USER MOD reduce.3.24.130724 H: found=0, std=0, add=688, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 686 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 33 THR OG1 : rot -78:sc= 1.99 USER MOD Set 1.2: A 35 SER OG : rot -47:sc= 1.23 USER MOD Set 1.3: A 63 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 45 THR OG1 : rot -117:sc= 0.456 USER MOD Set 2.2: A 50 HIS : no HD1:sc= -6.05! C(o=-5.6!,f=-18!) USER MOD Single : A 1 SER N :NH3+ -141:sc= 0.0426 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl -153:sc= -0.293 (180deg=-1.56!) USER MOD Single : A 5 GLN : amide:sc=-0.00806 K(o=-0.0081,f=-1.6!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -133:sc= -0.152 (180deg=-2.43!) USER MOD Single : A 12 LYS NZ :NH3+ -164:sc= 1.25 (180deg=1.03) USER MOD Single : A 14 TYR OH : rot 180:sc= -2.41 USER MOD Single : A 16 HIS : no HD1:sc= -0.367 K(o=-0.37,f=-1.1) USER MOD Single : A 22 SER OG : rot 108:sc= 0.866 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc=-0.000624 K(o=-0.00062,f=-1.7!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -150:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= -0.278 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -168:sc= -3.46! (180deg=-4.23!) USER MOD Single : A 71 ASN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 81 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0659) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 0.402 -31.911 -18.273 1.00 0.00 N ATOM 2 CA SER A 1 -0.459 -31.455 -19.399 1.00 0.00 C ATOM 3 C SER A 1 -0.313 -29.941 -19.572 1.00 0.00 C ATOM 4 O SER A 1 0.448 -29.299 -18.878 1.00 0.00 O ATOM 5 CB SER A 1 -1.920 -31.794 -19.095 1.00 0.00 C ATOM 6 OG SER A 1 -2.496 -32.454 -20.212 1.00 0.00 O ATOM 0 H1 SER A 1 0.837 -32.824 -18.516 1.00 0.00 H new ATOM 0 H2 SER A 1 1.148 -31.207 -18.099 1.00 0.00 H new ATOM 0 H3 SER A 1 -0.177 -32.021 -17.416 1.00 0.00 H new ATOM 0 HA SER A 1 -0.153 -31.958 -20.316 1.00 0.00 H new ATOM 0 HB2 SER A 1 -1.980 -32.431 -18.212 1.00 0.00 H new ATOM 0 HB3 SER A 1 -2.476 -30.884 -18.870 1.00 0.00 H new ATOM 0 HG SER A 1 -3.431 -32.673 -20.016 1.00 0.00 H new ATOM 14 N MET A 2 -1.036 -29.367 -20.494 1.00 0.00 N ATOM 15 CA MET A 2 -0.937 -27.897 -20.711 1.00 0.00 C ATOM 16 C MET A 2 -1.287 -27.166 -19.412 1.00 0.00 C ATOM 17 O MET A 2 -0.744 -26.122 -19.111 1.00 0.00 O ATOM 18 CB MET A 2 -1.912 -27.475 -21.812 1.00 0.00 C ATOM 19 CG MET A 2 -1.507 -28.137 -23.131 1.00 0.00 C ATOM 20 SD MET A 2 0.205 -27.700 -23.523 1.00 0.00 S ATOM 21 CE MET A 2 -0.036 -25.910 -23.627 1.00 0.00 C ATOM 0 H MET A 2 -1.691 -29.853 -21.106 1.00 0.00 H new ATOM 0 HA MET A 2 0.080 -27.642 -21.010 1.00 0.00 H new ATOM 0 HB2 MET A 2 -2.928 -27.765 -21.544 1.00 0.00 H new ATOM 0 HB3 MET A 2 -1.908 -26.390 -21.920 1.00 0.00 H new ATOM 0 HG2 MET A 2 -1.609 -29.219 -23.054 1.00 0.00 H new ATOM 0 HG3 MET A 2 -2.170 -27.811 -23.933 1.00 0.00 H new ATOM 0 HE1 MET A 2 0.710 -25.481 -24.296 1.00 0.00 H new ATOM 0 HE2 MET A 2 -1.034 -25.699 -24.012 1.00 0.00 H new ATOM 0 HE3 MET A 2 0.071 -25.470 -22.635 1.00 0.00 H new ATOM 31 N GLY A 3 -2.191 -27.706 -18.643 1.00 0.00 N ATOM 32 CA GLY A 3 -2.575 -27.042 -17.365 1.00 0.00 C ATOM 33 C GLY A 3 -3.805 -26.160 -17.596 1.00 0.00 C ATOM 34 O GLY A 3 -4.236 -25.438 -16.719 1.00 0.00 O ATOM 0 H GLY A 3 -2.681 -28.578 -18.844 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -2.790 -27.792 -16.604 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -1.747 -26.439 -16.993 1.00 0.00 H new ATOM 38 N GLY A 4 -4.375 -26.213 -18.769 1.00 0.00 N ATOM 39 CA GLY A 4 -5.576 -25.377 -19.052 1.00 0.00 C ATOM 40 C GLY A 4 -6.682 -25.717 -18.050 1.00 0.00 C ATOM 41 O GLY A 4 -7.484 -24.880 -17.688 1.00 0.00 O ATOM 0 H GLY A 4 -4.061 -26.799 -19.543 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.321 -24.320 -18.983 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.925 -25.555 -20.069 1.00 0.00 H new ATOM 45 N GLN A 5 -6.730 -26.940 -17.598 1.00 0.00 N ATOM 46 CA GLN A 5 -7.784 -27.332 -16.620 1.00 0.00 C ATOM 47 C GLN A 5 -7.490 -26.681 -15.268 1.00 0.00 C ATOM 48 O GLN A 5 -6.351 -26.446 -14.916 1.00 0.00 O ATOM 49 CB GLN A 5 -7.793 -28.854 -16.463 1.00 0.00 C ATOM 50 CG GLN A 5 -8.140 -29.503 -17.803 1.00 0.00 C ATOM 51 CD GLN A 5 -8.058 -31.025 -17.670 1.00 0.00 C ATOM 52 OE1 GLN A 5 -7.475 -31.534 -16.733 1.00 0.00 O ATOM 53 NE2 GLN A 5 -8.623 -31.778 -18.573 1.00 0.00 N ATOM 0 H GLN A 5 -6.085 -27.685 -17.863 1.00 0.00 H new ATOM 0 HA GLN A 5 -8.757 -26.999 -16.980 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -6.818 -29.201 -16.121 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -8.520 -29.148 -15.706 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.142 -29.208 -18.113 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -7.453 -29.157 -18.575 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -9.112 -31.351 -19.360 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -8.575 -32.794 -18.493 1.00 0.00 H new ATOM 62 N LYS A 6 -8.507 -26.386 -14.507 1.00 0.00 N ATOM 63 CA LYS A 6 -8.285 -25.750 -13.178 1.00 0.00 C ATOM 64 C LYS A 6 -9.073 -26.509 -12.109 1.00 0.00 C ATOM 65 O LYS A 6 -10.079 -27.129 -12.390 1.00 0.00 O ATOM 66 CB LYS A 6 -8.757 -24.295 -13.222 1.00 0.00 C ATOM 67 CG LYS A 6 -10.277 -24.259 -13.393 1.00 0.00 C ATOM 68 CD LYS A 6 -10.736 -22.811 -13.577 1.00 0.00 C ATOM 69 CE LYS A 6 -12.256 -22.733 -13.424 1.00 0.00 C ATOM 70 NZ LYS A 6 -12.905 -23.114 -14.710 1.00 0.00 N ATOM 0 H LYS A 6 -9.483 -26.558 -14.748 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.223 -25.780 -12.936 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.471 -23.780 -12.305 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.275 -23.769 -14.046 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.571 -24.857 -14.256 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.762 -24.697 -12.521 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.253 -22.169 -12.841 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -10.440 -22.447 -14.561 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -12.587 -23.398 -12.626 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -12.552 -21.723 -13.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -13.938 -23.061 -14.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -12.598 -22.462 -15.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -12.632 -24.085 -14.962 1.00 0.00 H new ATOM 84 N ILE A 7 -8.625 -26.464 -10.886 1.00 0.00 N ATOM 85 CA ILE A 7 -9.350 -27.182 -9.799 1.00 0.00 C ATOM 86 C ILE A 7 -9.843 -26.170 -8.764 1.00 0.00 C ATOM 87 O ILE A 7 -9.172 -25.204 -8.457 1.00 0.00 O ATOM 88 CB ILE A 7 -8.405 -28.180 -9.129 1.00 0.00 C ATOM 89 CG1 ILE A 7 -7.864 -29.155 -10.178 1.00 0.00 C ATOM 90 CG2 ILE A 7 -9.165 -28.959 -8.054 1.00 0.00 C ATOM 91 CD1 ILE A 7 -6.821 -30.070 -9.534 1.00 0.00 C ATOM 0 H ILE A 7 -7.788 -25.961 -10.591 1.00 0.00 H new ATOM 0 HA ILE A 7 -10.202 -27.717 -10.219 1.00 0.00 H new ATOM 0 HB ILE A 7 -7.575 -27.642 -8.671 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -8.679 -29.749 -10.592 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -7.418 -28.604 -11.006 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -8.492 -29.671 -7.576 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -9.550 -28.266 -7.306 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -9.995 -29.496 -8.513 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -6.436 -30.764 -10.281 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -6.002 -29.468 -9.141 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -7.282 -30.631 -8.721 1.00 0.00 H new ATOM 103 N ARG A 8 -11.011 -26.381 -8.224 1.00 0.00 N ATOM 104 CA ARG A 8 -11.546 -25.429 -7.209 1.00 0.00 C ATOM 105 C ARG A 8 -11.829 -26.176 -5.905 1.00 0.00 C ATOM 106 O ARG A 8 -12.399 -27.249 -5.904 1.00 0.00 O ATOM 107 CB ARG A 8 -12.842 -24.803 -7.730 1.00 0.00 C ATOM 108 CG ARG A 8 -12.540 -23.969 -8.976 1.00 0.00 C ATOM 109 CD ARG A 8 -13.807 -23.232 -9.414 1.00 0.00 C ATOM 110 NE ARG A 8 -13.608 -22.670 -10.780 1.00 0.00 N ATOM 111 CZ ARG A 8 -14.578 -22.716 -11.652 1.00 0.00 C ATOM 112 NH1 ARG A 8 -15.089 -23.865 -12.000 1.00 0.00 N ATOM 113 NH2 ARG A 8 -15.037 -21.612 -12.175 1.00 0.00 N ATOM 0 H ARG A 8 -11.619 -27.171 -8.441 1.00 0.00 H new ATOM 0 HA ARG A 8 -10.811 -24.645 -7.025 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -13.565 -25.583 -7.968 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -13.291 -24.176 -6.960 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -11.745 -23.254 -8.764 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -12.184 -24.613 -9.780 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -14.657 -23.914 -9.410 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -14.037 -22.432 -8.710 1.00 0.00 H new ATOM 0 HE ARG A 8 -12.714 -22.250 -11.033 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -14.730 -24.728 -11.591 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -15.847 -23.901 -12.681 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -14.638 -20.714 -11.902 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -15.795 -21.647 -12.857 1.00 0.00 H new ATOM 127 N ILE A 9 -11.436 -25.618 -4.793 1.00 0.00 N ATOM 128 CA ILE A 9 -11.684 -26.295 -3.490 1.00 0.00 C ATOM 129 C ILE A 9 -12.608 -25.427 -2.633 1.00 0.00 C ATOM 130 O ILE A 9 -12.438 -24.228 -2.541 1.00 0.00 O ATOM 131 CB ILE A 9 -10.355 -26.500 -2.759 1.00 0.00 C ATOM 132 CG1 ILE A 9 -9.417 -27.341 -3.629 1.00 0.00 C ATOM 133 CG2 ILE A 9 -10.609 -27.225 -1.436 1.00 0.00 C ATOM 134 CD1 ILE A 9 -8.035 -27.403 -2.975 1.00 0.00 C ATOM 0 H ILE A 9 -10.953 -24.722 -4.731 1.00 0.00 H new ATOM 0 HA ILE A 9 -12.154 -27.263 -3.667 1.00 0.00 H new ATOM 0 HB ILE A 9 -9.896 -25.531 -2.562 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.820 -28.347 -3.750 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.341 -26.906 -4.626 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.663 -27.372 -0.914 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.277 -26.627 -0.816 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -11.068 -28.194 -1.634 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.366 -28.002 -3.594 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.633 -26.394 -2.877 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.120 -27.857 -1.988 1.00 0.00 H new ATOM 146 N LYS A 10 -13.585 -26.023 -2.007 1.00 0.00 N ATOM 147 CA LYS A 10 -14.519 -25.228 -1.158 1.00 0.00 C ATOM 148 C LYS A 10 -14.212 -25.482 0.320 1.00 0.00 C ATOM 149 O LYS A 10 -14.102 -26.611 0.756 1.00 0.00 O ATOM 150 CB LYS A 10 -15.959 -25.646 -1.456 1.00 0.00 C ATOM 151 CG LYS A 10 -16.921 -24.606 -0.878 1.00 0.00 C ATOM 152 CD LYS A 10 -18.362 -25.007 -1.203 1.00 0.00 C ATOM 153 CE LYS A 10 -19.317 -23.917 -0.713 1.00 0.00 C ATOM 154 NZ LYS A 10 -19.575 -22.949 -1.817 1.00 0.00 N ATOM 0 H LYS A 10 -13.778 -27.024 -2.046 1.00 0.00 H new ATOM 0 HA LYS A 10 -14.393 -24.168 -1.378 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -16.108 -25.736 -2.532 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.162 -26.625 -1.023 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -16.788 -24.532 0.201 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -16.703 -23.623 -1.294 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -18.477 -25.151 -2.277 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -18.603 -25.957 -0.727 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -20.254 -24.363 -0.379 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -18.887 -23.400 0.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -19.477 -21.978 -1.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -18.889 -23.105 -2.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -20.539 -23.088 -2.182 1.00 0.00 H new ATOM 168 N LEU A 11 -14.076 -24.440 1.093 1.00 0.00 N ATOM 169 CA LEU A 11 -13.779 -24.622 2.543 1.00 0.00 C ATOM 170 C LEU A 11 -15.019 -24.272 3.368 1.00 0.00 C ATOM 171 O LEU A 11 -15.598 -23.215 3.218 1.00 0.00 O ATOM 172 CB LEU A 11 -12.622 -23.705 2.945 1.00 0.00 C ATOM 173 CG LEU A 11 -11.416 -23.983 2.047 1.00 0.00 C ATOM 174 CD1 LEU A 11 -10.217 -23.167 2.536 1.00 0.00 C ATOM 175 CD2 LEU A 11 -11.074 -25.473 2.100 1.00 0.00 C ATOM 0 H LEU A 11 -14.157 -23.471 0.784 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.502 -25.660 2.729 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -12.923 -22.661 2.855 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.358 -23.872 3.989 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.654 -23.701 1.021 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -9.357 -23.365 1.896 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -10.460 -22.105 2.499 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -9.979 -23.449 3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -10.214 -25.672 1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -10.836 -25.755 3.126 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -11.928 -26.055 1.752 1.00 0.00 H new ATOM 187 N LYS A 12 -15.432 -25.152 4.240 1.00 0.00 N ATOM 188 CA LYS A 12 -16.634 -24.869 5.075 1.00 0.00 C ATOM 189 C LYS A 12 -16.258 -24.950 6.556 1.00 0.00 C ATOM 190 O LYS A 12 -15.554 -25.845 6.980 1.00 0.00 O ATOM 191 CB LYS A 12 -17.723 -25.901 4.769 1.00 0.00 C ATOM 192 CG LYS A 12 -17.941 -25.977 3.257 1.00 0.00 C ATOM 193 CD LYS A 12 -19.091 -26.942 2.956 1.00 0.00 C ATOM 194 CE LYS A 12 -19.362 -26.956 1.449 1.00 0.00 C ATOM 195 NZ LYS A 12 -20.100 -28.201 1.089 1.00 0.00 N ATOM 0 H LYS A 12 -14.989 -26.055 4.410 1.00 0.00 H new ATOM 0 HA LYS A 12 -17.006 -23.870 4.848 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -17.432 -26.878 5.155 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.652 -25.625 5.268 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -18.169 -24.987 2.861 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -17.030 -26.315 2.764 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -18.838 -27.945 3.301 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -19.988 -26.636 3.495 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -19.945 -26.080 1.165 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -18.422 -26.905 0.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -20.049 -28.350 0.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -19.671 -29.013 1.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -21.095 -28.110 1.377 1.00 0.00 H new ATOM 209 N ALA A 13 -16.721 -24.020 7.349 1.00 0.00 N ATOM 210 CA ALA A 13 -16.388 -24.049 8.802 1.00 0.00 C ATOM 211 C ALA A 13 -17.290 -23.069 9.555 1.00 0.00 C ATOM 212 O ALA A 13 -17.585 -21.990 9.081 1.00 0.00 O ATOM 213 CB ALA A 13 -14.925 -23.644 8.997 1.00 0.00 C ATOM 0 H ALA A 13 -17.314 -23.244 7.054 1.00 0.00 H new ATOM 0 HA ALA A 13 -16.544 -25.056 9.189 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -14.680 -23.665 10.059 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.280 -24.341 8.462 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -14.771 -22.637 8.609 1.00 0.00 H new ATOM 219 N TYR A 14 -17.732 -23.438 10.727 1.00 0.00 N ATOM 220 CA TYR A 14 -18.615 -22.534 11.515 1.00 0.00 C ATOM 221 C TYR A 14 -17.940 -21.170 11.681 1.00 0.00 C ATOM 222 O TYR A 14 -18.530 -20.141 11.421 1.00 0.00 O ATOM 223 CB TYR A 14 -18.865 -23.148 12.892 1.00 0.00 C ATOM 224 CG TYR A 14 -20.062 -22.484 13.526 1.00 0.00 C ATOM 225 CD1 TYR A 14 -21.344 -22.727 13.023 1.00 0.00 C ATOM 226 CD2 TYR A 14 -19.889 -21.624 14.618 1.00 0.00 C ATOM 227 CE1 TYR A 14 -22.456 -22.111 13.611 1.00 0.00 C ATOM 228 CE2 TYR A 14 -20.999 -21.008 15.207 1.00 0.00 C ATOM 229 CZ TYR A 14 -22.282 -21.252 14.703 1.00 0.00 C ATOM 230 OH TYR A 14 -23.377 -20.644 15.284 1.00 0.00 O ATOM 0 H TYR A 14 -17.518 -24.330 11.173 1.00 0.00 H new ATOM 0 HA TYR A 14 -19.563 -22.406 10.992 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -19.037 -24.220 12.799 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -17.987 -23.020 13.525 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -21.477 -23.390 12.181 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -18.899 -21.436 15.006 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -23.446 -22.298 13.223 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -20.866 -20.345 16.049 1.00 0.00 H new ATOM 0 HH TYR A 14 -23.081 -20.081 16.030 1.00 0.00 H new ATOM 240 N ASP A 15 -16.713 -21.154 12.121 1.00 0.00 N ATOM 241 CA ASP A 15 -16.006 -19.856 12.311 1.00 0.00 C ATOM 242 C ASP A 15 -15.404 -19.396 10.982 1.00 0.00 C ATOM 243 O ASP A 15 -14.751 -20.152 10.290 1.00 0.00 O ATOM 244 CB ASP A 15 -14.890 -20.029 13.342 1.00 0.00 C ATOM 245 CG ASP A 15 -15.503 -20.232 14.728 1.00 0.00 C ATOM 246 OD1 ASP A 15 -16.694 -20.002 14.868 1.00 0.00 O ATOM 247 OD2 ASP A 15 -14.772 -20.614 15.627 1.00 0.00 O ATOM 0 H ASP A 15 -16.169 -21.984 12.357 1.00 0.00 H new ATOM 0 HA ASP A 15 -16.716 -19.108 12.663 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -14.267 -20.884 13.079 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -14.243 -19.152 13.344 1.00 0.00 H new ATOM 252 N HIS A 16 -15.617 -18.160 10.621 1.00 0.00 N ATOM 253 CA HIS A 16 -15.054 -17.649 9.340 1.00 0.00 C ATOM 254 C HIS A 16 -13.537 -17.508 9.474 1.00 0.00 C ATOM 255 O HIS A 16 -12.796 -17.737 8.538 1.00 0.00 O ATOM 256 CB HIS A 16 -15.668 -16.285 9.023 1.00 0.00 C ATOM 257 CG HIS A 16 -15.083 -15.756 7.741 1.00 0.00 C ATOM 258 ND1 HIS A 16 -15.227 -16.420 6.533 1.00 0.00 N ATOM 259 CD2 HIS A 16 -14.351 -14.627 7.464 1.00 0.00 C ATOM 260 CE1 HIS A 16 -14.596 -15.691 5.593 1.00 0.00 C ATOM 261 NE2 HIS A 16 -14.045 -14.589 6.107 1.00 0.00 N ATOM 0 H HIS A 16 -16.157 -17.482 11.159 1.00 0.00 H new ATOM 0 HA HIS A 16 -15.285 -18.346 8.535 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -16.750 -16.374 8.931 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -15.473 -15.588 9.839 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -14.058 -13.882 8.189 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -14.542 -15.965 4.550 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -13.514 -13.873 5.612 1.00 0.00 H new ATOM 269 N GLU A 17 -13.068 -17.132 10.632 1.00 0.00 N ATOM 270 CA GLU A 17 -11.599 -16.979 10.829 1.00 0.00 C ATOM 271 C GLU A 17 -10.902 -18.299 10.501 1.00 0.00 C ATOM 272 O GLU A 17 -9.808 -18.321 9.971 1.00 0.00 O ATOM 273 CB GLU A 17 -11.317 -16.599 12.284 1.00 0.00 C ATOM 274 CG GLU A 17 -9.824 -16.313 12.457 1.00 0.00 C ATOM 275 CD GLU A 17 -9.525 -16.044 13.933 1.00 0.00 C ATOM 276 OE1 GLU A 17 -10.448 -16.123 14.728 1.00 0.00 O ATOM 277 OE2 GLU A 17 -8.380 -15.764 14.244 1.00 0.00 O ATOM 0 H GLU A 17 -13.639 -16.924 11.451 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.222 -16.196 10.170 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.901 -15.721 12.561 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -11.622 -17.408 12.948 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -9.237 -17.161 12.105 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -9.535 -15.453 11.854 1.00 0.00 H new ATOM 284 N LEU A 18 -11.528 -19.403 10.809 1.00 0.00 N ATOM 285 CA LEU A 18 -10.901 -20.722 10.512 1.00 0.00 C ATOM 286 C LEU A 18 -10.756 -20.885 8.998 1.00 0.00 C ATOM 287 O LEU A 18 -9.805 -21.466 8.514 1.00 0.00 O ATOM 288 CB LEU A 18 -11.785 -21.840 11.063 1.00 0.00 C ATOM 289 CG LEU A 18 -11.921 -21.683 12.579 1.00 0.00 C ATOM 290 CD1 LEU A 18 -12.775 -22.825 13.135 1.00 0.00 C ATOM 291 CD2 LEU A 18 -10.534 -21.723 13.223 1.00 0.00 C ATOM 0 H LEU A 18 -12.445 -19.448 11.253 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.918 -20.773 10.979 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.768 -21.806 10.594 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.352 -22.811 10.825 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.398 -20.729 12.804 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -12.872 -22.714 14.215 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -13.764 -22.797 12.677 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -12.298 -23.779 12.910 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -10.631 -21.611 14.303 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -10.056 -22.676 12.998 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -9.925 -20.910 12.827 1.00 0.00 H new ATOM 303 N LEU A 19 -11.693 -20.376 8.245 1.00 0.00 N ATOM 304 CA LEU A 19 -11.609 -20.500 6.763 1.00 0.00 C ATOM 305 C LEU A 19 -10.532 -19.553 6.233 1.00 0.00 C ATOM 306 O LEU A 19 -9.789 -19.882 5.331 1.00 0.00 O ATOM 307 CB LEU A 19 -12.958 -20.135 6.145 1.00 0.00 C ATOM 308 CG LEU A 19 -13.979 -21.229 6.463 1.00 0.00 C ATOM 309 CD1 LEU A 19 -14.500 -21.038 7.888 1.00 0.00 C ATOM 310 CD2 LEU A 19 -15.146 -21.142 5.478 1.00 0.00 C ATOM 0 H LEU A 19 -12.513 -19.879 8.593 1.00 0.00 H new ATOM 0 HA LEU A 19 -11.353 -21.526 6.497 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -13.302 -19.177 6.536 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -12.856 -20.021 5.066 1.00 0.00 H new ATOM 0 HG LEU A 19 -13.504 -22.206 6.376 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -15.228 -21.817 8.117 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -13.669 -21.100 8.591 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -14.975 -20.061 7.974 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -15.873 -21.922 5.705 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -15.623 -20.165 5.564 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -14.775 -21.277 4.462 1.00 0.00 H new ATOM 322 N ASP A 20 -10.441 -18.374 6.789 1.00 0.00 N ATOM 323 CA ASP A 20 -9.413 -17.405 6.317 1.00 0.00 C ATOM 324 C ASP A 20 -8.017 -17.962 6.606 1.00 0.00 C ATOM 325 O ASP A 20 -7.137 -17.921 5.769 1.00 0.00 O ATOM 326 CB ASP A 20 -9.592 -16.074 7.048 1.00 0.00 C ATOM 327 CG ASP A 20 -8.698 -15.013 6.403 1.00 0.00 C ATOM 328 OD1 ASP A 20 -8.101 -15.312 5.382 1.00 0.00 O ATOM 329 OD2 ASP A 20 -8.625 -13.921 6.941 1.00 0.00 O ATOM 0 H ASP A 20 -11.034 -18.042 7.549 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.527 -17.248 5.244 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -10.635 -15.761 7.005 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.337 -16.188 8.101 1.00 0.00 H new ATOM 334 N GLU A 21 -7.807 -18.481 7.784 1.00 0.00 N ATOM 335 CA GLU A 21 -6.467 -19.039 8.124 1.00 0.00 C ATOM 336 C GLU A 21 -6.234 -20.324 7.328 1.00 0.00 C ATOM 337 O GLU A 21 -5.157 -20.565 6.818 1.00 0.00 O ATOM 338 CB GLU A 21 -6.407 -19.348 9.621 1.00 0.00 C ATOM 339 CG GLU A 21 -6.527 -18.046 10.415 1.00 0.00 C ATOM 340 CD GLU A 21 -6.411 -18.348 11.910 1.00 0.00 C ATOM 341 OE1 GLU A 21 -6.418 -19.516 12.261 1.00 0.00 O ATOM 342 OE2 GLU A 21 -6.315 -17.406 12.680 1.00 0.00 O ATOM 0 H GLU A 21 -8.504 -18.543 8.526 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.696 -18.311 7.873 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.212 -20.029 9.895 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.470 -19.849 9.863 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.745 -17.349 10.112 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.482 -17.565 10.203 1.00 0.00 H new ATOM 349 N SER A 22 -7.236 -21.153 7.216 1.00 0.00 N ATOM 350 CA SER A 22 -7.072 -22.422 6.452 1.00 0.00 C ATOM 351 C SER A 22 -6.820 -22.102 4.977 1.00 0.00 C ATOM 352 O SER A 22 -6.015 -22.734 4.323 1.00 0.00 O ATOM 353 CB SER A 22 -8.345 -23.262 6.581 1.00 0.00 C ATOM 354 OG SER A 22 -8.643 -23.462 7.955 1.00 0.00 O ATOM 0 H SER A 22 -8.161 -21.006 7.620 1.00 0.00 H new ATOM 0 HA SER A 22 -6.225 -22.980 6.852 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.177 -22.760 6.087 1.00 0.00 H new ATOM 0 HB3 SER A 22 -8.212 -24.222 6.083 1.00 0.00 H new ATOM 0 HG SER A 22 -9.429 -22.931 8.200 1.00 0.00 H new ATOM 360 N ALA A 23 -7.503 -21.123 4.449 1.00 0.00 N ATOM 361 CA ALA A 23 -7.302 -20.764 3.016 1.00 0.00 C ATOM 362 C ALA A 23 -5.879 -20.237 2.818 1.00 0.00 C ATOM 363 O ALA A 23 -5.244 -20.497 1.815 1.00 0.00 O ATOM 364 CB ALA A 23 -8.307 -19.683 2.616 1.00 0.00 C ATOM 0 H ALA A 23 -8.190 -20.557 4.947 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.452 -21.647 2.395 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.161 -19.420 1.568 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -9.321 -20.058 2.758 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -8.157 -18.799 3.236 1.00 0.00 H new ATOM 370 N LYS A 24 -5.373 -19.497 3.767 1.00 0.00 N ATOM 371 CA LYS A 24 -3.993 -18.954 3.632 1.00 0.00 C ATOM 372 C LYS A 24 -2.991 -20.110 3.599 1.00 0.00 C ATOM 373 O LYS A 24 -2.031 -20.092 2.853 1.00 0.00 O ATOM 374 CB LYS A 24 -3.682 -18.045 4.823 1.00 0.00 C ATOM 375 CG LYS A 24 -2.307 -17.404 4.631 1.00 0.00 C ATOM 376 CD LYS A 24 -1.956 -16.569 5.864 1.00 0.00 C ATOM 377 CE LYS A 24 -0.650 -15.815 5.613 1.00 0.00 C ATOM 378 NZ LYS A 24 -0.857 -14.362 5.871 1.00 0.00 N ATOM 0 H LYS A 24 -5.856 -19.246 4.629 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.918 -18.380 2.708 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.446 -17.272 4.913 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.700 -18.621 5.748 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -1.553 -18.176 4.475 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.309 -16.775 3.741 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -2.759 -15.865 6.080 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -1.854 -17.214 6.737 1.00 0.00 H new ATOM 0 HE2 LYS A 24 0.136 -16.202 6.262 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.320 -15.969 4.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.031 -13.849 5.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -1.595 -13.998 5.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.152 -14.223 6.858 1.00 0.00 H new ATOM 392 N LYS A 25 -3.206 -21.117 4.401 1.00 0.00 N ATOM 393 CA LYS A 25 -2.266 -22.274 4.415 1.00 0.00 C ATOM 394 C LYS A 25 -2.317 -22.987 3.063 1.00 0.00 C ATOM 395 O LYS A 25 -1.303 -23.366 2.511 1.00 0.00 O ATOM 396 CB LYS A 25 -2.672 -23.247 5.522 1.00 0.00 C ATOM 397 CG LYS A 25 -2.467 -22.585 6.886 1.00 0.00 C ATOM 398 CD LYS A 25 -2.721 -23.608 7.995 1.00 0.00 C ATOM 399 CE LYS A 25 -2.656 -22.910 9.355 1.00 0.00 C ATOM 400 NZ LYS A 25 -3.648 -23.531 10.279 1.00 0.00 N ATOM 0 H LYS A 25 -3.992 -21.189 5.047 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.252 -21.918 4.600 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -3.716 -23.537 5.400 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -2.078 -24.158 5.455 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.452 -22.194 6.963 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -3.144 -21.738 6.996 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -3.697 -24.073 7.859 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -1.979 -24.405 7.947 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -1.652 -22.994 9.772 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -2.865 -21.846 9.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -3.605 -23.057 11.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -4.604 -23.429 9.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -3.428 -24.541 10.397 1.00 0.00 H new ATOM 414 N ILE A 26 -3.491 -23.177 2.526 1.00 0.00 N ATOM 415 CA ILE A 26 -3.606 -23.867 1.210 1.00 0.00 C ATOM 416 C ILE A 26 -2.958 -23.008 0.123 1.00 0.00 C ATOM 417 O ILE A 26 -2.208 -23.493 -0.701 1.00 0.00 O ATOM 418 CB ILE A 26 -5.083 -24.083 0.876 1.00 0.00 C ATOM 419 CG1 ILE A 26 -5.747 -24.897 1.989 1.00 0.00 C ATOM 420 CG2 ILE A 26 -5.201 -24.840 -0.448 1.00 0.00 C ATOM 421 CD1 ILE A 26 -4.903 -26.138 2.285 1.00 0.00 C ATOM 0 H ILE A 26 -4.375 -22.884 2.942 1.00 0.00 H new ATOM 0 HA ILE A 26 -3.099 -24.831 1.260 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.579 -23.116 0.789 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.848 -24.289 2.888 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -6.753 -25.191 1.689 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -6.253 -24.994 -0.686 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -4.730 -24.260 -1.242 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.704 -25.806 -0.360 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.375 -26.718 3.078 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.825 -26.748 1.385 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.906 -25.833 2.603 1.00 0.00 H new ATOM 433 N VAL A 27 -3.241 -21.734 0.114 1.00 0.00 N ATOM 434 CA VAL A 27 -2.642 -20.844 -0.920 1.00 0.00 C ATOM 435 C VAL A 27 -1.121 -20.825 -0.760 1.00 0.00 C ATOM 436 O VAL A 27 -0.384 -20.931 -1.720 1.00 0.00 O ATOM 437 CB VAL A 27 -3.190 -19.426 -0.750 1.00 0.00 C ATOM 438 CG1 VAL A 27 -2.446 -18.476 -1.691 1.00 0.00 C ATOM 439 CG2 VAL A 27 -4.682 -19.412 -1.087 1.00 0.00 C ATOM 0 H VAL A 27 -3.861 -21.271 0.778 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.897 -21.217 -1.912 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.047 -19.102 0.281 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.836 -17.465 -1.571 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.383 -18.486 -1.452 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.589 -18.799 -2.722 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -5.073 -18.402 -0.966 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.825 -19.735 -2.118 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.213 -20.089 -0.417 1.00 0.00 H new ATOM 449 N GLU A 28 -0.644 -20.690 0.447 1.00 0.00 N ATOM 450 CA GLU A 28 0.830 -20.663 0.668 1.00 0.00 C ATOM 451 C GLU A 28 1.436 -22.001 0.239 1.00 0.00 C ATOM 452 O GLU A 28 2.412 -22.047 -0.483 1.00 0.00 O ATOM 453 CB GLU A 28 1.118 -20.424 2.152 1.00 0.00 C ATOM 454 CG GLU A 28 2.619 -20.207 2.351 1.00 0.00 C ATOM 455 CD GLU A 28 2.914 -20.017 3.841 1.00 0.00 C ATOM 456 OE1 GLU A 28 1.979 -20.080 4.622 1.00 0.00 O ATOM 457 OE2 GLU A 28 4.069 -19.811 4.175 1.00 0.00 O ATOM 0 H GLU A 28 -1.211 -20.597 1.290 1.00 0.00 H new ATOM 0 HA GLU A 28 1.271 -19.860 0.078 1.00 0.00 H new ATOM 0 HB2 GLU A 28 0.564 -19.555 2.506 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.782 -21.277 2.741 1.00 0.00 H new ATOM 0 HG2 GLU A 28 3.175 -21.061 1.965 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.948 -19.333 1.790 1.00 0.00 H new ATOM 464 N VAL A 29 0.867 -23.090 0.680 1.00 0.00 N ATOM 465 CA VAL A 29 1.414 -24.422 0.297 1.00 0.00 C ATOM 466 C VAL A 29 1.163 -24.669 -1.191 1.00 0.00 C ATOM 467 O VAL A 29 2.045 -25.081 -1.920 1.00 0.00 O ATOM 468 CB VAL A 29 0.721 -25.511 1.118 1.00 0.00 C ATOM 469 CG1 VAL A 29 1.279 -26.880 0.722 1.00 0.00 C ATOM 470 CG2 VAL A 29 0.975 -25.268 2.607 1.00 0.00 C ATOM 0 H VAL A 29 0.048 -23.115 1.288 1.00 0.00 H new ATOM 0 HA VAL A 29 2.486 -24.444 0.492 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.351 -25.485 0.924 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.786 -27.657 1.306 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.098 -27.054 -0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.351 -26.906 0.916 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.481 -26.044 3.192 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.047 -25.294 2.802 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.578 -24.293 2.889 1.00 0.00 H new ATOM 480 N ALA A 30 -0.033 -24.423 -1.651 1.00 0.00 N ATOM 481 CA ALA A 30 -0.339 -24.646 -3.092 1.00 0.00 C ATOM 482 C ALA A 30 0.542 -23.733 -3.948 1.00 0.00 C ATOM 483 O ALA A 30 1.173 -24.169 -4.891 1.00 0.00 O ATOM 484 CB ALA A 30 -1.811 -24.328 -3.358 1.00 0.00 C ATOM 0 H ALA A 30 -0.812 -24.077 -1.091 1.00 0.00 H new ATOM 0 HA ALA A 30 -0.141 -25.687 -3.347 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -2.034 -24.491 -4.412 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -2.439 -24.978 -2.749 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -2.010 -23.287 -3.102 1.00 0.00 H new ATOM 490 N LYS A 31 0.593 -22.469 -3.628 1.00 0.00 N ATOM 491 CA LYS A 31 1.435 -21.533 -4.425 1.00 0.00 C ATOM 492 C LYS A 31 2.887 -22.011 -4.405 1.00 0.00 C ATOM 493 O LYS A 31 3.594 -21.922 -5.390 1.00 0.00 O ATOM 494 CB LYS A 31 1.352 -20.130 -3.820 1.00 0.00 C ATOM 495 CG LYS A 31 1.972 -19.120 -4.786 1.00 0.00 C ATOM 496 CD LYS A 31 2.038 -17.746 -4.117 1.00 0.00 C ATOM 497 CE LYS A 31 2.655 -16.735 -5.085 1.00 0.00 C ATOM 498 NZ LYS A 31 3.325 -15.651 -4.311 1.00 0.00 N ATOM 0 H LYS A 31 0.088 -22.044 -2.850 1.00 0.00 H new ATOM 0 HA LYS A 31 1.075 -21.507 -5.453 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.312 -19.869 -3.622 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.875 -20.103 -2.864 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.972 -19.444 -5.075 1.00 0.00 H new ATOM 0 HG3 LYS A 31 1.379 -19.063 -5.699 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.038 -17.423 -3.826 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.633 -17.802 -3.205 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.376 -17.231 -5.735 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.883 -16.313 -5.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.745 -14.963 -4.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.626 -15.172 -3.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 4.072 -16.061 -3.715 1.00 0.00 H new ATOM 512 N SER A 32 3.338 -22.521 -3.291 1.00 0.00 N ATOM 513 CA SER A 32 4.745 -23.006 -3.211 1.00 0.00 C ATOM 514 C SER A 32 4.976 -24.077 -4.279 1.00 0.00 C ATOM 515 O SER A 32 6.068 -24.233 -4.789 1.00 0.00 O ATOM 516 CB SER A 32 4.999 -23.604 -1.826 1.00 0.00 C ATOM 517 OG SER A 32 6.374 -23.933 -1.696 1.00 0.00 O ATOM 0 H SER A 32 2.794 -22.623 -2.434 1.00 0.00 H new ATOM 0 HA SER A 32 5.428 -22.173 -3.378 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.710 -22.892 -1.053 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.386 -24.494 -1.685 1.00 0.00 H new ATOM 0 HG SER A 32 6.537 -24.315 -0.808 1.00 0.00 H new ATOM 523 N THR A 33 3.955 -24.815 -4.623 1.00 0.00 N ATOM 524 CA THR A 33 4.117 -25.874 -5.658 1.00 0.00 C ATOM 525 C THR A 33 4.200 -25.224 -7.042 1.00 0.00 C ATOM 526 O THR A 33 3.843 -24.077 -7.222 1.00 0.00 O ATOM 527 CB THR A 33 2.915 -26.820 -5.612 1.00 0.00 C ATOM 528 OG1 THR A 33 1.765 -26.147 -6.104 1.00 0.00 O ATOM 529 CG2 THR A 33 2.668 -27.265 -4.170 1.00 0.00 C ATOM 0 H THR A 33 3.017 -24.730 -4.232 1.00 0.00 H new ATOM 0 HA THR A 33 5.030 -26.436 -5.463 1.00 0.00 H new ATOM 0 HB THR A 33 3.118 -27.694 -6.230 1.00 0.00 H new ATOM 0 HG1 THR A 33 1.412 -25.553 -5.410 1.00 0.00 H new ATOM 0 HG21 THR A 33 1.812 -27.939 -4.139 1.00 0.00 H new ATOM 0 HG22 THR A 33 3.550 -27.782 -3.793 1.00 0.00 H new ATOM 0 HG23 THR A 33 2.466 -26.392 -3.549 1.00 0.00 H new ATOM 537 N ASN A 34 4.670 -25.949 -8.020 1.00 0.00 N ATOM 538 CA ASN A 34 4.776 -25.373 -9.389 1.00 0.00 C ATOM 539 C ASN A 34 3.401 -24.873 -9.840 1.00 0.00 C ATOM 540 O ASN A 34 3.288 -23.889 -10.544 1.00 0.00 O ATOM 541 CB ASN A 34 5.272 -26.447 -10.359 1.00 0.00 C ATOM 542 CG ASN A 34 6.687 -26.875 -9.964 1.00 0.00 C ATOM 543 OD1 ASN A 34 7.366 -26.175 -9.242 1.00 0.00 O ATOM 544 ND2 ASN A 34 7.163 -28.004 -10.413 1.00 0.00 N ATOM 0 H ASN A 34 4.985 -26.915 -7.930 1.00 0.00 H new ATOM 0 HA ASN A 34 5.480 -24.541 -9.379 1.00 0.00 H new ATOM 0 HB2 ASN A 34 4.602 -27.306 -10.341 1.00 0.00 H new ATOM 0 HB3 ASN A 34 5.268 -26.061 -11.379 1.00 0.00 H new ATOM 0 HD21 ASN A 34 8.106 -28.298 -10.157 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.592 -28.593 -11.020 1.00 0.00 H new ATOM 551 N SER A 35 2.355 -25.543 -9.439 1.00 0.00 N ATOM 552 CA SER A 35 0.990 -25.105 -9.845 1.00 0.00 C ATOM 553 C SER A 35 0.690 -23.736 -9.231 1.00 0.00 C ATOM 554 O SER A 35 1.273 -23.350 -8.237 1.00 0.00 O ATOM 555 CB SER A 35 -0.041 -26.122 -9.350 1.00 0.00 C ATOM 556 OG SER A 35 -0.181 -26.007 -7.942 1.00 0.00 O ATOM 0 H SER A 35 2.387 -26.374 -8.848 1.00 0.00 H new ATOM 0 HA SER A 35 0.939 -25.036 -10.932 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.001 -25.949 -9.837 1.00 0.00 H new ATOM 0 HB3 SER A 35 0.273 -27.132 -9.614 1.00 0.00 H new ATOM 0 HG SER A 35 0.706 -25.971 -7.527 1.00 0.00 H new ATOM 562 N LYS A 36 -0.214 -22.997 -9.815 1.00 0.00 N ATOM 563 CA LYS A 36 -0.549 -21.654 -9.264 1.00 0.00 C ATOM 564 C LYS A 36 -1.932 -21.700 -8.611 1.00 0.00 C ATOM 565 O LYS A 36 -2.740 -22.557 -8.907 1.00 0.00 O ATOM 566 CB LYS A 36 -0.554 -20.625 -10.396 1.00 0.00 C ATOM 567 CG LYS A 36 0.847 -20.531 -11.007 1.00 0.00 C ATOM 568 CD LYS A 36 0.864 -19.436 -12.075 1.00 0.00 C ATOM 569 CE LYS A 36 2.246 -19.382 -12.728 1.00 0.00 C ATOM 570 NZ LYS A 36 2.109 -18.928 -14.142 1.00 0.00 N ATOM 0 H LYS A 36 -0.735 -23.266 -10.650 1.00 0.00 H new ATOM 0 HA LYS A 36 0.195 -21.372 -8.519 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.277 -20.912 -11.160 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -0.862 -19.651 -10.015 1.00 0.00 H new ATOM 0 HG2 LYS A 36 1.580 -20.309 -10.231 1.00 0.00 H new ATOM 0 HG3 LYS A 36 1.129 -21.488 -11.447 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.102 -19.636 -12.828 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.624 -18.472 -11.627 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.894 -18.701 -12.177 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.715 -20.365 -12.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 3.048 -18.891 -14.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 1.505 -19.595 -14.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.678 -17.982 -14.163 1.00 0.00 H new ATOM 584 N VAL A 37 -2.210 -20.783 -7.725 1.00 0.00 N ATOM 585 CA VAL A 37 -3.540 -20.773 -7.054 1.00 0.00 C ATOM 586 C VAL A 37 -4.115 -19.356 -7.085 1.00 0.00 C ATOM 587 O VAL A 37 -3.393 -18.382 -6.996 1.00 0.00 O ATOM 588 CB VAL A 37 -3.383 -21.230 -5.602 1.00 0.00 C ATOM 589 CG1 VAL A 37 -2.648 -22.572 -5.567 1.00 0.00 C ATOM 590 CG2 VAL A 37 -2.578 -20.187 -4.824 1.00 0.00 C ATOM 0 H VAL A 37 -1.573 -20.040 -7.437 1.00 0.00 H new ATOM 0 HA VAL A 37 -4.216 -21.451 -7.576 1.00 0.00 H new ATOM 0 HB VAL A 37 -4.367 -21.343 -5.147 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -2.536 -22.898 -4.533 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -3.221 -23.315 -6.122 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.663 -22.460 -6.021 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -2.466 -20.512 -3.790 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -1.593 -20.074 -5.278 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.101 -19.231 -4.849 1.00 0.00 H new ATOM 600 N SER A 38 -5.408 -19.229 -7.215 1.00 0.00 N ATOM 601 CA SER A 38 -6.022 -17.872 -7.253 1.00 0.00 C ATOM 602 C SER A 38 -7.061 -17.746 -6.138 1.00 0.00 C ATOM 603 O SER A 38 -7.645 -18.720 -5.706 1.00 0.00 O ATOM 604 CB SER A 38 -6.699 -17.657 -8.608 1.00 0.00 C ATOM 605 OG SER A 38 -5.809 -18.035 -9.647 1.00 0.00 O ATOM 0 H SER A 38 -6.064 -20.006 -7.296 1.00 0.00 H new ATOM 0 HA SER A 38 -5.246 -17.120 -7.110 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.614 -18.246 -8.667 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.985 -16.611 -8.722 1.00 0.00 H new ATOM 0 HG SER A 38 -5.992 -17.498 -10.446 1.00 0.00 H new ATOM 611 N GLY A 39 -7.294 -16.551 -5.667 1.00 0.00 N ATOM 612 CA GLY A 39 -8.294 -16.360 -4.579 1.00 0.00 C ATOM 613 C GLY A 39 -7.571 -15.965 -3.290 1.00 0.00 C ATOM 614 O GLY A 39 -6.587 -15.252 -3.314 1.00 0.00 O ATOM 0 H GLY A 39 -6.835 -15.699 -5.989 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -9.010 -15.587 -4.859 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.860 -17.278 -4.425 1.00 0.00 H new ATOM 618 N PRO A 40 -8.070 -16.445 -2.142 1.00 0.00 N ATOM 619 CA PRO A 40 -9.256 -17.309 -2.091 1.00 0.00 C ATOM 620 C PRO A 40 -10.537 -16.535 -2.421 1.00 0.00 C ATOM 621 O PRO A 40 -10.667 -15.368 -2.107 1.00 0.00 O ATOM 622 CB PRO A 40 -9.294 -17.778 -0.638 1.00 0.00 C ATOM 623 CG PRO A 40 -8.571 -16.717 0.121 1.00 0.00 C ATOM 624 CD PRO A 40 -7.513 -16.184 -0.803 1.00 0.00 C ATOM 0 HA PRO A 40 -9.201 -18.121 -2.816 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -10.319 -17.889 -0.284 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.810 -18.748 -0.522 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -9.254 -15.925 0.428 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -8.125 -17.124 1.029 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -7.336 -15.121 -0.641 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -6.559 -16.692 -0.658 1.00 0.00 H new ATOM 632 N ILE A 41 -11.484 -17.178 -3.047 1.00 0.00 N ATOM 633 CA ILE A 41 -12.755 -16.480 -3.391 1.00 0.00 C ATOM 634 C ILE A 41 -13.744 -16.632 -2.233 1.00 0.00 C ATOM 635 O ILE A 41 -14.188 -17.720 -1.923 1.00 0.00 O ATOM 636 CB ILE A 41 -13.350 -17.099 -4.655 1.00 0.00 C ATOM 637 CG1 ILE A 41 -12.284 -17.151 -5.751 1.00 0.00 C ATOM 638 CG2 ILE A 41 -14.530 -16.250 -5.133 1.00 0.00 C ATOM 639 CD1 ILE A 41 -12.182 -18.576 -6.299 1.00 0.00 C ATOM 0 H ILE A 41 -11.433 -18.155 -3.335 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.556 -15.423 -3.565 1.00 0.00 H new ATOM 0 HB ILE A 41 -13.694 -18.110 -4.435 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -12.539 -16.459 -6.554 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -11.321 -16.834 -5.351 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.954 -16.692 -6.035 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -15.291 -16.214 -4.354 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.186 -15.239 -5.351 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -11.422 -18.612 -7.080 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -11.907 -19.257 -5.493 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -13.144 -18.876 -6.715 1.00 0.00 H new ATOM 651 N PRO A 42 -14.089 -15.513 -1.580 1.00 0.00 N ATOM 652 CA PRO A 42 -15.023 -15.511 -0.448 1.00 0.00 C ATOM 653 C PRO A 42 -16.467 -15.752 -0.897 1.00 0.00 C ATOM 654 O PRO A 42 -16.906 -15.242 -1.908 1.00 0.00 O ATOM 655 CB PRO A 42 -14.884 -14.103 0.128 1.00 0.00 C ATOM 656 CG PRO A 42 -14.417 -13.267 -1.016 1.00 0.00 C ATOM 657 CD PRO A 42 -13.593 -14.164 -1.898 1.00 0.00 C ATOM 0 HA PRO A 42 -14.799 -16.303 0.266 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -15.834 -13.741 0.521 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -14.170 -14.081 0.951 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -15.264 -12.855 -1.566 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -13.826 -12.423 -0.662 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -13.730 -13.925 -2.953 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -12.528 -14.068 -1.685 1.00 0.00 H new ATOM 665 N LEU A 43 -17.209 -16.523 -0.149 1.00 0.00 N ATOM 666 CA LEU A 43 -18.623 -16.794 -0.530 1.00 0.00 C ATOM 667 C LEU A 43 -19.553 -16.272 0.567 1.00 0.00 C ATOM 668 O LEU A 43 -19.121 -15.951 1.657 1.00 0.00 O ATOM 669 CB LEU A 43 -18.827 -18.301 -0.698 1.00 0.00 C ATOM 670 CG LEU A 43 -18.539 -18.697 -2.147 1.00 0.00 C ATOM 671 CD1 LEU A 43 -19.658 -18.174 -3.051 1.00 0.00 C ATOM 672 CD2 LEU A 43 -17.204 -18.091 -2.586 1.00 0.00 C ATOM 0 H LEU A 43 -16.896 -16.977 0.709 1.00 0.00 H new ATOM 0 HA LEU A 43 -18.850 -16.291 -1.470 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -18.167 -18.845 -0.023 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -19.849 -18.572 -0.432 1.00 0.00 H new ATOM 0 HG LEU A 43 -18.488 -19.783 -2.223 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -19.453 -18.456 -4.084 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -20.609 -18.605 -2.739 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -19.710 -17.088 -2.975 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -16.998 -18.373 -3.619 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -17.255 -17.005 -2.510 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -16.407 -18.463 -1.943 1.00 0.00 H new ATOM 684 N PRO A 44 -20.858 -16.188 0.269 1.00 0.00 N ATOM 685 CA PRO A 44 -21.860 -15.704 1.228 1.00 0.00 C ATOM 686 C PRO A 44 -22.073 -16.696 2.376 1.00 0.00 C ATOM 687 O PRO A 44 -22.314 -17.868 2.160 1.00 0.00 O ATOM 688 CB PRO A 44 -23.133 -15.592 0.390 1.00 0.00 C ATOM 689 CG PRO A 44 -22.932 -16.560 -0.727 1.00 0.00 C ATOM 690 CD PRO A 44 -21.460 -16.557 -1.024 1.00 0.00 C ATOM 0 HA PRO A 44 -21.559 -14.767 1.697 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -24.017 -15.841 0.977 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -23.274 -14.578 0.016 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -23.270 -17.557 -0.444 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -23.507 -16.266 -1.605 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -21.116 -17.533 -1.365 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -21.208 -15.840 -1.805 1.00 0.00 H new ATOM 698 N THR A 45 -21.987 -16.236 3.595 1.00 0.00 N ATOM 699 CA THR A 45 -22.183 -17.152 4.754 1.00 0.00 C ATOM 700 C THR A 45 -23.648 -17.591 4.814 1.00 0.00 C ATOM 701 O THR A 45 -24.532 -16.904 4.343 1.00 0.00 O ATOM 702 CB THR A 45 -21.815 -16.422 6.047 1.00 0.00 C ATOM 703 OG1 THR A 45 -20.547 -15.801 5.894 1.00 0.00 O ATOM 704 CG2 THR A 45 -21.758 -17.423 7.202 1.00 0.00 C ATOM 0 H THR A 45 -21.789 -15.265 3.838 1.00 0.00 H new ATOM 0 HA THR A 45 -21.546 -18.029 4.638 1.00 0.00 H new ATOM 0 HB THR A 45 -22.568 -15.664 6.263 1.00 0.00 H new ATOM 0 HG1 THR A 45 -19.912 -16.192 6.530 1.00 0.00 H new ATOM 0 HG21 THR A 45 -21.496 -16.902 8.123 1.00 0.00 H new ATOM 0 HG22 THR A 45 -22.732 -17.899 7.319 1.00 0.00 H new ATOM 0 HG23 THR A 45 -21.006 -18.183 6.988 1.00 0.00 H new ATOM 712 N GLU A 46 -23.912 -18.732 5.392 1.00 0.00 N ATOM 713 CA GLU A 46 -25.319 -19.214 5.482 1.00 0.00 C ATOM 714 C GLU A 46 -25.683 -19.454 6.948 1.00 0.00 C ATOM 715 O GLU A 46 -25.074 -20.259 7.625 1.00 0.00 O ATOM 716 CB GLU A 46 -25.462 -20.521 4.700 1.00 0.00 C ATOM 717 CG GLU A 46 -26.902 -21.025 4.808 1.00 0.00 C ATOM 718 CD GLU A 46 -26.987 -22.450 4.257 1.00 0.00 C ATOM 719 OE1 GLU A 46 -25.955 -22.980 3.878 1.00 0.00 O ATOM 720 OE2 GLU A 46 -28.082 -22.986 4.222 1.00 0.00 O ATOM 0 H GLU A 46 -23.214 -19.350 5.805 1.00 0.00 H new ATOM 0 HA GLU A 46 -25.988 -18.464 5.060 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -25.198 -20.362 3.654 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -24.773 -21.269 5.092 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -27.228 -21.006 5.848 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -27.571 -20.368 4.252 1.00 0.00 H new ATOM 727 N SER A 47 -26.672 -18.762 7.446 1.00 0.00 N ATOM 728 CA SER A 47 -27.072 -18.952 8.869 1.00 0.00 C ATOM 729 C SER A 47 -25.888 -18.618 9.778 1.00 0.00 C ATOM 730 O SER A 47 -25.751 -17.509 10.255 1.00 0.00 O ATOM 731 CB SER A 47 -27.491 -20.406 9.091 1.00 0.00 C ATOM 732 OG SER A 47 -28.862 -20.560 8.753 1.00 0.00 O ATOM 0 H SER A 47 -27.220 -18.074 6.929 1.00 0.00 H new ATOM 0 HA SER A 47 -27.908 -18.294 9.103 1.00 0.00 H new ATOM 0 HB2 SER A 47 -26.878 -21.070 8.481 1.00 0.00 H new ATOM 0 HB3 SER A 47 -27.328 -20.688 10.131 1.00 0.00 H new ATOM 0 HG SER A 47 -29.131 -21.492 8.893 1.00 0.00 H new ATOM 738 N ARG A 48 -25.029 -19.570 10.021 1.00 0.00 N ATOM 739 CA ARG A 48 -23.853 -19.307 10.898 1.00 0.00 C ATOM 740 C ARG A 48 -22.643 -20.081 10.372 1.00 0.00 C ATOM 741 O ARG A 48 -21.714 -20.368 11.100 1.00 0.00 O ATOM 742 CB ARG A 48 -24.169 -19.762 12.325 1.00 0.00 C ATOM 743 CG ARG A 48 -25.339 -18.942 12.873 1.00 0.00 C ATOM 744 CD ARG A 48 -25.512 -19.236 14.365 1.00 0.00 C ATOM 745 NE ARG A 48 -26.835 -18.723 14.820 1.00 0.00 N ATOM 746 CZ ARG A 48 -27.217 -18.910 16.054 1.00 0.00 C ATOM 747 NH1 ARG A 48 -26.515 -18.414 17.036 1.00 0.00 N ATOM 748 NH2 ARG A 48 -28.301 -19.592 16.306 1.00 0.00 N ATOM 0 H ARG A 48 -25.091 -20.518 9.650 1.00 0.00 H new ATOM 0 HA ARG A 48 -23.630 -18.240 10.898 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -24.419 -20.823 12.333 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -23.293 -19.636 12.961 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -25.155 -17.879 12.720 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -26.254 -19.188 12.334 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -25.444 -20.309 14.546 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -24.711 -18.765 14.935 1.00 0.00 H new ATOM 0 HE ARG A 48 -27.442 -18.226 14.168 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -25.668 -17.880 16.839 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -26.813 -18.560 18.001 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -28.850 -19.979 15.538 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -28.599 -19.738 17.271 1.00 0.00 H new ATOM 762 N VAL A 49 -22.647 -20.422 9.113 1.00 0.00 N ATOM 763 CA VAL A 49 -21.497 -21.178 8.542 1.00 0.00 C ATOM 764 C VAL A 49 -20.905 -20.395 7.368 1.00 0.00 C ATOM 765 O VAL A 49 -21.608 -19.988 6.465 1.00 0.00 O ATOM 766 CB VAL A 49 -21.978 -22.545 8.051 1.00 0.00 C ATOM 767 CG1 VAL A 49 -20.793 -23.331 7.487 1.00 0.00 C ATOM 768 CG2 VAL A 49 -22.594 -23.319 9.219 1.00 0.00 C ATOM 0 H VAL A 49 -23.397 -20.210 8.455 1.00 0.00 H new ATOM 0 HA VAL A 49 -20.735 -21.315 9.310 1.00 0.00 H new ATOM 0 HB VAL A 49 -22.727 -22.408 7.271 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -21.136 -24.305 7.137 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -20.354 -22.780 6.655 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -20.044 -23.469 8.266 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -22.937 -24.293 8.870 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -21.846 -23.456 10.000 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -23.439 -22.760 9.621 1.00 0.00 H new ATOM 778 N HIS A 50 -19.619 -20.179 7.375 1.00 0.00 N ATOM 779 CA HIS A 50 -18.985 -19.420 6.260 1.00 0.00 C ATOM 780 C HIS A 50 -18.390 -20.401 5.249 1.00 0.00 C ATOM 781 O HIS A 50 -18.111 -21.540 5.566 1.00 0.00 O ATOM 782 CB HIS A 50 -17.878 -18.526 6.819 1.00 0.00 C ATOM 783 CG HIS A 50 -18.429 -17.695 7.945 1.00 0.00 C ATOM 784 ND1 HIS A 50 -19.033 -16.466 7.730 1.00 0.00 N ATOM 785 CD2 HIS A 50 -18.479 -17.904 9.301 1.00 0.00 C ATOM 786 CE1 HIS A 50 -19.415 -15.987 8.928 1.00 0.00 C ATOM 787 NE2 HIS A 50 -19.102 -16.824 9.919 1.00 0.00 N ATOM 0 H HIS A 50 -18.980 -20.495 8.104 1.00 0.00 H new ATOM 0 HA HIS A 50 -19.735 -18.803 5.766 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -17.048 -19.136 7.175 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -17.486 -17.880 6.034 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -18.093 -18.775 9.811 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -19.914 -15.040 9.070 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -19.281 -16.699 10.915 1.00 0.00 H new ATOM 795 N LYS A 51 -18.196 -19.970 4.032 1.00 0.00 N ATOM 796 CA LYS A 51 -17.622 -20.882 3.003 1.00 0.00 C ATOM 797 C LYS A 51 -16.665 -20.102 2.100 1.00 0.00 C ATOM 798 O LYS A 51 -16.947 -18.993 1.688 1.00 0.00 O ATOM 799 CB LYS A 51 -18.751 -21.471 2.156 1.00 0.00 C ATOM 800 CG LYS A 51 -19.703 -22.264 3.053 1.00 0.00 C ATOM 801 CD LYS A 51 -20.685 -23.052 2.183 1.00 0.00 C ATOM 802 CE LYS A 51 -21.345 -22.109 1.176 1.00 0.00 C ATOM 803 NZ LYS A 51 -22.600 -22.728 0.664 1.00 0.00 N ATOM 0 H LYS A 51 -18.410 -19.027 3.707 1.00 0.00 H new ATOM 0 HA LYS A 51 -17.078 -21.687 3.498 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -19.293 -20.673 1.648 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -18.339 -22.119 1.382 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -19.138 -22.944 3.690 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -20.247 -21.588 3.713 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -20.162 -23.852 1.659 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -21.444 -23.523 2.808 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -21.566 -21.152 1.649 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -20.663 -21.907 0.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -23.049 -22.087 -0.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -22.377 -23.631 0.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -23.251 -22.899 1.457 1.00 0.00 H new ATOM 817 N ARG A 52 -15.538 -20.676 1.784 1.00 0.00 N ATOM 818 CA ARG A 52 -14.562 -19.977 0.903 1.00 0.00 C ATOM 819 C ARG A 52 -14.100 -20.936 -0.195 1.00 0.00 C ATOM 820 O ARG A 52 -14.058 -22.135 -0.005 1.00 0.00 O ATOM 821 CB ARG A 52 -13.356 -19.526 1.731 1.00 0.00 C ATOM 822 CG ARG A 52 -13.795 -18.453 2.729 1.00 0.00 C ATOM 823 CD ARG A 52 -12.571 -17.925 3.481 1.00 0.00 C ATOM 824 NE ARG A 52 -11.743 -17.096 2.560 1.00 0.00 N ATOM 825 CZ ARG A 52 -11.370 -15.899 2.920 1.00 0.00 C ATOM 826 NH1 ARG A 52 -12.238 -14.925 2.946 1.00 0.00 N ATOM 827 NH2 ARG A 52 -10.129 -15.675 3.255 1.00 0.00 N ATOM 0 H ARG A 52 -15.250 -21.602 2.099 1.00 0.00 H new ATOM 0 HA ARG A 52 -15.035 -19.105 0.452 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -12.926 -20.376 2.261 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -12.578 -19.132 1.076 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.294 -17.637 2.206 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -14.516 -18.869 3.433 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -12.886 -17.331 4.339 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -11.982 -18.756 3.868 1.00 0.00 H new ATOM 0 HE ARG A 52 -11.468 -17.464 1.649 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -13.208 -15.100 2.685 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -11.946 -13.989 3.228 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.450 -16.436 3.235 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.838 -14.739 3.536 1.00 0.00 H new ATOM 841 N LEU A 53 -13.755 -20.422 -1.343 1.00 0.00 N ATOM 842 CA LEU A 53 -13.301 -21.313 -2.447 1.00 0.00 C ATOM 843 C LEU A 53 -11.949 -20.834 -2.974 1.00 0.00 C ATOM 844 O LEU A 53 -11.668 -19.652 -3.012 1.00 0.00 O ATOM 845 CB LEU A 53 -14.326 -21.282 -3.582 1.00 0.00 C ATOM 846 CG LEU A 53 -15.576 -22.055 -3.161 1.00 0.00 C ATOM 847 CD1 LEU A 53 -16.318 -21.271 -2.078 1.00 0.00 C ATOM 848 CD2 LEU A 53 -16.490 -22.244 -4.374 1.00 0.00 C ATOM 0 H LEU A 53 -13.768 -19.426 -1.564 1.00 0.00 H new ATOM 0 HA LEU A 53 -13.203 -22.331 -2.069 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -14.587 -20.251 -3.823 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -13.900 -21.722 -4.484 1.00 0.00 H new ATOM 0 HG LEU A 53 -15.287 -23.030 -2.769 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -17.210 -21.821 -1.777 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -15.666 -21.136 -1.215 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -16.608 -20.296 -2.469 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -17.382 -22.795 -4.075 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -16.780 -21.269 -4.766 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -15.960 -22.802 -5.146 1.00 0.00 H new ATOM 860 N ILE A 54 -11.109 -21.744 -3.382 1.00 0.00 N ATOM 861 CA ILE A 54 -9.775 -21.346 -3.910 1.00 0.00 C ATOM 862 C ILE A 54 -9.600 -21.912 -5.322 1.00 0.00 C ATOM 863 O ILE A 54 -9.605 -23.109 -5.526 1.00 0.00 O ATOM 864 CB ILE A 54 -8.680 -21.903 -2.998 1.00 0.00 C ATOM 865 CG1 ILE A 54 -8.904 -21.402 -1.569 1.00 0.00 C ATOM 866 CG2 ILE A 54 -7.313 -21.429 -3.496 1.00 0.00 C ATOM 867 CD1 ILE A 54 -7.889 -22.063 -0.633 1.00 0.00 C ATOM 0 H ILE A 54 -11.289 -22.748 -3.372 1.00 0.00 H new ATOM 0 HA ILE A 54 -9.703 -20.259 -3.941 1.00 0.00 H new ATOM 0 HB ILE A 54 -8.714 -22.992 -3.011 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -8.798 -20.318 -1.531 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -9.919 -21.634 -1.245 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.532 -21.825 -2.847 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.154 -21.784 -4.514 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -7.278 -20.340 -3.482 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.047 -21.707 0.385 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -8.017 -23.145 -0.663 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -6.879 -21.808 -0.953 1.00 0.00 H new ATOM 879 N ASP A 55 -9.447 -21.059 -6.298 1.00 0.00 N ATOM 880 CA ASP A 55 -9.275 -21.552 -7.694 1.00 0.00 C ATOM 881 C ASP A 55 -7.835 -22.029 -7.893 1.00 0.00 C ATOM 882 O ASP A 55 -6.898 -21.428 -7.409 1.00 0.00 O ATOM 883 CB ASP A 55 -9.576 -20.420 -8.676 1.00 0.00 C ATOM 884 CG ASP A 55 -9.805 -21.003 -10.072 1.00 0.00 C ATOM 885 OD1 ASP A 55 -9.740 -22.213 -10.204 1.00 0.00 O ATOM 886 OD2 ASP A 55 -10.041 -20.227 -10.984 1.00 0.00 O ATOM 0 H ASP A 55 -9.434 -20.045 -6.190 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.961 -22.380 -7.873 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -10.458 -19.868 -8.352 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -8.747 -19.713 -8.697 1.00 0.00 H new ATOM 891 N ILE A 56 -7.652 -23.107 -8.606 1.00 0.00 N ATOM 892 CA ILE A 56 -6.273 -23.622 -8.838 1.00 0.00 C ATOM 893 C ILE A 56 -5.996 -23.670 -10.342 1.00 0.00 C ATOM 894 O ILE A 56 -6.730 -24.273 -11.100 1.00 0.00 O ATOM 895 CB ILE A 56 -6.150 -25.028 -8.250 1.00 0.00 C ATOM 896 CG1 ILE A 56 -6.460 -24.983 -6.751 1.00 0.00 C ATOM 897 CG2 ILE A 56 -4.726 -25.547 -8.461 1.00 0.00 C ATOM 898 CD1 ILE A 56 -6.311 -26.385 -6.157 1.00 0.00 C ATOM 0 H ILE A 56 -8.398 -23.653 -9.038 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.551 -22.963 -8.356 1.00 0.00 H new ATOM 0 HB ILE A 56 -6.856 -25.693 -8.748 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.784 -24.290 -6.250 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -7.473 -24.614 -6.589 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -4.638 -26.549 -8.042 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -4.505 -25.579 -9.528 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -4.019 -24.883 -7.964 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.532 -26.353 -5.090 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.005 -27.065 -6.651 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -5.290 -26.737 -6.306 1.00 0.00 H new ATOM 910 N ILE A 57 -4.943 -23.036 -10.781 1.00 0.00 N ATOM 911 CA ILE A 57 -4.622 -23.044 -12.236 1.00 0.00 C ATOM 912 C ILE A 57 -3.401 -23.932 -12.486 1.00 0.00 C ATOM 913 O ILE A 57 -2.449 -23.922 -11.730 1.00 0.00 O ATOM 914 CB ILE A 57 -4.319 -21.619 -12.698 1.00 0.00 C ATOM 915 CG1 ILE A 57 -5.494 -20.705 -12.340 1.00 0.00 C ATOM 916 CG2 ILE A 57 -4.109 -21.607 -14.214 1.00 0.00 C ATOM 917 CD1 ILE A 57 -5.122 -19.253 -12.650 1.00 0.00 C ATOM 0 H ILE A 57 -4.292 -22.513 -10.195 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.474 -23.434 -12.793 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.416 -21.262 -12.203 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.379 -20.994 -12.906 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -5.743 -20.811 -11.284 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.893 -20.591 -14.543 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -3.273 -22.257 -14.471 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -5.012 -21.965 -14.709 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -5.958 -18.601 -12.396 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -4.248 -18.968 -12.064 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -4.895 -19.154 -13.711 1.00 0.00 H new ATOM 929 N ASP A 58 -3.421 -24.698 -13.541 1.00 0.00 N ATOM 930 CA ASP A 58 -2.261 -25.585 -13.842 1.00 0.00 C ATOM 931 C ASP A 58 -1.903 -26.401 -12.599 1.00 0.00 C ATOM 932 O ASP A 58 -0.827 -26.269 -12.048 1.00 0.00 O ATOM 933 CB ASP A 58 -1.061 -24.731 -14.255 1.00 0.00 C ATOM 934 CG ASP A 58 -0.329 -25.408 -15.415 1.00 0.00 C ATOM 935 OD1 ASP A 58 0.197 -26.488 -15.208 1.00 0.00 O ATOM 936 OD2 ASP A 58 -0.308 -24.834 -16.492 1.00 0.00 O ATOM 0 H ASP A 58 -4.191 -24.749 -14.209 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.524 -26.262 -14.655 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.394 -23.736 -14.552 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -0.385 -24.602 -13.410 1.00 0.00 H new ATOM 941 N PRO A 59 -2.828 -27.263 -12.152 1.00 0.00 N ATOM 942 CA PRO A 59 -2.616 -28.110 -10.972 1.00 0.00 C ATOM 943 C PRO A 59 -1.585 -29.210 -11.243 1.00 0.00 C ATOM 944 O PRO A 59 -1.506 -29.743 -12.332 1.00 0.00 O ATOM 945 CB PRO A 59 -3.991 -28.730 -10.725 1.00 0.00 C ATOM 946 CG PRO A 59 -4.661 -28.704 -12.058 1.00 0.00 C ATOM 947 CD PRO A 59 -4.151 -27.477 -12.761 1.00 0.00 C ATOM 0 HA PRO A 59 -2.232 -27.544 -10.124 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -3.904 -29.748 -10.345 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -4.556 -28.161 -9.986 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.429 -29.604 -12.628 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -5.745 -28.667 -11.948 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -4.078 -27.631 -13.838 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -4.809 -26.622 -12.605 1.00 0.00 H new ATOM 955 N SER A 60 -0.796 -29.555 -10.262 1.00 0.00 N ATOM 956 CA SER A 60 0.226 -30.619 -10.467 1.00 0.00 C ATOM 957 C SER A 60 0.150 -31.631 -9.322 1.00 0.00 C ATOM 958 O SER A 60 -0.553 -31.433 -8.351 1.00 0.00 O ATOM 959 CB SER A 60 1.620 -29.989 -10.499 1.00 0.00 C ATOM 960 OG SER A 60 2.150 -30.079 -11.813 1.00 0.00 O ATOM 0 H SER A 60 -0.815 -29.146 -9.328 1.00 0.00 H new ATOM 0 HA SER A 60 0.034 -31.127 -11.412 1.00 0.00 H new ATOM 0 HB2 SER A 60 1.567 -28.946 -10.188 1.00 0.00 H new ATOM 0 HB3 SER A 60 2.277 -30.499 -9.795 1.00 0.00 H new ATOM 0 HG SER A 60 3.042 -29.674 -11.834 1.00 0.00 H new ATOM 966 N PRO A 61 0.895 -32.740 -9.445 1.00 0.00 N ATOM 967 CA PRO A 61 0.920 -33.797 -8.425 1.00 0.00 C ATOM 968 C PRO A 61 1.592 -33.325 -7.132 1.00 0.00 C ATOM 969 O PRO A 61 1.309 -33.818 -6.059 1.00 0.00 O ATOM 970 CB PRO A 61 1.752 -34.903 -9.076 1.00 0.00 C ATOM 971 CG PRO A 61 2.604 -34.191 -10.071 1.00 0.00 C ATOM 972 CD PRO A 61 1.773 -33.050 -10.585 1.00 0.00 C ATOM 0 HA PRO A 61 -0.083 -34.113 -8.139 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.358 -35.430 -8.339 1.00 0.00 H new ATOM 0 HB3 PRO A 61 1.117 -35.647 -9.557 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.523 -33.828 -9.610 1.00 0.00 H new ATOM 0 HG3 PRO A 61 2.896 -34.857 -10.882 1.00 0.00 H new ATOM 0 HD2 PRO A 61 2.389 -32.195 -10.864 1.00 0.00 H new ATOM 0 HD3 PRO A 61 1.202 -33.333 -11.469 1.00 0.00 H new ATOM 980 N LYS A 62 2.477 -32.371 -7.226 1.00 0.00 N ATOM 981 CA LYS A 62 3.160 -31.870 -6.001 1.00 0.00 C ATOM 982 C LYS A 62 2.122 -31.258 -5.059 1.00 0.00 C ATOM 983 O LYS A 62 2.347 -31.127 -3.871 1.00 0.00 O ATOM 984 CB LYS A 62 4.188 -30.804 -6.386 1.00 0.00 C ATOM 985 CG LYS A 62 5.238 -31.418 -7.314 1.00 0.00 C ATOM 986 CD LYS A 62 6.260 -30.348 -7.704 1.00 0.00 C ATOM 987 CE LYS A 62 6.999 -29.869 -6.452 1.00 0.00 C ATOM 988 NZ LYS A 62 8.462 -29.816 -6.729 1.00 0.00 N ATOM 0 H LYS A 62 2.756 -31.918 -8.096 1.00 0.00 H new ATOM 0 HA LYS A 62 3.666 -32.697 -5.503 1.00 0.00 H new ATOM 0 HB2 LYS A 62 3.693 -29.969 -6.882 1.00 0.00 H new ATOM 0 HB3 LYS A 62 4.667 -30.405 -5.491 1.00 0.00 H new ATOM 0 HG2 LYS A 62 5.737 -32.249 -6.816 1.00 0.00 H new ATOM 0 HG3 LYS A 62 4.759 -31.822 -8.206 1.00 0.00 H new ATOM 0 HD2 LYS A 62 6.969 -30.753 -8.426 1.00 0.00 H new ATOM 0 HD3 LYS A 62 5.758 -29.509 -8.187 1.00 0.00 H new ATOM 0 HE2 LYS A 62 6.638 -28.884 -6.158 1.00 0.00 H new ATOM 0 HE3 LYS A 62 6.800 -30.543 -5.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 8.965 -29.491 -5.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 8.801 -30.764 -6.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 8.643 -29.156 -7.512 1.00 0.00 H new ATOM 1002 N THR A 63 0.986 -30.882 -5.578 1.00 0.00 N ATOM 1003 CA THR A 63 -0.066 -30.279 -4.712 1.00 0.00 C ATOM 1004 C THR A 63 -0.718 -31.376 -3.868 1.00 0.00 C ATOM 1005 O THR A 63 -1.025 -31.182 -2.709 1.00 0.00 O ATOM 1006 CB THR A 63 -1.128 -29.610 -5.588 1.00 0.00 C ATOM 1007 OG1 THR A 63 -0.502 -28.674 -6.454 1.00 0.00 O ATOM 1008 CG2 THR A 63 -2.143 -28.889 -4.701 1.00 0.00 C ATOM 0 H THR A 63 0.741 -30.966 -6.564 1.00 0.00 H new ATOM 0 HA THR A 63 0.385 -29.534 -4.057 1.00 0.00 H new ATOM 0 HB THR A 63 -1.642 -30.367 -6.181 1.00 0.00 H new ATOM 0 HG1 THR A 63 -1.180 -28.245 -7.017 1.00 0.00 H new ATOM 0 HG21 THR A 63 -2.899 -28.413 -5.326 1.00 0.00 H new ATOM 0 HG22 THR A 63 -2.622 -29.609 -4.037 1.00 0.00 H new ATOM 0 HG23 THR A 63 -1.633 -28.131 -4.107 1.00 0.00 H new ATOM 1016 N ILE A 64 -0.933 -32.528 -4.441 1.00 0.00 N ATOM 1017 CA ILE A 64 -1.564 -33.638 -3.673 1.00 0.00 C ATOM 1018 C ILE A 64 -0.600 -34.115 -2.585 1.00 0.00 C ATOM 1019 O ILE A 64 -0.997 -34.403 -1.474 1.00 0.00 O ATOM 1020 CB ILE A 64 -1.882 -34.796 -4.620 1.00 0.00 C ATOM 1021 CG1 ILE A 64 -2.832 -34.311 -5.718 1.00 0.00 C ATOM 1022 CG2 ILE A 64 -2.547 -35.930 -3.835 1.00 0.00 C ATOM 1023 CD1 ILE A 64 -2.969 -35.393 -6.791 1.00 0.00 C ATOM 0 H ILE A 64 -0.699 -32.749 -5.409 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.486 -33.285 -3.211 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.959 -35.159 -5.072 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -3.809 -34.081 -5.293 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.452 -33.391 -6.161 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.774 -36.755 -4.510 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.871 -36.276 -3.053 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.470 -35.567 -3.383 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.646 -35.047 -7.572 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -1.991 -35.602 -7.224 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.368 -36.302 -6.342 1.00 0.00 H new ATOM 1035 N ASP A 65 0.665 -34.197 -2.894 1.00 0.00 N ATOM 1036 CA ASP A 65 1.652 -34.652 -1.875 1.00 0.00 C ATOM 1037 C ASP A 65 1.670 -33.662 -0.710 1.00 0.00 C ATOM 1038 O ASP A 65 1.728 -34.045 0.442 1.00 0.00 O ATOM 1039 CB ASP A 65 3.043 -34.722 -2.507 1.00 0.00 C ATOM 1040 CG ASP A 65 3.065 -35.821 -3.572 1.00 0.00 C ATOM 1041 OD1 ASP A 65 2.132 -36.607 -3.601 1.00 0.00 O ATOM 1042 OD2 ASP A 65 4.013 -35.858 -4.338 1.00 0.00 O ATOM 0 H ASP A 65 1.057 -33.969 -3.807 1.00 0.00 H new ATOM 0 HA ASP A 65 1.370 -35.640 -1.510 1.00 0.00 H new ATOM 0 HB2 ASP A 65 3.299 -33.762 -2.955 1.00 0.00 H new ATOM 0 HB3 ASP A 65 3.792 -34.927 -1.742 1.00 0.00 H new ATOM 1047 N ALA A 66 1.617 -32.390 -0.999 1.00 0.00 N ATOM 1048 CA ALA A 66 1.628 -31.377 0.093 1.00 0.00 C ATOM 1049 C ALA A 66 0.363 -31.530 0.938 1.00 0.00 C ATOM 1050 O ALA A 66 0.397 -31.427 2.149 1.00 0.00 O ATOM 1051 CB ALA A 66 1.669 -29.973 -0.513 1.00 0.00 C ATOM 0 H ALA A 66 1.567 -32.009 -1.944 1.00 0.00 H new ATOM 0 HA ALA A 66 2.507 -31.527 0.720 1.00 0.00 H new ATOM 0 HB1 ALA A 66 1.677 -29.232 0.286 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.569 -29.864 -1.118 1.00 0.00 H new ATOM 0 HB3 ALA A 66 0.790 -29.821 -1.140 1.00 0.00 H new ATOM 1057 N LEU A 67 -0.755 -31.777 0.311 1.00 0.00 N ATOM 1058 CA LEU A 67 -2.020 -31.939 1.080 1.00 0.00 C ATOM 1059 C LEU A 67 -1.910 -33.169 1.982 1.00 0.00 C ATOM 1060 O LEU A 67 -2.404 -33.183 3.093 1.00 0.00 O ATOM 1061 CB LEU A 67 -3.188 -32.121 0.107 1.00 0.00 C ATOM 1062 CG LEU A 67 -4.499 -32.203 0.892 1.00 0.00 C ATOM 1063 CD1 LEU A 67 -4.877 -30.809 1.400 1.00 0.00 C ATOM 1064 CD2 LEU A 67 -5.608 -32.731 -0.020 1.00 0.00 C ATOM 0 H LEU A 67 -0.846 -31.873 -0.700 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.192 -31.053 1.691 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.224 -31.288 -0.595 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.047 -33.028 -0.481 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.374 -32.877 1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.811 -30.866 1.959 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.087 -30.432 2.050 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -5.002 -30.135 0.553 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.542 -32.789 0.539 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -5.734 -32.057 -0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -5.339 -33.723 -0.382 1.00 0.00 H new ATOM 1076 N MET A 68 -1.265 -34.204 1.516 1.00 0.00 N ATOM 1077 CA MET A 68 -1.122 -35.430 2.349 1.00 0.00 C ATOM 1078 C MET A 68 -0.160 -35.150 3.505 1.00 0.00 C ATOM 1079 O MET A 68 -0.238 -35.761 4.552 1.00 0.00 O ATOM 1080 CB MET A 68 -0.569 -36.569 1.489 1.00 0.00 C ATOM 1081 CG MET A 68 -1.668 -37.086 0.558 1.00 0.00 C ATOM 1082 SD MET A 68 -1.079 -38.559 -0.312 1.00 0.00 S ATOM 1083 CE MET A 68 0.364 -37.797 -1.096 1.00 0.00 C ATOM 0 H MET A 68 -0.831 -34.253 0.594 1.00 0.00 H new ATOM 0 HA MET A 68 -2.096 -35.716 2.747 1.00 0.00 H new ATOM 0 HB2 MET A 68 0.282 -36.218 0.905 1.00 0.00 H new ATOM 0 HB3 MET A 68 -0.207 -37.377 2.125 1.00 0.00 H new ATOM 0 HG2 MET A 68 -2.564 -37.324 1.132 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.945 -36.313 -0.159 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.763 -38.470 -1.855 1.00 0.00 H new ATOM 0 HE2 MET A 68 0.070 -36.857 -1.563 1.00 0.00 H new ATOM 0 HE3 MET A 68 1.128 -37.605 -0.343 1.00 0.00 H new ATOM 1093 N ARG A 69 0.747 -34.229 3.324 1.00 0.00 N ATOM 1094 CA ARG A 69 1.710 -33.908 4.413 1.00 0.00 C ATOM 1095 C ARG A 69 1.025 -33.017 5.451 1.00 0.00 C ATOM 1096 O ARG A 69 1.369 -33.025 6.616 1.00 0.00 O ATOM 1097 CB ARG A 69 2.918 -33.174 3.827 1.00 0.00 C ATOM 1098 CG ARG A 69 3.713 -34.131 2.936 1.00 0.00 C ATOM 1099 CD ARG A 69 5.013 -33.457 2.493 1.00 0.00 C ATOM 1100 NE ARG A 69 5.700 -34.315 1.488 1.00 0.00 N ATOM 1101 CZ ARG A 69 6.888 -33.989 1.056 1.00 0.00 C ATOM 1102 NH1 ARG A 69 7.597 -33.104 1.702 1.00 0.00 N ATOM 1103 NH2 ARG A 69 7.366 -34.549 -0.022 1.00 0.00 N ATOM 0 H ARG A 69 0.862 -33.685 2.469 1.00 0.00 H new ATOM 0 HA ARG A 69 2.043 -34.831 4.888 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.587 -32.311 3.248 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.552 -32.796 4.629 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.934 -35.050 3.478 1.00 0.00 H new ATOM 0 HG3 ARG A 69 3.121 -34.410 2.065 1.00 0.00 H new ATOM 0 HD2 ARG A 69 4.800 -32.477 2.065 1.00 0.00 H new ATOM 0 HD3 ARG A 69 5.663 -33.295 3.353 1.00 0.00 H new ATOM 0 HE ARG A 69 5.243 -35.157 1.138 1.00 0.00 H new ATOM 0 HH11 ARG A 69 7.223 -32.667 2.544 1.00 0.00 H new ATOM 0 HH12 ARG A 69 8.525 -32.849 1.365 1.00 0.00 H new ATOM 0 HH21 ARG A 69 6.811 -35.241 -0.526 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.294 -34.295 -0.360 1.00 0.00 H new ATOM 1117 N ILE A 70 0.055 -32.249 5.036 1.00 0.00 N ATOM 1118 CA ILE A 70 -0.654 -31.358 5.997 1.00 0.00 C ATOM 1119 C ILE A 70 -2.099 -31.836 6.160 1.00 0.00 C ATOM 1120 O ILE A 70 -2.771 -32.151 5.198 1.00 0.00 O ATOM 1121 CB ILE A 70 -0.649 -29.925 5.464 1.00 0.00 C ATOM 1122 CG1 ILE A 70 0.792 -29.474 5.225 1.00 0.00 C ATOM 1123 CG2 ILE A 70 -1.310 -28.998 6.487 1.00 0.00 C ATOM 1124 CD1 ILE A 70 0.792 -28.104 4.546 1.00 0.00 C ATOM 0 H ILE A 70 -0.277 -32.200 4.073 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.148 -31.387 6.962 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.202 -29.885 4.526 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.330 -29.422 6.172 1.00 0.00 H new ATOM 0 HG13 ILE A 70 1.313 -30.201 4.602 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.307 -27.976 6.108 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.338 -29.318 6.658 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.757 -29.038 7.425 1.00 0.00 H new ATOM 0 HD11 ILE A 70 1.819 -27.782 4.376 1.00 0.00 H new ATOM 0 HD12 ILE A 70 0.270 -28.171 3.592 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.287 -27.381 5.186 1.00 0.00 H new ATOM 1136 N ASN A 71 -2.582 -31.894 7.372 1.00 0.00 N ATOM 1137 CA ASN A 71 -3.982 -32.354 7.593 1.00 0.00 C ATOM 1138 C ASN A 71 -4.855 -31.161 7.989 1.00 0.00 C ATOM 1139 O ASN A 71 -4.487 -30.362 8.828 1.00 0.00 O ATOM 1140 CB ASN A 71 -4.003 -33.396 8.713 1.00 0.00 C ATOM 1141 CG ASN A 71 -3.198 -34.623 8.283 1.00 0.00 C ATOM 1142 OD1 ASN A 71 -2.954 -34.825 7.109 1.00 0.00 O ATOM 1143 ND2 ASN A 71 -2.770 -35.458 9.189 1.00 0.00 N ATOM 0 H ASN A 71 -2.068 -31.643 8.217 1.00 0.00 H new ATOM 0 HA ASN A 71 -4.369 -32.797 6.676 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -3.582 -32.973 9.625 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -5.030 -33.682 8.939 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.232 -36.279 8.912 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -2.974 -35.290 10.174 1.00 0.00 H new ATOM 1150 N LEU A 72 -6.008 -31.034 7.391 1.00 0.00 N ATOM 1151 CA LEU A 72 -6.904 -29.893 7.734 1.00 0.00 C ATOM 1152 C LEU A 72 -7.349 -30.015 9.192 1.00 0.00 C ATOM 1153 O LEU A 72 -7.539 -31.101 9.702 1.00 0.00 O ATOM 1154 CB LEU A 72 -8.132 -29.917 6.821 1.00 0.00 C ATOM 1155 CG LEU A 72 -8.035 -28.779 5.803 1.00 0.00 C ATOM 1156 CD1 LEU A 72 -7.290 -29.271 4.560 1.00 0.00 C ATOM 1157 CD2 LEU A 72 -9.441 -28.325 5.409 1.00 0.00 C ATOM 0 H LEU A 72 -6.368 -31.671 6.680 1.00 0.00 H new ATOM 0 HA LEU A 72 -6.367 -28.954 7.596 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -8.196 -30.875 6.306 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -9.041 -29.812 7.414 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.494 -27.942 6.244 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.220 -28.461 3.834 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -6.288 -29.594 4.841 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -7.831 -30.108 4.119 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -9.372 -27.514 4.684 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -9.983 -29.161 4.968 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -9.972 -27.975 6.294 1.00 0.00 H new ATOM 1169 N PRO A 73 -7.519 -28.872 9.872 1.00 0.00 N ATOM 1170 CA PRO A 73 -7.945 -28.841 11.276 1.00 0.00 C ATOM 1171 C PRO A 73 -9.409 -29.260 11.436 1.00 0.00 C ATOM 1172 O PRO A 73 -10.220 -29.067 10.552 1.00 0.00 O ATOM 1173 CB PRO A 73 -7.777 -27.373 11.669 1.00 0.00 C ATOM 1174 CG PRO A 73 -7.885 -26.625 10.383 1.00 0.00 C ATOM 1175 CD PRO A 73 -7.309 -27.521 9.323 1.00 0.00 C ATOM 0 HA PRO A 73 -7.369 -29.531 11.893 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -8.547 -27.061 12.375 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.814 -27.199 12.149 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.924 -26.380 10.162 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.339 -25.683 10.434 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.817 -27.392 8.367 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -6.252 -27.315 9.153 1.00 0.00 H new ATOM 1183 N ALA A 74 -9.753 -29.832 12.557 1.00 0.00 N ATOM 1184 CA ALA A 74 -11.164 -30.261 12.770 1.00 0.00 C ATOM 1185 C ALA A 74 -12.082 -29.038 12.717 1.00 0.00 C ATOM 1186 O ALA A 74 -11.686 -27.938 13.045 1.00 0.00 O ATOM 1187 CB ALA A 74 -11.291 -30.934 14.138 1.00 0.00 C ATOM 0 H ALA A 74 -9.119 -30.021 13.334 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.451 -30.966 11.990 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -12.323 -31.248 14.295 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.637 -31.805 14.177 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.004 -30.229 14.918 1.00 0.00 H new ATOM 1193 N GLY A 75 -13.307 -29.222 12.304 1.00 0.00 N ATOM 1194 CA GLY A 75 -14.249 -28.069 12.230 1.00 0.00 C ATOM 1195 C GLY A 75 -14.222 -27.475 10.819 1.00 0.00 C ATOM 1196 O GLY A 75 -14.868 -26.485 10.541 1.00 0.00 O ATOM 0 H GLY A 75 -13.696 -30.120 12.015 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -15.259 -28.395 12.479 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -13.969 -27.310 12.961 1.00 0.00 H new ATOM 1200 N VAL A 76 -13.480 -28.072 9.925 1.00 0.00 N ATOM 1201 CA VAL A 76 -13.415 -27.539 8.536 1.00 0.00 C ATOM 1202 C VAL A 76 -13.648 -28.678 7.542 1.00 0.00 C ATOM 1203 O VAL A 76 -13.278 -29.810 7.783 1.00 0.00 O ATOM 1204 CB VAL A 76 -12.037 -26.920 8.291 1.00 0.00 C ATOM 1205 CG1 VAL A 76 -11.990 -26.312 6.888 1.00 0.00 C ATOM 1206 CG2 VAL A 76 -11.779 -25.826 9.330 1.00 0.00 C ATOM 0 H VAL A 76 -12.917 -28.905 10.098 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.183 -26.778 8.402 1.00 0.00 H new ATOM 0 HB VAL A 76 -11.272 -27.692 8.376 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -11.008 -25.872 6.715 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -12.174 -27.091 6.148 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -12.754 -25.540 6.800 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.798 -25.384 9.157 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -12.545 -25.055 9.244 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -11.811 -26.259 10.330 1.00 0.00 H new ATOM 1216 N ASP A 77 -14.260 -28.390 6.425 1.00 0.00 N ATOM 1217 CA ASP A 77 -14.516 -29.458 5.420 1.00 0.00 C ATOM 1218 C ASP A 77 -14.032 -28.993 4.044 1.00 0.00 C ATOM 1219 O ASP A 77 -13.893 -27.813 3.791 1.00 0.00 O ATOM 1220 CB ASP A 77 -16.017 -29.751 5.359 1.00 0.00 C ATOM 1221 CG ASP A 77 -16.281 -30.854 4.333 1.00 0.00 C ATOM 1222 OD1 ASP A 77 -15.368 -31.618 4.065 1.00 0.00 O ATOM 1223 OD2 ASP A 77 -17.391 -30.916 3.832 1.00 0.00 O ATOM 0 H ASP A 77 -14.593 -27.461 6.166 1.00 0.00 H new ATOM 0 HA ASP A 77 -13.979 -30.362 5.707 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -16.378 -30.059 6.340 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -16.564 -28.848 5.087 1.00 0.00 H new ATOM 1228 N VAL A 78 -13.774 -29.912 3.154 1.00 0.00 N ATOM 1229 CA VAL A 78 -13.298 -29.523 1.797 1.00 0.00 C ATOM 1230 C VAL A 78 -14.173 -30.194 0.736 1.00 0.00 C ATOM 1231 O VAL A 78 -14.381 -31.391 0.755 1.00 0.00 O ATOM 1232 CB VAL A 78 -11.847 -29.971 1.619 1.00 0.00 C ATOM 1233 CG1 VAL A 78 -11.321 -29.473 0.272 1.00 0.00 C ATOM 1234 CG2 VAL A 78 -10.991 -29.392 2.747 1.00 0.00 C ATOM 0 H VAL A 78 -13.872 -30.915 3.308 1.00 0.00 H new ATOM 0 HA VAL A 78 -13.361 -28.440 1.687 1.00 0.00 H new ATOM 0 HB VAL A 78 -11.797 -31.059 1.648 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.287 -29.792 0.145 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -11.930 -29.887 -0.532 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.371 -28.385 0.242 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -9.957 -29.712 2.620 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -11.040 -28.303 2.719 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -11.365 -29.748 3.707 1.00 0.00 H new ATOM 1244 N GLU A 79 -14.688 -29.433 -0.191 1.00 0.00 N ATOM 1245 CA GLU A 79 -15.549 -30.027 -1.252 1.00 0.00 C ATOM 1246 C GLU A 79 -14.937 -29.741 -2.625 1.00 0.00 C ATOM 1247 O GLU A 79 -14.440 -28.662 -2.882 1.00 0.00 O ATOM 1248 CB GLU A 79 -16.948 -29.411 -1.180 1.00 0.00 C ATOM 1249 CG GLU A 79 -17.877 -30.141 -2.152 1.00 0.00 C ATOM 1250 CD GLU A 79 -19.235 -29.436 -2.187 1.00 0.00 C ATOM 1251 OE1 GLU A 79 -19.381 -28.440 -1.499 1.00 0.00 O ATOM 1252 OE2 GLU A 79 -20.105 -29.906 -2.902 1.00 0.00 O ATOM 0 H GLU A 79 -14.549 -28.425 -0.259 1.00 0.00 H new ATOM 0 HA GLU A 79 -15.618 -31.104 -1.101 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -17.337 -29.483 -0.164 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -16.904 -28.351 -1.429 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -17.438 -30.157 -3.149 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -18.002 -31.179 -1.842 1.00 0.00 H new ATOM 1259 N ILE A 80 -14.968 -30.700 -3.511 1.00 0.00 N ATOM 1260 CA ILE A 80 -14.388 -30.482 -4.866 1.00 0.00 C ATOM 1261 C ILE A 80 -15.507 -30.507 -5.911 1.00 0.00 C ATOM 1262 O ILE A 80 -16.331 -31.399 -5.931 1.00 0.00 O ATOM 1263 CB ILE A 80 -13.380 -31.592 -5.173 1.00 0.00 C ATOM 1264 CG1 ILE A 80 -12.302 -31.618 -4.087 1.00 0.00 C ATOM 1265 CG2 ILE A 80 -12.727 -31.326 -6.531 1.00 0.00 C ATOM 1266 CD1 ILE A 80 -11.376 -32.815 -4.317 1.00 0.00 C ATOM 0 H ILE A 80 -15.370 -31.624 -3.354 1.00 0.00 H new ATOM 0 HA ILE A 80 -13.886 -29.515 -4.895 1.00 0.00 H new ATOM 0 HB ILE A 80 -13.895 -32.553 -5.198 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -11.728 -30.691 -4.107 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -12.764 -31.686 -3.102 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -12.009 -32.116 -6.750 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -13.493 -31.307 -7.306 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -12.213 -30.365 -6.506 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -10.608 -32.834 -3.544 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -11.956 -33.737 -4.275 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.904 -32.727 -5.296 1.00 0.00 H new ATOM 1278 N LYS A 81 -15.540 -29.535 -6.781 1.00 0.00 N ATOM 1279 CA LYS A 81 -16.604 -29.504 -7.824 1.00 0.00 C ATOM 1280 C LYS A 81 -16.041 -30.037 -9.143 1.00 0.00 C ATOM 1281 O LYS A 81 -14.882 -29.845 -9.456 1.00 0.00 O ATOM 1282 CB LYS A 81 -17.086 -28.065 -8.020 1.00 0.00 C ATOM 1283 CG LYS A 81 -17.741 -27.566 -6.731 1.00 0.00 C ATOM 1284 CD LYS A 81 -18.343 -26.180 -6.967 1.00 0.00 C ATOM 1285 CE LYS A 81 -18.901 -25.633 -5.651 1.00 0.00 C ATOM 1286 NZ LYS A 81 -20.156 -26.357 -5.304 1.00 0.00 N ATOM 0 H LYS A 81 -14.876 -28.761 -6.815 1.00 0.00 H new ATOM 0 HA LYS A 81 -17.440 -30.127 -7.507 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -16.247 -27.422 -8.286 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -17.798 -28.018 -8.844 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -18.517 -28.262 -6.412 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -17.004 -27.522 -5.929 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -17.583 -25.505 -7.361 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -19.135 -26.239 -7.713 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -18.167 -25.754 -4.854 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -19.098 -24.565 -5.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -20.607 -25.898 -4.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -20.806 -26.335 -6.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -19.933 -27.345 -5.067 1.00 0.00 H new ATOM 1300 N LEU A 82 -16.850 -30.704 -9.919 1.00 0.00 N ATOM 1301 CA LEU A 82 -16.358 -31.248 -11.217 1.00 0.00 C ATOM 1302 C LEU A 82 -17.552 -31.622 -12.099 1.00 0.00 C ATOM 1303 O LEU A 82 -18.032 -32.736 -11.970 1.00 0.00 O ATOM 1304 CB LEU A 82 -15.505 -32.491 -10.958 1.00 0.00 C ATOM 1305 CG LEU A 82 -14.545 -32.703 -12.131 1.00 0.00 C ATOM 1306 CD1 LEU A 82 -15.348 -32.926 -13.414 1.00 0.00 C ATOM 1307 CD2 LEU A 82 -13.658 -31.467 -12.293 1.00 0.00 C ATOM 1308 OXT LEU A 82 -17.964 -30.787 -12.888 1.00 0.00 O ATOM 0 H LEU A 82 -17.830 -30.896 -9.711 1.00 0.00 H new ATOM 0 HA LEU A 82 -15.756 -30.493 -11.723 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -14.944 -32.373 -10.031 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -16.144 -33.365 -10.835 1.00 0.00 H new ATOM 0 HG LEU A 82 -13.921 -33.576 -11.937 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -14.664 -33.077 -14.249 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -15.980 -33.806 -13.299 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -15.972 -32.054 -13.609 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -12.974 -31.617 -13.128 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -14.282 -30.594 -12.487 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -13.086 -31.308 -11.379 1.00 0.00 H new TER 1320 LEU A 82