 -3.592 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.554 -3.197 -2.295 1.00 0.00 C ATOM 381 CD2 TYR A 387 -1.251 -3.256 -4.573 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.620 -2.378 -1.985 1.00 0.00 C ATOM 383 CE2 TYR A 387 -2.323 -2.439 -4.270 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.502 -2.003 -2.975 1.00 0.00 C ATOM 385 OH TYR A 387 -3.562 -1.181 -2.668 1.00 0.00 O ATOM 0 H TYR A 387 1.285 -2.903 -5.988 1.00 0.00 H new ATOM 0 HA TYR A 387 2.478 -3.302 -3.304 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.590 -5.144 -4.797 1.00 0.00 H new ATOM 0 HB3 TYR A 387 1.035 -5.202 -3.103 1.00 0.00 H new ATOM 0 HD1 TYR A 387 0.134 -3.490 -1.516 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.111 -3.593 -5.589 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -1.762 -2.033 -0.972 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -3.017 -2.144 -5.043 1.00 0.00 H new ATOM 0 HH TYR A 387 -3.863 -0.719 -3.478 1.00 0.00 H new ATOM 395 N VAL A 388 4.338 -4.611 -4.177 1.00 0.00 N ATOM 396 CA VAL A 388 5.474 -5.405 -4.628 1.00 0.00 C ATOM 397 C VAL A 388 5.513 -6.752 -3.920 1.00 0.00 C ATOM 398 O VAL A 388 5.395 -6.819 -2.700 1.00 0.00 O ATOM 399 CB VAL A 388 6.807 -4.668 -4.391 1.00 0.00 C ATOM 400 CG1 VAL A 388 6.801 -3.965 -3.044 1.00 0.00 C ATOM 401 CG2 VAL A 388 7.977 -5.632 -4.486 1.00 0.00 C ATOM 0 H VAL A 388 4.511 -4.076 -3.326 1.00 0.00 H new ATOM 0 HA VAL A 388 5.346 -5.564 -5.699 1.00 0.00 H new ATOM 0 HB VAL A 388 6.921 -3.913 -5.169 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.751 -3.451 -2.897 1.00 0.00 H new ATOM 0 HG12 VAL A 388 5.988 -3.239 -3.016 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.659 -4.699 -2.251 1.00 0.00 H new ATOM 0 HG21 VAL A 388 8.908 -5.092 -4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 388 7.867 -6.413 -3.733 1.00 0.00 H new ATOM 0 HG23 VAL A 388 7.996 -6.084 -5.478 1.00 0.00 H new ATOM 411 N THR A 389 5.689 -7.821 -4.689 1.00 0.00 N ATOM 412 CA THR A 389 5.750 -9.161 -4.121 1.00 0.00 C ATOM 413 C THR A 389 7.190 -9.574 -3.843 1.00 0.00 C ATOM 414 O THR A 389 7.955 -9.861 -4.763 1.00 0.00 O ATOM 415 CB THR A 389 5.099 -10.203 -5.049 1.00 0.00 C ATOM 416 OG1 THR A 389 3.809 -9.769 -5.498 1.00 0.00 O ATOM 417 CG2 THR A 389 4.937 -11.540 -4.336 1.00 0.00 C ATOM 0 H THR A 389 5.791 -7.785 -5.703 1.00 0.00 H new ATOM 0 HA THR A 389 5.194 -9.129 -3.184 1.00 0.00 H new ATOM 0 HB THR A 389 5.761 -10.319 -5.907 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.456 -10.411 -6.148 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.475 -12.259 -5.012 1.00 0.00 H new ATOM 0 HG22 THR A 389 5.915 -11.909 -4.027 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.305 -11.410 -3.458 1.00 0.00 H new ATOM 425 N VAL A 390 7.549 -9.607 -2.564 1.00 0.00 N ATOM 426 CA VAL A 390 8.897 -9.992 -2.155 1.00 0.00 C ATOM 427 C VAL A 390 8.993 -11.501 -2.003 1.00 0.00 C ATOM 428 O VAL A 390 10.016 -12.109 -2.318 1.00 0.00 O ATOM 429 CB VAL A 390 9.320 -9.336 -0.822 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.544 -8.456 -1.023 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.178 -8.537 -0.216 1.00 0.00 C ATOM 0 H VAL A 390 6.926 -9.372 -1.792 1.00 0.00 H new ATOM 0 HA VAL A 390 9.569 -9.642 -2.938 1.00 0.00 H new ATOM 0 HB VAL A 390 9.578 -10.132 -0.124 1.00 0.00 H new ATOM 0 HG11 VAL A 390 10.826 -8.003 -0.073 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.370 -9.061 -1.396 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.314 -7.672 -1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.506 -8.087 0.721 1.00 0.00 H new ATOM 0 HG22 VAL A 390 7.875 -7.752 -0.909 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.333 -9.198 -0.025 1.00 0.00 H new ATOM 441 N LYS A 391 7.912 -12.101 -1.520 1.00 0.00 N ATOM 442 CA LYS A 391 7.861 -13.541 -1.326 1.00 0.00 C ATOM 443 C LYS A 391 6.466 -14.072 -1.642 1.00 0.00 C ATOM 444 O LYS A 391 5.475 -13.351 -1.542 1.00 0.00 O ATOM 445 CB LYS A 391 8.286 -13.900 0.110 1.00 0.00 C ATOM 446 CG LYS A 391 7.180 -14.473 0.988 1.00 0.00 C ATOM 447 CD LYS A 391 7.751 -15.276 2.146 1.00 0.00 C ATOM 448 CE LYS A 391 8.246 -16.639 1.686 1.00 0.00 C ATOM 449 NZ LYS A 391 9.285 -17.191 2.599 1.00 0.00 N ATOM 0 H LYS A 391 7.058 -11.610 -1.256 1.00 0.00 H new ATOM 0 HA LYS A 391 8.561 -14.016 -2.013 1.00 0.00 H new ATOM 0 HB2 LYS A 391 9.101 -14.622 0.061 1.00 0.00 H new ATOM 0 HB3 LYS A 391 8.682 -13.005 0.590 1.00 0.00 H new ATOM 0 HG2 LYS A 391 6.563 -13.662 1.375 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.530 -15.109 0.388 1.00 0.00 H new ATOM 0 HD2 LYS A 391 8.572 -14.724 2.603 1.00 0.00 H new ATOM 0 HD3 LYS A 391 6.987 -15.404 2.913 1.00 0.00 H new ATOM 0 HE2 LYS A 391 7.406 -17.331 1.632 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.655 -16.556 0.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 9.596 -18.120 2.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 10.098 -16.544 2.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 8.888 -17.295 3.554 1.00 0.00 H new ATOM 463 N LYS A 392 6.402 -15.341 -2.023 1.00 0.00 N ATOM 464 CA LYS A 392 5.138 -15.984 -2.356 1.00 0.00 C ATOM 465 C LYS A 392 5.100 -17.396 -1.794 1.00 0.00 C ATOM 466 O LYS A 392 6.108 -17.905 -1.310 1.00 0.00 O ATOM 467 CB LYS A 392 4.944 -16.036 -3.873 1.00 0.00 C ATOM 468 CG LYS A 392 6.054 -15.357 -4.659 1.00 0.00 C ATOM 469 CD LYS A 392 7.212 -16.308 -4.915 1.00 0.00 C ATOM 470 CE LYS A 392 7.754 -16.158 -6.328 1.00 0.00 C ATOM 471 NZ LYS A 392 6.720 -16.459 -7.356 1.00 0.00 N ATOM 0 H LYS A 392 7.217 -15.949 -2.109 1.00 0.00 H new ATOM 0 HA LYS A 392 4.333 -15.397 -1.914 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.876 -17.078 -4.185 1.00 0.00 H new ATOM 0 HB3 LYS A 392 3.994 -15.565 -4.124 1.00 0.00 H new ATOM 0 HG2 LYS A 392 5.661 -14.996 -5.609 1.00 0.00 H new ATOM 0 HG3 LYS A 392 6.411 -14.486 -4.110 1.00 0.00 H new ATOM 0 HD2 LYS A 392 8.008 -16.115 -4.196 1.00 0.00 H new ATOM 0 HD3 LYS A 392 6.882 -17.335 -4.758 1.00 0.00 H new ATOM 0 HE2 LYS A 392 8.121 -15.141 -6.470 1.00 0.00 H new ATOM 0 HE3 LYS A 392 8.605 -16.826 -6.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 7.177 -16.857 -8.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 6.040 -17.147 -6.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 6.220 -15.584 -7.612 1.00 0.00 H new ATOM 485 N PRO A 393 3.935 -18.052 -1.855 1.00 0.00 N ATOM 486 CA PRO A 393 3.783 -19.417 -1.352 1.00 0.00 C ATOM 487 C PRO A 393 4.768 -20.373 -2.017 1.00 0.00 C ATOM 488 O PRO A 393 4.904 -20.386 -3.241 1.00 0.00 O ATOM 489 CB PRO A 393 2.344 -19.785 -1.730 1.00 0.00 C ATOM 490 CG PRO A 393 1.646 -18.478 -1.901 1.00 0.00 C ATOM 491 CD PRO A 393 2.683 -17.521 -2.418 1.00 0.00 C ATOM 0 HA PRO A 393 3.980 -19.486 -0.282 1.00 0.00 H new ATOM 0 HB2 PRO A 393 2.314 -20.372 -2.648 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.873 -20.386 -0.952 1.00 0.00 H new ATOM 0 HG2 PRO A 393 0.815 -18.568 -2.600 1.00 0.00 H new ATOM 0 HG3 PRO A 393 1.231 -18.130 -0.955 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.707 -17.502 -3.508 1.00 0.00 H new ATOM 0 HD3 PRO A 393 2.492 -16.501 -2.085 1.00 0.00 H new ATOM 499 N THR A 394 5.455 -21.170 -1.208 1.00 0.00 N ATOM 500 CA THR A 394 6.426 -22.125 -1.723 1.00 0.00 C ATOM 501 C THR A 394 6.445 -23.395 -0.879 1.00 0.00 C ATOM 502 O THR A 394 5.832 -23.450 0.187 1.00 0.00 O ATOM 503 CB THR A 394 7.844 -21.522 -1.764 1.00 0.00 C ATOM 504 OG1 THR A 394 8.495 -21.635 -0.491 1.00 0.00 O ATOM 505 CG2 THR A 394 7.797 -20.052 -2.157 1.00 0.00 C ATOM 0 H THR A 394 5.357 -21.173 -0.193 1.00 0.00 H new ATOM 0 HA THR A 394 6.120 -22.372 -2.739 1.00 0.00 H new ATOM 0 HB THR A 394 8.408 -22.084 -2.508 1.00 0.00 H new ATOM 0 HG1 THR A 394 8.864 -20.764 -0.234 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.809 -19.649 -2.179 1.00 0.00 H new ATOM 0 HG22 THR A 394 7.346 -19.954 -3.144 1.00 0.00 H new ATOM 0 HG23 THR A 394 7.202 -19.500 -1.429 1.00 0.00 H new ATOM 513 N ALA A 395 7.148 -24.413 -1.362 1.00 0.00 N ATOM 514 CA ALA A 395 7.241 -25.681 -0.648 1.00 0.00 C ATOM 515 C ALA A 395 7.892 -25.496 0.717 1.00 0.00 C ATOM 516 O ALA A 395 7.439 -26.057 1.714 1.00 0.00 O ATOM 517 CB ALA A 395 8.011 -26.709 -1.464 1.00 0.00 C ATOM 0 H ALA A 395 7.661 -24.385 -2.243 1.00 0.00 H new ATOM 0 HA ALA A 395 6.226 -26.049 -0.496 1.00 0.00 H new ATOM 0 HB1 ALA A 395 8.066 -27.646 -0.910 1.00 0.00 H new ATOM 0 HB2 ALA A 395 7.500 -26.878 -2.412 1.00 0.00 H new ATOM 0 HB3 ALA A 395 9.019 -26.341 -1.656 1.00 0.00 H new ATOM 523 N VAL A 396 8.957 -24.706 0.753 1.00 0.00 N ATOM 524 CA VAL A 396 9.676 -24.444 1.990 1.00 0.00 C ATOM 525 C VAL A 396 8.881 -23.512 2.901 1.00 0.00 C ATOM 526 O VAL A 396 8.863 -23.681 4.121 1.00 0.00 O ATOM 527 CB VAL A 396 11.060 -23.825 1.698 1.00 0.00 C ATOM 528 CG1 VAL A 396 11.642 -24.412 0.422 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.975 -22.307 1.595 1.00 0.00 C ATOM 0 H VAL A 396 9.342 -24.234 -0.065 1.00 0.00 H new ATOM 0 HA VAL A 396 9.812 -25.398 2.498 1.00 0.00 H new ATOM 0 HB VAL A 396 11.720 -24.068 2.531 1.00 0.00 H new ATOM 0 HG11 VAL A 396 12.618 -23.966 0.229 1.00 0.00 H new ATOM 0 HG12 VAL A 396 11.752 -25.491 0.535 1.00 0.00 H new ATOM 0 HG13 VAL A 396 10.975 -24.200 -0.413 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.965 -21.900 1.389 1.00 0.00 H new ATOM 0 HG22 VAL A 396 10.296 -22.035 0.787 1.00 0.00 H new ATOM 0 HG23 VAL A 396 10.604 -21.899 2.535 1.00 0.00 H new ATOM 539 N ASP A 397 8.233 -22.528 2.293 1.00 0.00 N ATOM 540 CA ASP A 397 7.440 -21.557 3.036 1.00 0.00 C ATOM 541 C ASP A 397 6.207 -21.145 2.238 1.00 0.00 C ATOM 542 O ASP A 397 6.315 -20.467 1.216 1.00 0.00 O ATOM 543 CB ASP A 397 8.286 -20.323 3.359 1.00 0.00 C ATOM 544 CG ASP A 397 8.435 -20.097 4.851 1.00 0.00 C ATOM 545 OD1 ASP A 397 7.491 -19.561 5.468 1.00 0.00 O ATOM 546 OD2 ASP A 397 9.499 -20.452 5.402 1.00 0.00 O ATOM 0 H ASP A 397 8.241 -22.380 1.284 1.00 0.00 H new ATOM 0 HA ASP A 397 7.113 -22.021 3.967 1.00 0.00 H new ATOM 0 HB2 ASP A 397 9.273 -20.436 2.911 1.00 0.00 H new ATOM 0 HB3 ASP A 397 7.829 -19.444 2.905 1.00 0.00 H new ATOM 551 N PRO A 398 5.015 -21.554 2.695 1.00 0.00 N ATOM 552 CA PRO A 398 3.759 -21.231 2.025 1.00 0.00 C ATOM 553 C PRO A 398 3.245 -19.840 2.386 1.00 0.00 C ATOM 554 O PRO A 398 2.051 -19.650 2.617 1.00 0.00 O ATOM 555 CB PRO A 398 2.808 -22.310 2.540 1.00 0.00 C ATOM 556 CG PRO A 398 3.323 -22.669 3.895 1.00 0.00 C ATOM 557 CD PRO A 398 4.804 -22.367 3.905 1.00 0.00 C ATOM 0 HA PRO A 398 3.863 -21.214 0.940 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.784 -21.940 2.593 1.00 0.00 H new ATOM 0 HB3 PRO A 398 2.800 -23.177 1.879 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.808 -22.096 4.666 1.00 0.00 H new ATOM 0 HG3 PRO A 398 3.144 -23.723 4.108 1.00 0.00 H new ATOM 0 HD2 PRO A 398 5.094 -21.824 4.805 1.00 0.00 H new ATOM 0 HD3 PRO A 398 5.397 -23.281 3.879 1.00 0.00 H new ATOM 565 N ASN A 399 4.155 -18.871 2.435 1.00 0.00 N ATOM 566 CA ASN A 399 3.795 -17.497 2.769 1.00 0.00 C ATOM 567 C ASN A 399 4.179 -16.535 1.648 1.00 0.00 C ATOM 568 O ASN A 399 4.963 -16.878 0.763 1.00 0.00 O ATOM 569 CB ASN A 399 4.482 -17.070 4.068 1.00 0.00 C ATOM 570 CG ASN A 399 4.252 -18.054 5.199 1.00 0.00 C ATOM 571 OD1 ASN A 399 5.198 -18.527 5.827 1.00 0.00 O ATOM 572 ND2 ASN A 399 2.989 -18.365 5.463 1.00 0.00 N ATOM 0 H ASN A 399 5.148 -19.012 2.247 1.00 0.00 H new ATOM 0 HA ASN A 399 2.713 -17.460 2.900 1.00 0.00 H new ATOM 0 HB2 ASN A 399 5.553 -16.968 3.892 1.00 0.00 H new ATOM 0 HB3 ASN A 399 4.113 -16.088 4.364 1.00 0.00 H new ATOM 0 HD21 ASN A 399 2.771 -19.021 6.213 1.00 0.00 H new ATOM 0 HD22 ASN A 399 2.236 -17.948 4.916 1.00 0.00 H new ATOM 579 N SER A 400 3.631 -15.323 1.703 1.00 0.00 N ATOM 580 CA SER A 400 3.921 -14.297 0.707 1.00 0.00 C ATOM 581 C SER A 400 4.200 -12.963 1.391 1.00 0.00 C ATOM 582 O SER A 400 3.658 -12.681 2.459 1.00 0.00 O ATOM 583 CB SER A 400 2.748 -14.136 -0.265 1.00 0.00 C ATOM 584 OG SER A 400 3.151 -13.461 -1.444 1.00 0.00 O ATOM 0 H SER A 400 2.981 -15.028 2.431 1.00 0.00 H new ATOM 0 HA SER A 400 4.802 -14.609 0.147 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.348 -15.117 -0.522 1.00 0.00 H new ATOM 0 HB3 SER A 400 1.944 -13.581 0.219 1.00 0.00 H new ATOM 0 HG SER A 400 4.102 -13.233 -1.382 1.00 0.00 H new ATOM 590 N ILE A 401 5.036 -12.141 0.768 1.00 0.00 N ATOM 591 CA ILE A 401 5.365 -10.834 1.321 1.00 0.00 C ATOM 592 C ILE A 401 5.006 -9.729 0.337 1.00 0.00 C ATOM 593 O ILE A 401 5.082 -9.917 -0.878 1.00 0.00 O ATOM 594 CB ILE A 401 6.857 -10.721 1.690 1.00 0.00 C ATOM 595 CG1 ILE A 401 7.245 -11.837 2.676 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.149 -9.338 2.262 1.00 0.00 C ATOM 597 CD1 ILE A 401 7.703 -11.348 4.036 1.00 0.00 C ATOM 0 H ILE A 401 5.496 -12.355 -0.117 1.00 0.00 H new ATOM 0 HA ILE A 401 4.778 -10.720 2.232 1.00 0.00 H new ATOM 0 HB ILE A 401 7.463 -10.846 0.793 1.00 0.00 H new ATOM 0 HG12 ILE A 401 6.389 -12.497 2.812 1.00 0.00 H new ATOM 0 HG13 ILE A 401 8.041 -12.435 2.232 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.206 -9.267 2.520 1.00 0.00 H new ATOM 0 HG22 ILE A 401 6.905 -8.578 1.520 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.546 -9.179 3.156 1.00 0.00 H new ATOM 0 HD11 ILE A 401 7.955 -12.203 4.664 1.00 0.00 H new ATOM 0 HD12 ILE A 401 8.581 -10.713 3.918 1.00 0.00 H new ATOM 0 HD13 ILE A 401 6.902 -10.777 4.506 1.00 0.00 H new ATOM 609 N VAL A 402 4.624 -8.575 0.866 1.00 0.00 N ATOM 610 CA VAL A 402 4.264 -7.443 0.023 1.00 0.00 C ATOM 611 C VAL A 402 4.653 -6.112 0.653 1.00 0.00 C ATOM 612 O VAL A 402 4.599 -5.942 1.872 1.00 0.00 O ATOM 613 CB VAL A 402 2.759 -7.443 -0.318 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.308 -6.078 -0.822 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.450 -8.523 -1.346 1.00 0.00 C ATOM 0 H VAL A 402 4.555 -8.398 1.868 1.00 0.00 H new ATOM 0 HA VAL A 402 4.830 -7.559 -0.901 1.00 0.00 H new ATOM 0 HB VAL A 402 2.205 -7.660 0.595 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.243 -6.109 -1.054 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.490 -5.328 -0.052 1.00 0.00 H new ATOM 0 HG13 VAL A 402 2.868 -5.819 -1.721 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.385 -8.511 -1.577 1.00 0.00 H new ATOM 0 HG22 VAL A 402 3.021 -8.334 -2.255 1.00 0.00 H new ATOM 0 HG23 VAL A 402 2.723 -9.498 -0.943 1.00 0.00 H new ATOM 625 N GLU A 403 5.036 -5.171 -0.201 1.00 0.00 N ATOM 626 CA GLU A 403 5.431 -3.838 0.238 1.00 0.00 C ATOM 627 C GLU A 403 4.740 -2.780 -0.618 1.00 0.00 C ATOM 628 O GLU A 403 5.013 -2.657 -1.809 1.00 0.00 O ATOM 629 CB GLU A 403 6.951 -3.689 0.151 1.00 0.00 C ATOM 630 CG GLU A 403 7.697 -4.988 0.414 1.00 0.00 C ATOM 631 CD GLU A 403 9.153 -4.767 0.773 1.00 0.00 C ATOM 632 OE1 GLU A 403 9.631 -3.620 0.641 1.00 0.00 O ATOM 633 OE2 GLU A 403 9.816 -5.741 1.188 1.00 0.00 O ATOM 0 H GLU A 403 5.082 -5.308 -1.211 1.00 0.00 H new ATOM 0 HA GLU A 403 5.126 -3.698 1.275 1.00 0.00 H new ATOM 0 HB2 GLU A 403 7.217 -3.319 -0.839 1.00 0.00 H new ATOM 0 HB3 GLU A 403 7.278 -2.938 0.870 1.00 0.00 H new ATOM 0 HG2 GLU A 403 7.205 -5.526 1.224 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.638 -5.621 -0.471 1.00 0.00 H new ATOM 640 N CYS A 404 3.826 -2.028 -0.015 1.00 0.00 N ATOM 641 CA CYS A 404 3.096 -1.007 -0.748 1.00 0.00 C ATOM 642 C CYS A 404 3.963 0.212 -1.028 1.00 0.00 C ATOM 643 O CYS A 404 4.107 1.090 -0.180 1.00 0.00 O ATOM 644 CB CYS A 404 1.878 -0.573 0.061 1.00 0.00 C ATOM 645 SG CYS A 404 0.660 -1.880 0.321 1.00 0.00 S ATOM 0 H CYS A 404 3.576 -2.107 0.971 1.00 0.00 H new ATOM 0 HA CYS A 404 2.790 -1.436 -1.702 1.00 0.00 H new ATOM 0 HB2 CYS A 404 2.212 -0.205 1.031 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.396 0.262 -0.448 1.00 0.00 H new ATOM 0 HG CYS A 404 -0.059 -2.023 -0.752 1.00 0.00 H new ATOM 651 N ARG A 405 4.535 0.268 -2.222 1.00 0.00 N ATOM 652 CA ARG A 405 5.380 1.388 -2.597 1.00 0.00 C ATOM 653 C ARG A 405 4.557 2.483 -3.260 1.00 0.00 C ATOM 654 O ARG A 405 3.330 2.408 -3.318 1.00 0.00 O ATOM 655 CB ARG A 405 6.491 0.923 -3.536 1.00 0.00 C ATOM 656 CG ARG A 405 6.820 -0.553 -3.396 1.00 0.00 C ATOM 657 CD ARG A 405 8.209 -0.865 -3.926 1.00 0.00 C ATOM 658 NE ARG A 405 9.148 -1.165 -2.850 1.00 0.00 N ATOM 659 CZ ARG A 405 10.438 -1.411 -3.047 1.00 0.00 C ATOM 660 NH1 ARG A 405 10.943 -1.373 -4.273 1.00 0.00 N ATOM 661 NH2 ARG A 405 11.226 -1.690 -2.017 1.00 0.00 N ATOM 0 H ARG A 405 4.429 -0.446 -2.943 1.00 0.00 H new ATOM 0 HA ARG A 405 5.831 1.795 -1.692 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.195 1.126 -4.565 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.390 1.508 -3.341 1.00 0.00 H new ATOM 0 HG2 ARG A 405 6.755 -0.844 -2.347 1.00 0.00 H new ATOM 0 HG3 ARG A 405 6.081 -1.145 -3.937 1.00 0.00 H new ATOM 0 HD2 ARG A 405 8.155 -1.714 -4.608 1.00 0.00 H new ATOM 0 HD3 ARG A 405 8.577 -0.016 -4.502 1.00 0.00 H new ATOM 0 HE ARG A 405 8.794 -1.187 -1.894 1.00 0.00 H new ATOM 0 HH11 ARG A 405 10.340 -1.155 -5.066 1.00 0.00 H new ATOM 0 HH12 ARG A 405 11.934 -1.562 -4.422 1.00 0.00 H new ATOM 0 HH21 ARG A 405 10.841 -1.716 -1.073 1.00 0.00 H new ATOM 0 HH22 ARG A 405 12.217 -1.879 -2.169 1.00 0.00 H new ATOM 675 N VAL A 406 5.244 3.501 -3.754 1.00 0.00 N ATOM 676 CA VAL A 406 4.579 4.617 -4.407 1.00 0.00 C ATOM 677 C VAL A 406 5.513 5.311 -5.392 1.00 0.00 C ATOM 678 O VAL A 406 6.728 5.147 -5.323 1.00 0.00 O ATOM 679 CB VAL A 406 4.061 5.632 -3.372 1.00 0.00 C ATOM 680 CG1 VAL A 406 2.576 5.423 -3.129 1.00 0.00 C ATOM 681 CG2 VAL A 406 4.833 5.509 -2.066 1.00 0.00 C ATOM 0 H VAL A 406 6.260 3.577 -3.715 1.00 0.00 H new ATOM 0 HA VAL A 406 3.729 4.215 -4.958 1.00 0.00 H new ATOM 0 HB VAL A 406 4.214 6.636 -3.767 1.00 0.00 H new ATOM 0 HG11 VAL A 406 2.222 6.147 -2.395 1.00 0.00 H new ATOM 0 HG12 VAL A 406 2.032 5.558 -4.064 1.00 0.00 H new ATOM 0 HG13 VAL A 406 2.407 4.414 -2.754 1.00 0.00 H new ATOM 0 HG21 VAL A 406 4.451 6.235 -1.348 1.00 0.00 H new ATOM 0 HG22 VAL A 406 4.711 4.503 -1.665 1.00 0.00 H new ATOM 0 HG23 VAL A 406 5.890 5.701 -2.249 1.00 0.00 H new ATOM 691 N GLY A 407 4.936 6.075 -6.314 1.00 0.00 N ATOM 692 CA GLY A 407 5.733 6.772 -7.307 1.00 0.00 C ATOM 693 C GLY A 407 6.989 7.396 -6.725 1.00 0.00 C ATOM 694 O GLY A 407 8.000 7.524 -7.414 1.00 0.00 O ATOM 0 H GLY A 407 3.930 6.224 -6.391 1.00 0.00 H new ATOM 0 HA2 GLY A 407 6.012 6.074 -8.096 1.00 0.00 H new ATOM 0 HA3 GLY A 407 5.127 7.551 -7.770 1.00 0.00 H new ATOM 698 N ASP A 408 6.922 7.791 -5.459 1.00 0.00 N ATOM 699 CA ASP A 408 8.061 8.411 -4.790 1.00 0.00 C ATOM 700 C ASP A 408 9.159 7.389 -4.504 1.00 0.00 C ATOM 701 O ASP A 408 10.228 7.737 -4.002 1.00 0.00 O ATOM 702 CB ASP A 408 7.608 9.070 -3.486 1.00 0.00 C ATOM 703 CG ASP A 408 8.772 9.449 -2.592 1.00 0.00 C ATOM 704 OD1 ASP A 408 9.801 9.917 -3.123 1.00 0.00 O ATOM 705 OD2 ASP A 408 8.653 9.279 -1.360 1.00 0.00 O ATOM 0 H ASP A 408 6.092 7.693 -4.875 1.00 0.00 H new ATOM 0 HA ASP A 408 8.471 9.171 -5.456 1.00 0.00 H new ATOM 0 HB2 ASP A 408 7.026 9.962 -3.717 1.00 0.00 H new ATOM 0 HB3 ASP A 408 6.948 8.389 -2.949 1.00 0.00 H new ATOM 710 N GLY A 409 8.890 6.128 -4.827 1.00 0.00 N ATOM 711 CA GLY A 409 9.865 5.077 -4.598 1.00 0.00 C ATOM 712 C GLY A 409 10.049 4.777 -3.125 1.00 0.00 C ATOM 713 O GLY A 409 11.000 4.098 -2.736 1.00 0.00 O ATOM 0 H GLY A 409 8.013 5.815 -5.244 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.548 4.171 -5.114 1.00 0.00 H new ATOM 0 HA3 GLY A 409 10.822 5.371 -5.029 1.00 0.00 H new ATOM 717 N THR A 410 9.142 5.291 -2.302 1.00 0.00 N ATOM 718 CA THR A 410 9.212 5.082 -0.862 1.00 0.00 C ATOM 719 C THR A 410 8.219 4.025 -0.392 1.00 0.00 C ATOM 720 O THR A 410 7.036 4.078 -0.727 1.00 0.00 O ATOM 721 CB THR A 410 8.943 6.388 -0.093 1.00 0.00 C ATOM 722 OG1 THR A 410 9.855 7.424 -0.484 1.00 0.00 O ATOM 723 CG2 THR A 410 9.076 6.169 1.405 1.00 0.00 C ATOM 0 H THR A 410 8.350 5.856 -2.608 1.00 0.00 H new ATOM 0 HA THR A 410 10.224 4.736 -0.653 1.00 0.00 H new ATOM 0 HB THR A 410 7.925 6.694 -0.335 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.387 8.285 -0.493 1.00 0.00 H new ATOM 0 HG21 THR A 410 8.882 7.105 1.928 1.00 0.00 H new ATOM 0 HG22 THR A 410 8.356 5.417 1.728 1.00 0.00 H new ATOM 0 HG23 THR A 410 10.085 5.828 1.635 1.00 0.00 H new ATOM 731 N VAL A 411 8.703 3.078 0.404 1.00 0.00 N ATOM 732 CA VAL A 411 7.847 2.029 0.937 1.00 0.00 C ATOM 733 C VAL A 411 6.735 2.643 1.778 1.00 0.00 C ATOM 734 O VAL A 411 6.944 2.995 2.938 1.00 0.00 O ATOM 735 CB VAL A 411 8.641 1.029 1.801 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.768 -0.151 2.194 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.886 0.557 1.066 1.00 0.00 C ATOM 0 H VAL A 411 9.679 3.016 0.692 1.00 0.00 H new ATOM 0 HA VAL A 411 7.423 1.489 0.090 1.00 0.00 H new ATOM 0 HB VAL A 411 8.955 1.538 2.712 1.00 0.00 H new ATOM 0 HG11 VAL A 411 8.347 -0.845 2.803 1.00 0.00 H new ATOM 0 HG12 VAL A 411 6.911 0.205 2.765 1.00 0.00 H new ATOM 0 HG13 VAL A 411 7.419 -0.661 1.296 1.00 0.00 H new ATOM 0 HG21 VAL A 411 10.433 -0.148 1.692 1.00 0.00 H new ATOM 0 HG22 VAL A 411 9.596 0.067 0.136 1.00 0.00 H new ATOM 0 HG23 VAL A 411 10.523 1.413 0.842 1.00 0.00 H new ATOM 747 N LEU A 412 5.558 2.782 1.179 1.00 0.00 N ATOM 748 CA LEU A 412 4.418 3.363 1.857 1.00 0.00 C ATOM 749 C LEU A 412 3.810 2.362 2.830 1.00 0.00 C ATOM 750 O LEU A 412 3.329 2.731 3.901 1.00 0.00 O ATOM 751 CB LEU A 412 3.394 3.812 0.810 1.00 0.00 C ATOM 752 CG LEU A 412 1.951 3.931 1.290 1.00 0.00 C ATOM 753 CD1 LEU A 412 1.869 4.822 2.513 1.00 0.00 C ATOM 754 CD2 LEU A 412 1.074 4.481 0.179 1.00 0.00 C ATOM 0 H LEU A 412 5.373 2.496 0.217 1.00 0.00 H new ATOM 0 HA LEU A 412 4.736 4.229 2.437 1.00 0.00 H new ATOM 0 HB2 LEU A 412 3.706 4.780 0.418 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.422 3.108 -0.021 1.00 0.00 H new ATOM 0 HG LEU A 412 1.593 2.938 1.562 1.00 0.00 H new ATOM 0 HD11 LEU A 412 0.832 4.895 2.841 1.00 0.00 H new ATOM 0 HD12 LEU A 412 2.474 4.397 3.314 1.00 0.00 H new ATOM 0 HD13 LEU A 412 2.242 5.816 2.265 1.00 0.00 H new ATOM 0 HD21 LEU A 412 0.046 4.562 0.533 1.00 0.00 H new ATOM 0 HD22 LEU A 412 1.435 5.467 -0.115 1.00 0.00 H new ATOM 0 HD23 LEU A 412 1.111 3.810 -0.679 1.00 0.00 H new ATOM 766 N GLY A 413 3.843 1.089 2.450 1.00 0.00 N ATOM 767 CA GLY A 413 3.297 0.049 3.297 1.00 0.00 C ATOM 768 C GLY A 413 4.027 -1.269 3.160 1.00 0.00 C ATOM 769 O GLY A 413 4.910 -1.421 2.316 1.00 0.00 O ATOM 0 H GLY A 413 4.239 0.760 1.569 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.339 0.375 4.336 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.245 -0.097 3.051 1.00 0.00 H new ATOM 773 N THR A 414 3.649 -2.221 3.999 1.00 0.00 N ATOM 774 CA THR A 414 4.244 -3.548 3.994 1.00 0.00 C ATOM 775 C THR A 414 3.315 -4.525 4.699 1.00 0.00 C ATOM 776 O THR A 414 2.688 -4.177 5.699 1.00 0.00 O ATOM 777 CB THR A 414 5.619 -3.561 4.687 1.00 0.00 C ATOM 778 OG1 THR A 414 6.467 -2.521 4.182 1.00 0.00 O ATOM 779 CG2 THR A 414 6.316 -4.895 4.477 1.00 0.00 C ATOM 0 H THR A 414 2.921 -2.095 4.702 1.00 0.00 H new ATOM 0 HA THR A 414 4.388 -3.845 2.955 1.00 0.00 H new ATOM 0 HB THR A 414 5.441 -3.398 5.750 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.195 -2.292 3.269 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.285 -4.881 4.975 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.704 -5.695 4.895 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.459 -5.067 3.410 1.00 0.00 H new ATOM 787 N GLY A 415 3.213 -5.744 4.182 1.00 0.00 N ATOM 788 CA GLY A 415 2.339 -6.719 4.800 1.00 0.00 C ATOM 789 C GLY A 415 2.559 -8.126 4.282 1.00 0.00 C ATOM 790 O GLY A 415 2.805 -8.330 3.092 1.00 0.00 O ATOM 0 H GLY A 415 3.714 -6.071 3.356 1.00 0.00 H new ATOM 0 HA2 GLY A 415 2.496 -6.707 5.879 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.302 -6.432 4.625 1.00 0.00 H new ATOM 794 N VAL A 416 2.462 -9.096 5.182 1.00 0.00 N ATOM 795 CA VAL A 416 2.639 -10.494 4.831 1.00 0.00 C ATOM 796 C VAL A 416 1.296 -11.224 4.858 1.00 0.00 C ATOM 797 O VAL A 416 0.440 -10.932 5.693 1.00 0.00 O ATOM 798 CB VAL A 416 3.633 -11.179 5.799 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.370 -12.673 5.900 1.00 0.00 C ATOM 800 CG2 VAL A 416 5.066 -10.914 5.363 1.00 0.00 C ATOM 0 H VAL A 416 2.260 -8.935 6.169 1.00 0.00 H new ATOM 0 HA VAL A 416 3.047 -10.542 3.822 1.00 0.00 H new ATOM 0 HB VAL A 416 3.485 -10.750 6.790 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.086 -13.123 6.588 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.358 -12.840 6.269 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.477 -13.129 4.916 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.753 -11.403 6.054 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.220 -11.309 4.359 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.254 -9.840 5.363 1.00 0.00 H new ATOM 810 N GLY A 417 1.119 -12.173 3.946 1.00 0.00 N ATOM 811 CA GLY A 417 -0.120 -12.926 3.894 1.00 0.00 C ATOM 812 C GLY A 417 0.034 -14.245 3.164 1.00 0.00 C ATOM 813 O GLY A 417 0.972 -14.426 2.387 1.00 0.00 O ATOM 0 H GLY A 417 1.810 -12.434 3.243 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.470 -13.115 4.909 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.885 -12.327 3.399 1.00 0.00 H new ATOM 817 N ARG A 418 -0.891 -15.169 3.406 1.00 0.00 N ATOM 818 CA ARG A 418 -0.848 -16.472 2.756 1.00 0.00 C ATOM 819 C ARG A 418 -0.494 -16.313 1.284 1.00 0.00 C ATOM 820 O ARG A 418 0.368 -17.016 0.758 1.00 0.00 O ATOM 821 CB ARG A 418 -2.194 -17.181 2.899 1.00 0.00 C ATOM 822 CG ARG A 418 -3.367 -16.347 2.416 1.00 0.00 C ATOM 823 CD ARG A 418 -4.590 -16.528 3.300 1.00 0.00 C ATOM 824 NE ARG A 418 -5.272 -17.794 3.043 1.00 0.00 N ATOM 825 CZ ARG A 418 -6.099 -17.992 2.021 1.00 0.00 C ATOM 826 NH1 ARG A 418 -6.333 -17.017 1.153 1.00 0.00 N ATOM 827 NH2 ARG A 418 -6.692 -19.168 1.866 1.00 0.00 N ATOM 0 H ARG A 418 -1.676 -15.039 4.045 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.081 -17.077 3.239 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -2.166 -18.115 2.338 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.350 -17.442 3.946 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -3.083 -15.295 2.400 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.614 -16.626 1.392 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.290 -16.485 4.347 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.283 -15.703 3.133 1.00 0.00 H new ATOM 0 HE ARG A 418 -5.104 -18.570 3.684 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -5.878 -16.111 1.268 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -6.968 -17.173 0.370 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -6.514 -19.921 2.531 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -7.326 -19.320 1.082 1.00 0.00 H new ATOM 841 N ASN A 419 -1.161 -15.370 0.636 1.00 0.00 N ATOM 842 CA ASN A 419 -0.925 -15.087 -0.772 1.00 0.00 C ATOM 843 C ASN A 419 -0.595 -13.612 -0.959 1.00 0.00 C ATOM 844 O ASN A 419 -0.719 -12.819 -0.026 1.00 0.00 O ATOM 845 CB ASN A 419 -2.155 -15.457 -1.605 1.00 0.00 C ATOM 846 CG ASN A 419 -1.786 -16.095 -2.930 1.00 0.00 C ATOM 847 OD1 ASN A 419 -0.656 -15.965 -3.401 1.00 0.00 O ATOM 848 ND2 ASN A 419 -2.739 -16.790 -3.538 1.00 0.00 N ATOM 0 H ASN A 419 -1.876 -14.783 1.067 1.00 0.00 H new ATOM 0 HA ASN A 419 -0.081 -15.687 -1.111 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -2.782 -16.144 -1.036 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -2.748 -14.561 -1.789 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -2.549 -17.243 -4.432 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -3.662 -16.872 -3.111 1.00 0.00 H new ATOM 855 N ILE A 420 -0.176 -13.246 -2.164 1.00 0.00 N ATOM 856 CA ILE A 420 0.167 -11.862 -2.456 1.00 0.00 C ATOM 857 C ILE A 420 -0.996 -10.925 -2.138 1.00 0.00 C ATOM 858 O ILE A 420 -0.814 -9.714 -2.027 1.00 0.00 O ATOM 859 CB ILE A 420 0.582 -11.681 -3.931 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.009 -12.187 -4.137 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.469 -10.220 -4.347 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.105 -13.354 -5.098 1.00 0.00 C ATOM 0 H ILE A 420 -0.066 -13.886 -2.951 1.00 0.00 H new ATOM 0 HA ILE A 420 1.014 -11.606 -1.820 1.00 0.00 H new ATOM 0 HB ILE A 420 -0.093 -12.264 -4.557 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.626 -11.369 -4.509 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.423 -12.485 -3.174 1.00 0.00 H new ATOM 0 HG21 ILE A 420 0.766 -10.115 -5.390 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.562 -9.886 -4.228 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.122 -9.612 -3.721 1.00 0.00 H new ATOM 0 HD11 ILE A 420 3.147 -13.660 -5.196 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.516 -14.188 -4.717 1.00 0.00 H new ATOM 0 HD13 ILE A 420 1.722 -13.054 -6.074 1.00 0.00 H new ATOM 874 N LYS A 421 -2.185 -11.491 -1.984 1.00 0.00 N ATOM 875 CA LYS A 421 -3.350 -10.693 -1.667 1.00 0.00 C ATOM 876 C LYS A 421 -3.368 -10.355 -0.188 1.00 0.00 C ATOM 877 O LYS A 421 -3.371 -9.187 0.191 1.00 0.00 O ATOM 878 CB LYS A 421 -4.621 -11.433 -2.050 1.00 0.00 C ATOM 879 CG LYS A 421 -5.880 -10.712 -1.619 1.00 0.00 C ATOM 880 CD LYS A 421 -5.730 -9.208 -1.764 1.00 0.00 C ATOM 881 CE LYS A 421 -5.563 -8.810 -3.217 1.00 0.00 C ATOM 882 NZ LYS A 421 -6.814 -8.237 -3.786 1.00 0.00 N ATOM 0 H LYS A 421 -2.363 -12.491 -2.073 1.00 0.00 H new ATOM 0 HA LYS A 421 -3.301 -9.767 -2.239 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.641 -11.573 -3.131 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.606 -12.426 -1.600 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.722 -11.055 -2.220 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -6.106 -10.959 -0.582 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.606 -8.711 -1.347 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.867 -8.869 -1.190 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -4.758 -8.080 -3.303 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -5.266 -9.682 -3.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -7.118 -8.807 -4.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.560 -8.244 -3.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -6.639 -7.259 -4.094 1.00 0.00 H new ATOM 896 N ILE A 422 -3.372 -11.378 0.646 1.00 0.00 N ATOM 897 CA ILE A 422 -3.382 -11.170 2.083 1.00 0.00 C ATOM 898 C ILE A 422 -2.227 -10.282 2.490 1.00 0.00 C ATOM 899 O ILE A 422 -2.357 -9.447 3.386 1.00 0.00 O ATOM 900 CB ILE A 422 -3.313 -12.498 2.842 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.551 -13.344 2.534 1.00 0.00 C ATOM 902 CG2 ILE A 422 -3.190 -12.251 4.338 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.749 -12.543 2.048 1.00 0.00 C ATOM 0 H ILE A 422 -3.369 -12.356 0.356 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.322 -10.682 2.342 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.428 -13.044 2.514 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -4.292 -14.084 1.777 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.835 -13.892 3.432 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -3.142 -13.206 4.862 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -2.283 -11.681 4.539 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -4.057 -11.689 4.686 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.583 -13.218 1.853 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -6.038 -11.821 2.812 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.486 -12.016 1.131 1.00 0.00 H new ATOM 915 N ALA A 423 -1.106 -10.436 1.803 1.00 0.00 N ATOM 916 CA ALA A 423 0.045 -9.607 2.076 1.00 0.00 C ATOM 917 C ALA A 423 -0.262 -8.201 1.590 1.00 0.00 C ATOM 918 O ALA A 423 -0.149 -7.228 2.334 1.00 0.00 O ATOM 919 CB ALA A 423 1.301 -10.149 1.412 1.00 0.00 C ATOM 0 H ALA A 423 -0.974 -11.122 1.060 1.00 0.00 H new ATOM 0 HA ALA A 423 0.241 -9.602 3.148 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.144 -9.497 1.642 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.506 -11.152 1.785 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.155 -10.186 0.333 1.00 0.00 H new ATOM 925 N GLY A 424 -0.691 -8.118 0.333 1.00 0.00 N ATOM 926 CA GLY A 424 -1.057 -6.843 -0.246 1.00 0.00 C ATOM 927 C GLY A 424 -2.102 -6.149 0.600 1.00 0.00 C ATOM 928 O GLY A 424 -1.973 -4.965 0.915 1.00 0.00 O ATOM 0 H GLY A 424 -0.791 -8.916 -0.294 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -0.173 -6.210 -0.332 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -1.441 -6.993 -1.255 1.00 0.00 H new ATOM 932 N ILE A 425 -3.127 -6.902 1.000 1.00 0.00 N ATOM 933 CA ILE A 425 -4.171 -6.355 1.848 1.00 0.00 C ATOM 934 C ILE A 425 -3.531 -5.749 3.091 1.00 0.00 C ATOM 935 O ILE A 425 -3.624 -4.547 3.343 1.00 0.00 O ATOM 936 CB ILE A 425 -5.179 -7.438 2.298 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.925 -8.016 1.098 1.00 0.00 C ATOM 938 CG2 ILE A 425 -6.162 -6.861 3.306 1.00 0.00 C ATOM 939 CD1 ILE A 425 -6.223 -9.492 1.229 1.00 0.00 C ATOM 0 H ILE A 425 -3.251 -7.883 0.750 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.710 -5.604 1.270 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.623 -8.245 2.775 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.862 -7.474 0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -5.333 -7.851 0.198 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.865 -7.635 3.613 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.618 -6.498 4.178 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.708 -6.035 2.850 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.754 -9.836 0.342 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -5.289 -10.044 1.330 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.841 -9.662 2.110 1.00 0.00 H new ATOM 951 N ARG A 426 -2.881 -6.616 3.861 1.00 0.00 N ATOM 952 CA ARG A 426 -2.210 -6.219 5.093 1.00 0.00 C ATOM 953 C ARG A 426 -1.287 -5.021 4.875 1.00 0.00 C ATOM 954 O ARG A 426 -1.188 -4.148 5.734 1.00 0.00 O ATOM 955 CB ARG A 426 -1.417 -7.398 5.647 1.00 0.00 C ATOM 956 CG ARG A 426 -1.519 -7.551 7.156 1.00 0.00 C ATOM 957 CD ARG A 426 -0.911 -8.864 7.626 1.00 0.00 C ATOM 958 NE ARG A 426 0.376 -8.666 8.284 1.00 0.00 N ATOM 959 CZ ARG A 426 0.505 -8.248 9.539 1.00 0.00 C ATOM 960 NH1 ARG A 426 -0.571 -7.975 10.263 1.00 0.00 N ATOM 961 NH2 ARG A 426 1.712 -8.099 10.069 1.00 0.00 N ATOM 0 H ARG A 426 -2.805 -7.611 3.649 1.00 0.00 H new ATOM 0 HA ARG A 426 -2.973 -5.919 5.811 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.768 -8.315 5.174 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.369 -7.280 5.373 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -1.010 -6.719 7.642 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -2.565 -7.505 7.457 1.00 0.00 H new ATOM 0 HD2 ARG A 426 -1.598 -9.356 8.314 1.00 0.00 H new ATOM 0 HD3 ARG A 426 -0.783 -9.530 6.773 1.00 0.00 H new ATOM 0 HE ARG A 426 1.224 -8.859 7.751 1.00 0.00 H new ATOM 0 HH11 ARG A 426 -1.500 -8.086 9.857 1.00 0.00 H new ATOM 0 HH12 ARG A 426 -0.470 -7.654 11.226 1.00 0.00 H new ATOM 0 HH21 ARG A 426 2.542 -8.305 9.513 1.00 0.00 H new ATOM 0 HH22 ARG A 426 1.810 -7.778 11.032 1.00 0.00 H new ATOM 975 N ALA A 427 -0.614 -4.983 3.730 1.00 0.00 N ATOM 976 CA ALA A 427 0.295 -3.881 3.418 1.00 0.00 C ATOM 977 C ALA A 427 -0.488 -2.601 3.155 1.00 0.00 C ATOM 978 O ALA A 427 -0.314 -1.596 3.842 1.00 0.00 O ATOM 979 CB ALA A 427 1.173 -4.214 2.219 1.00 0.00 C ATOM 0 H ALA A 427 -0.679 -5.697 3.005 1.00 0.00 H new ATOM 0 HA ALA A 427 0.942 -3.728 4.282 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.838 -3.376 2.011 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.766 -5.102 2.438 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.544 -4.403 1.349 1.00 0.00 H new ATOM 985 N ALA A 428 -1.351 -2.649 2.150 1.00 0.00 N ATOM 986 CA ALA A 428 -2.158 -1.491 1.795 1.00 0.00 C ATOM 987 C ALA A 428 -2.668 -0.860 3.076 1.00 0.00 C ATOM 988 O ALA A 428 -2.512 0.338 3.311 1.00 0.00 O ATOM 989 CB ALA A 428 -3.311 -1.880 0.890 1.00 0.00 C ATOM 0 H ALA A 428 -1.510 -3.472 1.569 1.00 0.00 H new ATOM 0 HA ALA A 428 -1.549 -0.776 1.242 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.895 -0.993 0.643 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.921 -2.325 -0.026 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.947 -2.602 1.401 1.00 0.00 H new ATOM 995 N GLU A 429 -3.243 -1.704 3.913 1.00 0.00 N ATOM 996 CA GLU A 429 -3.752 -1.297 5.207 1.00 0.00 C ATOM 997 C GLU A 429 -2.607 -0.803 6.079 1.00 0.00 C ATOM 998 O GLU A 429 -2.688 0.246 6.700 1.00 0.00 O ATOM 999 CB GLU A 429 -4.425 -2.493 5.861 1.00 0.00 C ATOM 1000 CG GLU A 429 -5.807 -2.192 6.409 1.00 0.00 C ATOM 1001 CD GLU A 429 -5.776 -1.718 7.849 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -5.519 -2.552 8.743 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -6.008 -0.513 8.084 1.00 0.00 O ATOM 0 H GLU A 429 -3.370 -2.696 3.712 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.472 -0.488 5.087 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -4.501 -3.299 5.132 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -3.793 -2.855 6.672 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -6.280 -1.430 5.790 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -6.424 -3.088 6.339 1.00 0.00 H new ATOM 1010 N ASN A 430 -1.540 -1.583 6.101 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.364 -1.234 6.887 1.00 0.00 C ATOM 1012 C ASN A 430 -0.028 0.225 6.641 1.00 0.00 C ATOM 1013 O ASN A 430 0.017 1.034 7.568 1.00 0.00 O ATOM 1014 CB ASN A 430 0.814 -2.119 6.511 1.00 0.00 C ATOM 1015 CG ASN A 430 2.126 -1.600 7.064 1.00 0.00 C ATOM 1016 OD1 ASN A 430 2.694 -0.637 6.548 1.00 0.00 O ATOM 1017 ND2 ASN A 430 2.615 -2.237 8.121 1.00 0.00 N ATOM 0 H ASN A 430 -1.461 -2.460 5.586 1.00 0.00 H new ATOM 0 HA ASN A 430 -0.575 -1.390 7.945 1.00 0.00 H new ATOM 0 HB2 ASN A 430 0.640 -3.129 6.883 1.00 0.00 H new ATOM 0 HB3 ASN A 430 0.882 -2.187 5.425 1.00 0.00 H new ATOM 0 HD21 ASN A 430 3.495 -1.933 8.538 1.00 0.00 H new ATOM 0 HD22 ASN A 430 2.111 -3.031 8.516 1.00 0.00 H new ATOM 1024 N ALA A 431 0.160 0.559 5.374 1.00 0.00 N ATOM 1025 CA ALA A 431 0.440 1.927 4.980 1.00 0.00 C ATOM 1026 C ALA A 431 -0.737 2.799 5.378 1.00 0.00 C ATOM 1027 O ALA A 431 -0.580 3.938 5.820 1.00 0.00 O ATOM 1028 CB ALA A 431 0.670 2.007 3.478 1.00 0.00 C ATOM 0 H ALA A 431 0.123 -0.103 4.599 1.00 0.00 H new ATOM 0 HA ALA A 431 1.343 2.276 5.481 1.00 0.00 H new ATOM 0 HB1 ALA A 431 0.879 3.039 3.196 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.517 1.378 3.206 1.00 0.00 H new ATOM 0 HB3 ALA A 431 -0.221 1.661 2.954 1.00 0.00 H new ATOM 1034 N LEU A 432 -1.923 2.231 5.203 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.181 2.893 5.516 1.00 0.00 C ATOM 1036 C LEU A 432 -3.302 3.255 6.993 1.00 0.00 C ATOM 1037 O LEU A 432 -3.740 4.349 7.345 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.315 1.944 5.149 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.668 2.588 4.897 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.548 1.621 4.130 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -6.323 2.992 6.209 1.00 0.00 C ATOM 0 H LEU A 432 -2.039 1.287 4.835 1.00 0.00 H new ATOM 0 HA LEU A 432 -3.226 3.823 4.949 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.025 1.392 4.255 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -4.426 1.215 5.951 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.531 3.492 4.304 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.520 2.080 3.947 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -6.077 1.377 3.178 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -6.681 0.709 4.713 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -7.291 3.451 6.006 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -6.464 2.109 6.832 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -5.685 3.706 6.730 1.00 0.00 H new ATOM 1053 N ARG A 433 -2.943 2.309 7.847 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.039 2.485 9.287 1.00 0.00 C ATOM 1055 C ARG A 433 -2.231 3.682 9.783 1.00 0.00 C ATOM 1056 O ARG A 433 -2.370 4.096 10.934 1.00 0.00 O ATOM 1057 CB ARG A 433 -2.597 1.198 9.977 1.00 0.00 C ATOM 1058 CG ARG A 433 -3.601 0.070 9.804 1.00 0.00 C ATOM 1059 CD ARG A 433 -2.913 -1.253 9.519 1.00 0.00 C ATOM 1060 NE ARG A 433 -2.653 -2.016 10.736 1.00 0.00 N ATOM 1061 CZ ARG A 433 -1.990 -3.169 10.751 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -1.522 -3.683 9.623 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -1.796 -3.809 11.898 1.00 0.00 N ATOM 0 H ARG A 433 -2.578 1.400 7.562 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.078 2.697 9.538 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -1.633 0.887 9.575 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -2.452 1.391 11.040 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -4.206 -0.021 10.706 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -4.281 0.310 8.987 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -3.534 -1.846 8.847 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -1.972 -1.066 9.002 1.00 0.00 H new ATOM 0 HE ARG A 433 -2.998 -1.645 11.622 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -1.670 -3.194 8.740 1.00 0.00 H new ATOM 0 HH12 ARG A 433 -1.014 -4.567 9.638 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -2.155 -3.417 12.768 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -1.288 -4.693 11.909 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.401 4.244 8.915 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.594 5.397 9.272 1.00 0.00 C ATOM 1079 C ASP A 434 -1.230 6.685 8.742 1.00 0.00 C ATOM 1080 O ASP A 434 -1.221 6.941 7.539 1.00 0.00 O ATOM 1081 CB ASP A 434 0.818 5.236 8.718 1.00 0.00 C ATOM 1082 CG ASP A 434 1.611 4.176 9.458 1.00 0.00 C ATOM 1083 OD1 ASP A 434 1.113 3.038 9.580 1.00 0.00 O ATOM 1084 OD2 ASP A 434 2.731 4.486 9.916 1.00 0.00 O ATOM 0 H ASP A 434 -1.271 3.918 7.957 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.542 5.464 10.359 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.763 4.974 7.661 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.342 6.190 8.783 1.00 0.00 H new ATOM 1089 N LYS A 435 -1.776 7.489 9.651 1.00 0.00 N ATOM 1090 CA LYS A 435 -2.412 8.752 9.275 1.00 0.00 C ATOM 1091 C LYS A 435 -1.382 9.731 8.739 1.00 0.00 C ATOM 1092 O LYS A 435 -1.508 10.229 7.622 1.00 0.00 O ATOM 1093 CB LYS A 435 -3.143 9.361 10.472 1.00 0.00 C ATOM 1094 CG LYS A 435 -4.172 10.406 10.079 1.00 0.00 C ATOM 1095 CD LYS A 435 -5.590 9.917 10.326 1.00 0.00 C ATOM 1096 CE LYS A 435 -6.132 9.152 9.130 1.00 0.00 C ATOM 1097 NZ LYS A 435 -7.616 9.044 9.166 1.00 0.00 N ATOM 0 H LYS A 435 -1.792 7.290 10.651 1.00 0.00 H new ATOM 0 HA LYS A 435 -3.138 8.546 8.489 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -3.638 8.566 11.030 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -2.413 9.814 11.143 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -3.998 11.320 10.647 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -4.052 10.657 9.025 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -5.606 9.276 11.207 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -6.237 10.768 10.539 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -5.827 9.652 8.211 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -5.696 8.153 9.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -7.946 8.516 8.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -7.907 8.545 10.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -8.034 9.996 9.159 1.00 0.00 H new ATOM 1111 N LYS A 436 -0.384 10.034 9.559 1.00 0.00 N ATOM 1112 CA LYS A 436 0.643 10.988 9.181 1.00 0.00 C ATOM 1113 C LYS A 436 0.962 10.858 7.695 1.00 0.00 C ATOM 1114 O LYS A 436 0.956 11.849 6.965 1.00 0.00 O ATOM 1115 CB LYS A 436 1.905 10.761 10.014 1.00 0.00 C ATOM 1116 CG LYS A 436 1.857 11.407 11.389 1.00 0.00 C ATOM 1117 CD LYS A 436 1.773 12.922 11.294 1.00 0.00 C ATOM 1118 CE LYS A 436 2.537 13.592 12.425 1.00 0.00 C ATOM 1119 NZ LYS A 436 4.008 13.559 12.198 1.00 0.00 N ATOM 0 H LYS A 436 -0.266 9.632 10.489 1.00 0.00 H new ATOM 0 HA LYS A 436 0.273 11.995 9.372 1.00 0.00 H new ATOM 0 HB2 LYS A 436 2.063 9.689 10.132 1.00 0.00 H new ATOM 0 HB3 LYS A 436 2.764 11.152 9.469 1.00 0.00 H new ATOM 0 HG2 LYS A 436 0.996 11.028 11.939 1.00 0.00 H new ATOM 0 HG3 LYS A 436 2.745 11.126 11.955 1.00 0.00 H new ATOM 0 HD2 LYS A 436 2.176 13.251 10.336 1.00 0.00 H new ATOM 0 HD3 LYS A 436 0.729 13.233 11.324 1.00 0.00 H new ATOM 0 HE2 LYS A 436 2.208 14.627 12.522 1.00 0.00 H new ATOM 0 HE3 LYS A 436 2.304 13.093 13.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 4.502 13.721 13.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 4.280 12.631 11.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 4.271 14.303 11.521 1.00 0.00 H new ATOM 1133 N MET A 437 1.212 9.636 7.239 1.00 0.00 N ATOM 1134 CA MET A 437 1.497 9.413 5.822 1.00 0.00 C ATOM 1135 C MET A 437 0.253 9.732 5.000 1.00 0.00 C ATOM 1136 O MET A 437 0.334 10.398 3.970 1.00 0.00 O ATOM 1137 CB MET A 437 1.965 7.977 5.531 1.00 0.00 C ATOM 1138 CG MET A 437 2.020 7.068 6.747 1.00 0.00 C ATOM 1139 SD MET A 437 2.887 5.521 6.414 1.00 0.00 S ATOM 1140 CE MET A 437 4.470 5.842 7.192 1.00 0.00 C ATOM 0 H MET A 437 1.224 8.795 7.817 1.00 0.00 H new ATOM 0 HA MET A 437 2.316 10.076 5.543 1.00 0.00 H new ATOM 0 HB2 MET A 437 1.296 7.534 4.793 1.00 0.00 H new ATOM 0 HB3 MET A 437 2.956 8.017 5.079 1.00 0.00 H new ATOM 0 HG2 MET A 437 2.516 7.590 7.565 1.00 0.00 H new ATOM 0 HG3 MET A 437 1.005 6.848 7.078 1.00 0.00 H new ATOM 0 HE1 MET A 437 5.118 4.974 7.070 1.00 0.00 H new ATOM 0 HE2 MET A 437 4.935 6.710 6.726 1.00 0.00 H new ATOM 0 HE3 MET A 437 4.321 6.037 8.254 1.00 0.00 H new ATOM 1150 N LEU A 438 -0.905 9.285 5.481 1.00 0.00 N ATOM 1151 CA LEU A 438 -2.158 9.572 4.797 1.00 0.00 C ATOM 1152 C LEU A 438 -2.206 11.062 4.503 1.00 0.00 C ATOM 1153 O LEU A 438 -2.202 11.494 3.351 1.00 0.00 O ATOM 1154 CB LEU A 438 -3.341 9.194 5.692 1.00 0.00 C ATOM 1155 CG LEU A 438 -4.292 8.141 5.127 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -3.545 6.851 4.828 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -5.431 7.892 6.104 1.00 0.00 C ATOM 0 H LEU A 438 -0.999 8.730 6.331 1.00 0.00 H new ATOM 0 HA LEU A 438 -2.218 8.996 3.873 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -2.951 8.831 6.643 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -3.914 10.096 5.905 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.711 8.511 4.191 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -4.239 6.113 4.426 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -2.760 7.046 4.097 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -3.099 6.468 5.746 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -6.105 7.140 5.693 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -5.026 7.538 7.052 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -5.979 8.820 6.268 1.00 0.00 H new ATOM 1169 N ASP A 439 -2.229 11.832 5.582 1.00 0.00 N ATOM 1170 CA ASP A 439 -2.253 13.286 5.513 1.00 0.00 C ATOM 1171 C ASP A 439 -1.034 13.808 4.772 1.00 0.00 C ATOM 1172 O ASP A 439 -1.025 14.931 4.289 1.00 0.00 O ATOM 1173 CB ASP A 439 -2.261 13.859 6.929 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.269 14.981 7.099 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -3.978 15.296 6.121 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -3.344 15.547 8.210 1.00 0.00 O ATOM 0 H ASP A 439 -2.232 11.464 6.533 1.00 0.00 H new ATOM 0 HA ASP A 439 -3.150 13.595 4.977 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.487 13.062 7.638 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.265 14.230 7.172 1.00 0.00 H new ATOM 1181 N PHE A 440 -0.010 12.979 4.685 1.00 0.00 N ATOM 1182 CA PHE A 440 1.213 13.362 4.002 1.00 0.00 C ATOM 1183 C PHE A 440 1.003 13.331 2.498 1.00 0.00 C ATOM 1184 O PHE A 440 1.176 14.341 1.816 1.00 0.00 O ATOM 1185 CB PHE A 440 2.366 12.443 4.401 1.00 0.00 C ATOM 1186 CG PHE A 440 3.675 12.824 3.777 1.00 0.00 C ATOM 1187 CD1 PHE A 440 4.012 12.367 2.514 1.00 0.00 C ATOM 1188 CD2 PHE A 440 4.567 13.641 4.451 1.00 0.00 C ATOM 1189 CE1 PHE A 440 5.215 12.720 1.933 1.00 0.00 C ATOM 1190 CE2 PHE A 440 5.772 13.997 3.876 1.00 0.00 C ATOM 1191 CZ PHE A 440 6.097 13.536 2.615 1.00 0.00 C ATOM 0 H PHE A 440 -0.000 12.038 5.078 1.00 0.00 H new ATOM 0 HA PHE A 440 1.472 14.378 4.299 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.472 12.455 5.486 1.00 0.00 H new ATOM 0 HB3 PHE A 440 2.120 11.420 4.116 1.00 0.00 H new ATOM 0 HD1 PHE A 440 3.327 11.728 1.977 1.00 0.00 H new ATOM 0 HD2 PHE A 440 4.318 14.004 5.437 1.00 0.00 H new ATOM 0 HE1 PHE A 440 5.466 12.358 0.947 1.00 0.00 H new ATOM 0 HE2 PHE A 440 6.459 14.635 4.412 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.038 13.813 2.163 1.00 0.00 H new ATOM 1201 N TYR A 441 0.609 12.173 1.986 1.00 0.00 N ATOM 1202 CA TYR A 441 0.354 12.027 0.568 1.00 0.00 C ATOM 1203 C TYR A 441 -0.725 13.000 0.136 1.00 0.00 C ATOM 1204 O TYR A 441 -0.522 13.802 -0.777 1.00 0.00 O ATOM 1205 CB TYR A 441 -0.064 10.598 0.255 1.00 0.00 C ATOM 1206 CG TYR A 441 1.015 9.590 0.545 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.164 9.524 -0.233 1.00 0.00 C ATOM 1208 CD2 TYR A 441 0.886 8.709 1.603 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.156 8.600 0.039 1.00 0.00 C ATOM 1210 CE2 TYR A 441 1.868 7.786 1.882 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.002 7.732 1.098 1.00 0.00 C ATOM 1212 OH TYR A 441 3.982 6.808 1.374 1.00 0.00 O ATOM 0 H TYR A 441 0.461 11.325 2.534 1.00 0.00 H new ATOM 0 HA TYR A 441 1.268 12.249 0.017 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.951 10.349 0.838 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -0.344 10.530 -0.796 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.284 10.205 -1.063 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.001 8.746 2.220 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.044 8.559 -0.574 1.00 0.00 H new ATOM 0 HE2 TYR A 441 1.751 7.106 2.713 1.00 0.00 H new ATOM 0 HH TYR A 441 4.215 6.852 2.325 1.00 0.00 H new ATOM 1222 N ALA A 442 -1.869 12.950 0.811 1.00 0.00 N ATOM 1223 CA ALA A 442 -2.948 13.864 0.485 1.00 0.00 C ATOM 1224 C ALA A 442 -2.378 15.273 0.441 1.00 0.00 C ATOM 1225 O ALA A 442 -2.358 15.919 -0.607 1.00 0.00 O ATOM 1226 CB ALA A 442 -4.079 13.772 1.499 1.00 0.00 C ATOM 0 H ALA A 442 -2.067 12.299 1.571 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.370 13.598 -0.484 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -4.871 14.469 1.225 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.477 12.757 1.509 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -3.701 14.023 2.490 1.00 0.00 H new ATOM 1232 N LYS A 443 -1.905 15.737 1.596 1.00 0.00 N ATOM 1233 CA LYS A 443 -1.320 17.067 1.703 1.00 0.00 C ATOM 1234 C LYS A 443 -0.398 17.308 0.524 1.00 0.00 C ATOM 1235 O LYS A 443 -0.304 18.421 0.005 1.00 0.00 O ATOM 1236 CB LYS A 443 -0.520 17.194 2.994 1.00 0.00 C ATOM 1237 CG LYS A 443 -1.368 17.405 4.229 1.00 0.00 C ATOM 1238 CD LYS A 443 -1.614 18.881 4.488 1.00 0.00 C ATOM 1239 CE LYS A 443 -2.001 19.616 3.215 1.00 0.00 C ATOM 1240 NZ LYS A 443 -2.180 21.075 3.452 1.00 0.00 N ATOM 0 H LYS A 443 -1.917 15.210 2.469 1.00 0.00 H new ATOM 0 HA LYS A 443 -2.123 17.804 1.707 1.00 0.00 H new ATOM 0 HB2 LYS A 443 0.079 16.293 3.127 1.00 0.00 H new ATOM 0 HB3 LYS A 443 0.175 18.028 2.897 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.322 16.891 4.109 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -0.873 16.960 5.092 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -2.406 18.994 5.229 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -0.716 19.332 4.910 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -1.232 19.462 2.458 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -2.926 19.196 2.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -2.443 21.542 2.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -2.932 21.223 4.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -1.290 21.481 3.806 1.00 0.00 H new ATOM 1254 N GLN A 444 0.251 16.241 0.085 1.00 0.00 N ATOM 1255 CA GLN A 444 1.133 16.322 -1.066 1.00 0.00 C ATOM 1256 C GLN A 444 0.297 16.683 -2.290 1.00 0.00 C ATOM 1257 O GLN A 444 0.562 17.664 -2.977 1.00 0.00 O ATOM 1258 CB GLN A 444 1.857 14.992 -1.290 1.00 0.00 C ATOM 1259 CG GLN A 444 3.252 15.145 -1.872 1.00 0.00 C ATOM 1260 CD GLN A 444 3.888 13.813 -2.214 1.00 0.00 C ATOM 1261 OE1 GLN A 444 3.819 12.861 -1.435 1.00 0.00 O ATOM 1262 NE2 GLN A 444 4.514 13.737 -3.382 1.00 0.00 N ATOM 0 H GLN A 444 0.184 15.314 0.506 1.00 0.00 H new ATOM 0 HA GLN A 444 1.891 17.086 -0.893 1.00 0.00 H new ATOM 0 HB2 GLN A 444 1.926 14.462 -0.340 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.260 14.372 -1.959 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.202 15.761 -2.770 1.00 0.00 H new ATOM 0 HG3 GLN A 444 3.884 15.673 -1.158 1.00 0.00 H new ATOM 0 HE21 GLN A 444 4.547 14.550 -3.997 1.00 0.00 H new ATOM 0 HE22 GLN A 444 4.962 12.865 -3.665 1.00 0.00 H new ATOM 1271 N ARG A 445 -0.703 15.849 -2.554 1.00 0.00 N ATOM 1272 CA ARG A 445 -1.582 16.046 -3.700 1.00 0.00 C ATOM 1273 C ARG A 445 -1.871 17.532 -3.870 1.00 0.00 C ATOM 1274 O ARG A 445 -1.733 18.083 -4.962 1.00 0.00 O ATOM 1275 CB ARG A 445 -2.890 15.272 -3.522 1.00 0.00 C ATOM 1276 CG ARG A 445 -3.649 15.051 -4.822 1.00 0.00 C ATOM 1277 CD ARG A 445 -3.407 16.183 -5.809 1.00 0.00 C ATOM 1278 NE ARG A 445 -4.135 15.994 -7.059 1.00 0.00 N ATOM 1279 CZ ARG A 445 -3.871 16.670 -8.173 1.00 0.00 C ATOM 1280 NH1 ARG A 445 -2.898 17.571 -8.187 1.00 0.00 N ATOM 1281 NH2 ARG A 445 -4.580 16.451 -9.270 1.00 0.00 N ATOM 0 H ARG A 445 -0.925 15.029 -1.989 1.00 0.00 H new ATOM 0 HA ARG A 445 -1.084 15.668 -4.593 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -2.671 14.305 -3.070 1.00 0.00 H new ATOM 0 HB3 ARG A 445 -3.530 15.812 -2.825 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -3.340 14.106 -5.268 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -4.716 14.971 -4.613 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -3.707 17.128 -5.356 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -2.340 16.256 -6.020 1.00 0.00 H new ATOM 0 HE ARG A 445 -4.888 15.306 -7.079 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -2.352 17.745 -7.343 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -2.695 18.090 -9.042 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -5.332 15.762 -9.262 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -4.374 16.972 -10.123 1.00 0.00 H new ATOM 1295 N ALA A 446 -2.248 18.182 -2.776 1.00 0.00 N ATOM 1296 CA ALA A 446 -2.525 19.612 -2.793 1.00 0.00 C ATOM 1297 C ALA A 446 -1.218 20.387 -2.917 1.00 0.00 C ATOM 1298 O ALA A 446 -1.155 21.451 -3.532 1.00 0.00 O ATOM 1299 CB ALA A 446 -3.265 20.020 -1.531 1.00 0.00 C ATOM 0 H ALA A 446 -2.369 17.740 -1.865 1.00 0.00 H new ATOM 0 HA ALA A 446 -3.156 19.843 -3.651 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -3.466 21.091 -1.557 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -4.207 19.476 -1.470 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -2.654 19.786 -0.659 1.00 0.00 H new ATOM 1305 N ALA A 447 -0.177 19.815 -2.327 1.00 0.00 N ATOM 1306 CA ALA A 447 1.161 20.390 -2.342 1.00 0.00 C ATOM 1307 C ALA A 447 1.959 19.853 -3.528 1.00 0.00 C ATOM 1308 O ALA A 447 3.180 19.716 -3.454 1.00 0.00 O ATOM 1309 CB ALA A 447 1.890 20.087 -1.042 1.00 0.00 C ATOM 0 H ALA A 447 -0.238 18.932 -1.820 1.00 0.00 H new ATOM 0 HA ALA A 447 1.066 21.471 -2.443 1.00 0.00 H new ATOM 0 HB1 ALA A 447 2.888 20.525 -1.074 1.00 0.00 H new ATOM 0 HB2 ALA A 447 1.334 20.511 -0.206 1.00 0.00 H new ATOM 0 HB3 ALA A 447 1.972 19.008 -0.914 1.00 0.00 H new ATOM 1315 N ILE A 448 1.264 19.553 -4.621 1.00 0.00 N ATOM 1316 CA ILE A 448 1.912 19.034 -5.822 1.00 0.00 C ATOM 1317 C ILE A 448 1.019 19.198 -7.046 1.00 0.00 C ATOM 1318 O ILE A 448 0.184 18.341 -7.338 1.00 0.00 O ATOM 1319 CB ILE A 448 2.283 17.547 -5.668 1.00 0.00 C ATOM 1320 CG1 ILE A 448 1.047 16.722 -5.307 1.00 0.00 C ATOM 1321 CG2 ILE A 448 3.365 17.381 -4.611 1.00 0.00 C ATOM 1322 CD1 ILE A 448 0.551 15.846 -6.435 1.00 0.00 C ATOM 0 H ILE A 448 0.253 19.660 -4.700 1.00 0.00 H new ATOM 0 HA ILE A 448 2.824 19.615 -5.960 1.00 0.00 H new ATOM 0 HB ILE A 448 2.670 17.184 -6.620 1.00 0.00 H new ATOM 0 HG12 ILE A 448 1.278 16.095 -4.446 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.246 17.397 -5.004 1.00 0.00 H new ATOM 0 HG21 ILE A 448 3.618 16.325 -4.512 1.00 0.00 H new ATOM 0 HG22 ILE A 448 4.252 17.941 -4.907 1.00 0.00 H new ATOM 0 HG23 ILE A 448 3.001 17.758 -3.655 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -0.327 15.291 -6.105 1.00 0.00 H new ATOM 0 HD12 ILE A 448 0.287 16.468 -7.290 1.00 0.00 H new ATOM 0 HD13 ILE A 448 1.335 15.146 -6.724 1.00 0.00 H new ATOM 1334 N PRO A 449 1.187 20.308 -7.779 1.00 0.00 N ATOM 1335 CA PRO A 449 0.401 20.594 -8.978 1.00 0.00 C ATOM 1336 C PRO A 449 0.923 19.851 -10.204 1.00 0.00 C ATOM 1337 O PRO A 449 1.269 20.465 -11.213 1.00 0.00 O ATOM 1338 CB PRO A 449 0.574 22.102 -9.147 1.00 0.00 C ATOM 1339 CG PRO A 449 1.922 22.393 -8.578 1.00 0.00 C ATOM 1340 CD PRO A 449 2.163 21.374 -7.491 1.00 0.00 C ATOM 0 HA PRO A 449 -0.637 20.276 -8.880 1.00 0.00 H new ATOM 0 HB2 PRO A 449 0.516 22.392 -10.196 1.00 0.00 H new ATOM 0 HB3 PRO A 449 -0.206 22.652 -8.620 1.00 0.00 H new ATOM 0 HG2 PRO A 449 2.690 22.326 -9.349 1.00 0.00 H new ATOM 0 HG3 PRO A 449 1.962 23.405 -8.175 1.00 0.00 H new ATOM 0 HD2 PRO A 449 3.185 20.997 -7.517 1.00 0.00 H new ATOM 0 HD3 PRO A 449 2.006 21.802 -6.501 1.00 0.00 H new ATOM 1348 N ARG A 450 0.979 18.527 -10.106 1.00 0.00 N ATOM 1349 CA ARG A 450 1.460 17.696 -11.204 1.00 0.00 C ATOM 1350 C ARG A 450 2.985 17.639 -11.222 1.00 0.00 C ATOM 1351 O ARG A 450 3.615 17.925 -12.240 1.00 0.00 O ATOM 1352 CB ARG A 450 0.942 18.228 -12.541 1.00 0.00 C ATOM 1353 CG ARG A 450 0.401 17.142 -13.454 1.00 0.00 C ATOM 1354 CD ARG A 450 -0.896 17.568 -14.123 1.00 0.00 C ATOM 1355 NE ARG A 450 -1.873 16.484 -14.165 1.00 0.00 N ATOM 1356 CZ ARG A 450 -3.186 16.677 -14.206 1.00 0.00 C ATOM 1357 NH1 ARG A 450 -3.678 17.908 -14.218 1.00 0.00 N ATOM 1358 NH2 ARG A 450 -4.010 15.638 -14.237 1.00 0.00 N ATOM 0 H ARG A 450 0.697 18.006 -9.276 1.00 0.00 H new ATOM 0 HA ARG A 450 1.080 16.686 -11.051 1.00 0.00 H new ATOM 0 HB2 ARG A 450 0.156 18.959 -12.353 1.00 0.00 H new ATOM 0 HB3 ARG A 450 1.749 18.753 -13.052 1.00 0.00 H new ATOM 0 HG2 ARG A 450 1.143 16.904 -14.216 1.00 0.00 H new ATOM 0 HG3 ARG A 450 0.232 16.232 -12.878 1.00 0.00 H new ATOM 0 HD2 ARG A 450 -1.319 18.417 -13.585 1.00 0.00 H new ATOM 0 HD3 ARG A 450 -0.686 17.906 -15.138 1.00 0.00 H new ATOM 0 HE ARG A 450 -1.527 15.524 -14.163 1.00 0.00 H new ATOM 0 HH11 ARG A 450 -3.047 18.709 -14.196 1.00 0.00 H new ATOM 0 HH12 ARG A 450 -4.687 18.054 -14.250 1.00 0.00 H new ATOM 0 HH21 ARG A 450 -3.635 14.689 -14.229 1.00 0.00 H new ATOM 0 HH22 ARG A 450 -5.018 15.788 -14.268 1.00 0.00 H new ATOM 1372 N SER A 451 3.571 17.263 -10.091 1.00 0.00 N ATOM 1373 CA SER A 451 5.022 17.162 -9.979 1.00 0.00 C ATOM 1374 C SER A 451 5.472 15.708 -10.070 1.00 0.00 C ATOM 1375 O SER A 451 4.663 14.789 -9.938 1.00 0.00 O ATOM 1376 CB SER A 451 5.497 17.773 -8.658 1.00 0.00 C ATOM 1377 OG SER A 451 6.644 18.582 -8.854 1.00 0.00 O ATOM 0 H SER A 451 3.064 17.023 -9.239 1.00 0.00 H new ATOM 0 HA SER A 451 5.466 17.715 -10.807 1.00 0.00 H new ATOM 0 HB2 SER A 451 4.697 18.371 -8.222 1.00 0.00 H new ATOM 0 HB3 SER A 451 5.725 16.979 -7.947 1.00 0.00 H new ATOM 0 HG SER A 451 6.927 18.962 -7.996 1.00 0.00 H new ATOM 1383 N GLU A 452 6.764 15.504 -10.300 1.00 0.00 N ATOM 1384 CA GLU A 452 7.317 14.158 -10.411 1.00 0.00 C ATOM 1385 C GLU A 452 7.024 13.563 -11.784 1.00 0.00 C ATOM 1386 O GLU A 452 7.926 13.398 -12.606 1.00 0.00 O ATOM 1387 CB GLU A 452 6.741 13.256 -9.319 1.00 0.00 C ATOM 1388 CG GLU A 452 7.801 12.511 -8.525 1.00 0.00 C ATOM 1389 CD GLU A 452 7.204 11.539 -7.527 1.00 0.00 C ATOM 1390 OE1 GLU A 452 6.514 11.998 -6.592 1.00 0.00 O ATOM 1391 OE2 GLU A 452 7.425 10.320 -7.681 1.00 0.00 O ATOM 0 H GLU A 452 7.448 16.252 -10.413 1.00 0.00 H new ATOM 0 HA GLU A 452 8.398 14.224 -10.285 1.00 0.00 H new ATOM 0 HB2 GLU A 452 6.145 13.861 -8.636 1.00 0.00 H new ATOM 0 HB3 GLU A 452 6.065 12.533 -9.775 1.00 0.00 H new ATOM 0 HG2 GLU A 452 8.450 11.968 -9.212 1.00 0.00 H new ATOM 0 HG3 GLU A 452 8.427 13.230 -7.997 1.00 0.00 H new ATOM 1398 N SER A 453 5.759 13.245 -12.023 1.00 0.00 N ATOM 1399 CA SER A 453 5.341 12.669 -13.295 1.00 0.00 C ATOM 1400 C SER A 453 6.139 11.408 -13.611 1.00 0.00 C ATOM 1401 O SER A 453 6.138 10.986 -14.787 1.00 0.00 O ATOM 1402 CB SER A 453 5.511 13.691 -14.421 1.00 0.00 C ATOM 1403 OG SER A 453 6.228 14.828 -13.973 1.00 0.00 O ATOM 1404 OXT SER A 453 6.761 10.853 -12.680 1.00 0.00 O ATOM 0 H SER A 453 5.003 13.376 -11.351 1.00 0.00 H new ATOM 0 HA SER A 453 4.288 12.399 -13.215 1.00 0.00 H new ATOM 0 HB2 SER A 453 6.038 13.231 -15.257 1.00 0.00 H new ATOM 0 HB3 SER A 453 4.532 13.997 -14.790 1.00 0.00 H new ATOM 0 HG SER A 453 6.325 15.465 -14.711 1.00 0.00 H new TER 1410 SER A 453