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 -50:sc= 2 USER MOD Set 1.2: A 35 SER OG : rot -51:sc= 1.06 USER MOD Set 1.3: A 60 SER OG : rot 180:sc= -0.328 USER MOD Set 1.4: A 63 THR OG1 : rot -60:sc= 0 USER MOD Set 2.1: A 10 LYS NZ :NH3+ -120:sc= -0.84 (180deg=-1!) USER MOD Set 2.2: A 51 LYS NZ :NH3+ -122:sc= -0.0689 (180deg=0) USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl 125:sc= -0.158 (180deg=-1.01) USER MOD Single : A 5 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ -172:sc= -0.217 (180deg=-0.256) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -3.06! C(o=-3.1!,f=-5!) USER MOD Single : A 22 SER OG : rot 78:sc= 0.559 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0447) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 85:sc= 1.27 USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= -0.0158 USER MOD Single : A 50 HIS : no HD1:sc= -3.72! C(o=-3.7!,f=-4.6!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -170:sc= -1.6 (180deg=-2.02) USER MOD Single : A 71 ASN : amide:sc=-0.00636 K(o=-0.0064,f=-1.8!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -4.308 -22.642 -24.925 1.00 0.00 N ATOM 2 CA SER A 1 -3.113 -23.165 -25.645 1.00 0.00 C ATOM 3 C SER A 1 -2.518 -24.336 -24.861 1.00 0.00 C ATOM 4 O SER A 1 -2.462 -25.451 -25.340 1.00 0.00 O ATOM 5 CB SER A 1 -2.068 -22.054 -25.774 1.00 0.00 C ATOM 6 OG SER A 1 -1.385 -22.187 -27.012 1.00 0.00 O ATOM 0 H1 SER A 1 -4.713 -21.846 -25.457 1.00 0.00 H new ATOM 0 H2 SER A 1 -5.018 -23.397 -24.837 1.00 0.00 H new ATOM 0 H3 SER A 1 -4.028 -22.318 -23.977 1.00 0.00 H new ATOM 0 HA SER A 1 -3.407 -23.504 -26.638 1.00 0.00 H new ATOM 0 HB2 SER A 1 -2.550 -21.078 -25.716 1.00 0.00 H new ATOM 0 HB3 SER A 1 -1.359 -22.109 -24.948 1.00 0.00 H new ATOM 0 HG SER A 1 -0.717 -21.475 -27.095 1.00 0.00 H new ATOM 14 N MET A 2 -2.072 -24.093 -23.659 1.00 0.00 N ATOM 15 CA MET A 2 -1.482 -25.192 -22.846 1.00 0.00 C ATOM 16 C MET A 2 -2.200 -25.273 -21.497 1.00 0.00 C ATOM 17 O MET A 2 -2.810 -24.321 -21.051 1.00 0.00 O ATOM 18 CB MET A 2 0.006 -24.915 -22.616 1.00 0.00 C ATOM 19 CG MET A 2 0.742 -24.937 -23.958 1.00 0.00 C ATOM 20 SD MET A 2 2.524 -24.810 -23.670 1.00 0.00 S ATOM 21 CE MET A 2 2.767 -26.479 -23.014 1.00 0.00 C ATOM 0 H MET A 2 -2.091 -23.180 -23.205 1.00 0.00 H new ATOM 0 HA MET A 2 -1.598 -26.137 -23.376 1.00 0.00 H new ATOM 0 HB2 MET A 2 0.136 -23.946 -22.133 1.00 0.00 H new ATOM 0 HB3 MET A 2 0.427 -25.664 -21.946 1.00 0.00 H new ATOM 0 HG2 MET A 2 0.514 -25.858 -24.495 1.00 0.00 H new ATOM 0 HG3 MET A 2 0.404 -24.111 -24.584 1.00 0.00 H new ATOM 0 HE1 MET A 2 3.537 -26.989 -23.593 1.00 0.00 H new ATOM 0 HE2 MET A 2 3.078 -26.418 -21.971 1.00 0.00 H new ATOM 0 HE3 MET A 2 1.833 -27.036 -23.082 1.00 0.00 H new ATOM 31 N GLY A 3 -2.131 -26.400 -20.844 1.00 0.00 N ATOM 32 CA GLY A 3 -2.809 -26.539 -19.525 1.00 0.00 C ATOM 33 C GLY A 3 -4.325 -26.453 -19.719 1.00 0.00 C ATOM 34 O GLY A 3 -4.908 -27.211 -20.469 1.00 0.00 O ATOM 0 H GLY A 3 -1.634 -27.230 -21.167 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -2.544 -27.492 -19.066 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -2.473 -25.754 -18.847 1.00 0.00 H new ATOM 38 N GLY A 4 -4.967 -25.537 -19.047 1.00 0.00 N ATOM 39 CA GLY A 4 -6.444 -25.404 -19.194 1.00 0.00 C ATOM 40 C GLY A 4 -7.143 -26.177 -18.073 1.00 0.00 C ATOM 41 O GLY A 4 -8.353 -26.163 -17.957 1.00 0.00 O ATOM 0 H GLY A 4 -4.533 -24.876 -18.403 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.730 -24.353 -19.158 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.759 -25.787 -20.165 1.00 0.00 H new ATOM 45 N GLN A 5 -6.393 -26.851 -17.243 1.00 0.00 N ATOM 46 CA GLN A 5 -7.018 -27.622 -16.132 1.00 0.00 C ATOM 47 C GLN A 5 -6.909 -26.823 -14.832 1.00 0.00 C ATOM 48 O GLN A 5 -5.840 -26.402 -14.438 1.00 0.00 O ATOM 49 CB GLN A 5 -6.294 -28.960 -15.971 1.00 0.00 C ATOM 50 CG GLN A 5 -7.052 -29.832 -14.969 1.00 0.00 C ATOM 51 CD GLN A 5 -6.350 -31.185 -14.836 1.00 0.00 C ATOM 52 OE1 GLN A 5 -5.358 -31.434 -15.491 1.00 0.00 O ATOM 53 NE2 GLN A 5 -6.829 -32.075 -14.011 1.00 0.00 N ATOM 0 H GLN A 5 -5.375 -26.900 -17.287 1.00 0.00 H new ATOM 0 HA GLN A 5 -8.069 -27.802 -16.360 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -6.227 -29.468 -16.933 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -5.273 -28.794 -15.626 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -7.096 -29.336 -13.999 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -8.081 -29.975 -15.300 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -7.662 -31.865 -13.461 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -6.370 -32.981 -13.916 1.00 0.00 H new ATOM 62 N LYS A 6 -8.008 -26.611 -14.162 1.00 0.00 N ATOM 63 CA LYS A 6 -7.967 -25.840 -12.887 1.00 0.00 C ATOM 64 C LYS A 6 -8.761 -26.587 -11.813 1.00 0.00 C ATOM 65 O LYS A 6 -9.781 -27.188 -12.087 1.00 0.00 O ATOM 66 CB LYS A 6 -8.584 -24.458 -13.108 1.00 0.00 C ATOM 67 CG LYS A 6 -10.089 -24.602 -13.339 1.00 0.00 C ATOM 68 CD LYS A 6 -10.690 -23.231 -13.657 1.00 0.00 C ATOM 69 CE LYS A 6 -12.216 -23.312 -13.582 1.00 0.00 C ATOM 70 NZ LYS A 6 -12.755 -23.757 -14.897 1.00 0.00 N ATOM 0 H LYS A 6 -8.933 -26.938 -14.442 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.932 -25.729 -12.562 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.397 -23.822 -12.243 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.118 -23.973 -13.966 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.277 -25.293 -14.161 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.565 -25.023 -12.453 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.320 -22.487 -12.951 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -10.381 -22.909 -14.651 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -12.516 -24.009 -12.799 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -12.630 -22.339 -13.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -13.792 -23.812 -14.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -12.480 -23.076 -15.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -12.370 -24.694 -15.131 1.00 0.00 H new ATOM 84 N ILE A 7 -8.303 -26.553 -10.592 1.00 0.00 N ATOM 85 CA ILE A 7 -9.033 -27.260 -9.503 1.00 0.00 C ATOM 86 C ILE A 7 -9.520 -26.240 -8.472 1.00 0.00 C ATOM 87 O ILE A 7 -8.817 -25.312 -8.124 1.00 0.00 O ATOM 88 CB ILE A 7 -8.095 -28.262 -8.825 1.00 0.00 C ATOM 89 CG1 ILE A 7 -7.586 -29.267 -9.860 1.00 0.00 C ATOM 90 CG2 ILE A 7 -8.854 -29.005 -7.723 1.00 0.00 C ATOM 91 CD1 ILE A 7 -6.536 -30.173 -9.217 1.00 0.00 C ATOM 0 H ILE A 7 -7.455 -26.066 -10.302 1.00 0.00 H new ATOM 0 HA ILE A 7 -9.888 -27.790 -9.923 1.00 0.00 H new ATOM 0 HB ILE A 7 -7.249 -27.730 -8.390 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -8.414 -29.865 -10.240 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -7.155 -28.741 -10.712 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -8.187 -29.719 -7.240 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -9.216 -28.290 -6.985 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -9.700 -29.537 -8.159 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -6.173 -30.889 -9.954 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -5.703 -29.568 -8.859 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -6.982 -30.709 -8.379 1.00 0.00 H new ATOM 103 N ARG A 8 -10.718 -26.402 -7.982 1.00 0.00 N ATOM 104 CA ARG A 8 -11.247 -25.438 -6.976 1.00 0.00 C ATOM 105 C ARG A 8 -11.568 -26.178 -5.676 1.00 0.00 C ATOM 106 O ARG A 8 -12.135 -27.252 -5.685 1.00 0.00 O ATOM 107 CB ARG A 8 -12.519 -24.783 -7.519 1.00 0.00 C ATOM 108 CG ARG A 8 -12.171 -23.927 -8.738 1.00 0.00 C ATOM 109 CD ARG A 8 -13.406 -23.138 -9.176 1.00 0.00 C ATOM 110 NE ARG A 8 -14.517 -24.083 -9.480 1.00 0.00 N ATOM 111 CZ ARG A 8 -14.511 -24.762 -10.595 1.00 0.00 C ATOM 112 NH1 ARG A 8 -15.072 -24.265 -11.663 1.00 0.00 N ATOM 113 NH2 ARG A 8 -13.943 -25.936 -10.641 1.00 0.00 N ATOM 0 H ARG A 8 -11.353 -27.159 -8.234 1.00 0.00 H new ATOM 0 HA ARG A 8 -10.498 -24.671 -6.779 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -13.246 -25.547 -7.794 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -12.981 -24.166 -6.748 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -11.357 -23.244 -8.496 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -11.823 -24.561 -9.554 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -13.707 -22.447 -8.389 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -13.174 -22.538 -10.056 1.00 0.00 H new ATOM 0 HE ARG A 8 -15.283 -24.200 -8.816 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -15.515 -23.347 -11.626 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -15.068 -24.795 -12.535 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -13.504 -26.323 -9.806 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -13.938 -26.467 -11.512 1.00 0.00 H new ATOM 127 N ILE A 9 -11.211 -25.610 -4.558 1.00 0.00 N ATOM 128 CA ILE A 9 -11.497 -26.278 -3.258 1.00 0.00 C ATOM 129 C ILE A 9 -12.507 -25.442 -2.468 1.00 0.00 C ATOM 130 O ILE A 9 -12.365 -24.244 -2.334 1.00 0.00 O ATOM 131 CB ILE A 9 -10.201 -26.405 -2.453 1.00 0.00 C ATOM 132 CG1 ILE A 9 -9.174 -27.199 -3.263 1.00 0.00 C ATOM 133 CG2 ILE A 9 -10.486 -27.133 -1.138 1.00 0.00 C ATOM 134 CD1 ILE A 9 -7.839 -27.219 -2.514 1.00 0.00 C ATOM 0 H ILE A 9 -10.733 -24.711 -4.488 1.00 0.00 H new ATOM 0 HA ILE A 9 -11.909 -27.270 -3.442 1.00 0.00 H new ATOM 0 HB ILE A 9 -9.807 -25.411 -2.240 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.529 -28.217 -3.422 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.044 -26.749 -4.247 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.563 -27.223 -0.565 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.218 -26.568 -0.561 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -10.880 -28.127 -1.350 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.107 -27.784 -3.090 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.483 -26.198 -2.377 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.975 -27.689 -1.540 1.00 0.00 H new ATOM 146 N LYS A 10 -13.529 -26.066 -1.947 1.00 0.00 N ATOM 147 CA LYS A 10 -14.547 -25.304 -1.170 1.00 0.00 C ATOM 148 C LYS A 10 -14.248 -25.426 0.326 1.00 0.00 C ATOM 149 O LYS A 10 -14.135 -26.512 0.859 1.00 0.00 O ATOM 150 CB LYS A 10 -15.937 -25.871 -1.460 1.00 0.00 C ATOM 151 CG LYS A 10 -17.001 -24.932 -0.888 1.00 0.00 C ATOM 152 CD LYS A 10 -18.389 -25.535 -1.109 1.00 0.00 C ATOM 153 CE LYS A 10 -19.456 -24.548 -0.633 1.00 0.00 C ATOM 154 NZ LYS A 10 -20.746 -24.843 -1.319 1.00 0.00 N ATOM 0 H LYS A 10 -13.702 -27.068 -2.026 1.00 0.00 H new ATOM 0 HA LYS A 10 -14.514 -24.254 -1.461 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -16.078 -25.985 -2.535 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.036 -26.862 -1.018 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -16.827 -24.774 0.176 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -16.936 -23.956 -1.370 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -18.534 -25.763 -2.165 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -18.480 -26.475 -0.565 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -19.581 -24.623 0.447 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -19.143 -23.526 -0.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -21.047 -24.010 -1.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -20.621 -25.651 -1.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -21.471 -25.073 -0.610 1.00 0.00 H new ATOM 168 N LEU A 11 -14.123 -24.320 1.007 1.00 0.00 N ATOM 169 CA LEU A 11 -13.833 -24.373 2.468 1.00 0.00 C ATOM 170 C LEU A 11 -15.088 -23.973 3.247 1.00 0.00 C ATOM 171 O LEU A 11 -15.711 -22.968 2.965 1.00 0.00 O ATOM 172 CB LEU A 11 -12.697 -23.405 2.800 1.00 0.00 C ATOM 173 CG LEU A 11 -11.504 -23.683 1.882 1.00 0.00 C ATOM 174 CD1 LEU A 11 -10.333 -22.783 2.280 1.00 0.00 C ATOM 175 CD2 LEU A 11 -11.088 -25.150 2.019 1.00 0.00 C ATOM 0 H LEU A 11 -14.209 -23.382 0.615 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.537 -25.385 2.744 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.034 -22.376 2.675 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.401 -23.519 3.843 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.785 -23.478 0.849 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -9.483 -22.981 1.626 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -10.628 -21.738 2.185 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -10.051 -22.988 3.313 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -10.239 -25.350 1.366 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -10.807 -25.354 3.052 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -11.922 -25.793 1.736 1.00 0.00 H new ATOM 187 N LYS A 12 -15.465 -24.750 4.225 1.00 0.00 N ATOM 188 CA LYS A 12 -16.681 -24.412 5.020 1.00 0.00 C ATOM 189 C LYS A 12 -16.356 -24.497 6.512 1.00 0.00 C ATOM 190 O LYS A 12 -15.741 -25.438 6.972 1.00 0.00 O ATOM 191 CB LYS A 12 -17.799 -25.400 4.684 1.00 0.00 C ATOM 192 CG LYS A 12 -18.134 -25.306 3.194 1.00 0.00 C ATOM 193 CD LYS A 12 -19.392 -26.124 2.901 1.00 0.00 C ATOM 194 CE LYS A 12 -19.105 -27.606 3.145 1.00 0.00 C ATOM 195 NZ LYS A 12 -19.682 -28.015 4.458 1.00 0.00 N ATOM 0 H LYS A 12 -14.984 -25.604 4.508 1.00 0.00 H new ATOM 0 HA LYS A 12 -17.005 -23.400 4.777 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -17.489 -26.415 4.934 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.684 -25.180 5.281 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -18.290 -24.265 2.911 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -17.300 -25.677 2.599 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -20.211 -25.792 3.538 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -19.707 -25.969 1.869 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -19.535 -28.207 2.344 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -18.030 -27.785 3.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -19.373 -28.981 4.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -19.356 -27.362 5.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -20.720 -27.987 4.405 1.00 0.00 H new ATOM 209 N ALA A 13 -16.766 -23.519 7.273 1.00 0.00 N ATOM 210 CA ALA A 13 -16.483 -23.543 8.736 1.00 0.00 C ATOM 211 C ALA A 13 -17.391 -22.537 9.446 1.00 0.00 C ATOM 212 O ALA A 13 -17.694 -21.483 8.924 1.00 0.00 O ATOM 213 CB ALA A 13 -15.019 -23.168 8.979 1.00 0.00 C ATOM 0 H ALA A 13 -17.285 -22.704 6.945 1.00 0.00 H new ATOM 0 HA ALA A 13 -16.671 -24.543 9.127 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -14.812 -23.185 10.049 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.371 -23.883 8.472 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -14.830 -22.168 8.589 1.00 0.00 H new ATOM 219 N TYR A 14 -17.828 -22.853 10.634 1.00 0.00 N ATOM 220 CA TYR A 14 -18.715 -21.914 11.376 1.00 0.00 C ATOM 221 C TYR A 14 -17.975 -20.597 11.622 1.00 0.00 C ATOM 222 O TYR A 14 -18.530 -19.526 11.480 1.00 0.00 O ATOM 223 CB TYR A 14 -19.109 -22.536 12.718 1.00 0.00 C ATOM 224 CG TYR A 14 -19.870 -23.817 12.476 1.00 0.00 C ATOM 225 CD1 TYR A 14 -21.229 -23.771 12.139 1.00 0.00 C ATOM 226 CD2 TYR A 14 -19.217 -25.050 12.587 1.00 0.00 C ATOM 227 CE1 TYR A 14 -21.934 -24.960 11.916 1.00 0.00 C ATOM 228 CE2 TYR A 14 -19.922 -26.238 12.363 1.00 0.00 C ATOM 229 CZ TYR A 14 -21.280 -26.193 12.027 1.00 0.00 C ATOM 230 OH TYR A 14 -21.976 -27.365 11.806 1.00 0.00 O ATOM 0 H TYR A 14 -17.609 -23.721 11.123 1.00 0.00 H new ATOM 0 HA TYR A 14 -19.612 -21.722 10.787 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -18.218 -22.737 13.313 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -19.723 -21.838 13.288 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -21.732 -22.819 12.051 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -18.169 -25.085 12.846 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -22.982 -24.926 11.658 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -19.418 -27.189 12.449 1.00 0.00 H new ATOM 0 HH TYR A 14 -21.374 -28.130 11.922 1.00 0.00 H new ATOM 240 N ASP A 15 -16.725 -20.668 11.989 1.00 0.00 N ATOM 241 CA ASP A 15 -15.950 -19.421 12.242 1.00 0.00 C ATOM 242 C ASP A 15 -15.168 -19.041 10.983 1.00 0.00 C ATOM 243 O ASP A 15 -14.333 -19.788 10.510 1.00 0.00 O ATOM 244 CB ASP A 15 -14.976 -19.651 13.397 1.00 0.00 C ATOM 245 CG ASP A 15 -14.379 -18.312 13.835 1.00 0.00 C ATOM 246 OD1 ASP A 15 -14.736 -17.306 13.245 1.00 0.00 O ATOM 247 OD2 ASP A 15 -13.577 -18.315 14.754 1.00 0.00 O ATOM 0 H ASP A 15 -16.207 -21.536 12.125 1.00 0.00 H new ATOM 0 HA ASP A 15 -16.636 -18.614 12.501 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -15.492 -20.122 14.234 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -14.183 -20.331 13.088 1.00 0.00 H new ATOM 252 N HIS A 16 -15.430 -17.886 10.437 1.00 0.00 N ATOM 253 CA HIS A 16 -14.702 -17.460 9.209 1.00 0.00 C ATOM 254 C HIS A 16 -13.205 -17.360 9.512 1.00 0.00 C ATOM 255 O HIS A 16 -12.373 -17.741 8.712 1.00 0.00 O ATOM 256 CB HIS A 16 -15.221 -16.093 8.756 1.00 0.00 C ATOM 257 CG HIS A 16 -14.885 -15.061 9.796 1.00 0.00 C ATOM 258 ND1 HIS A 16 -15.612 -14.929 10.969 1.00 0.00 N ATOM 259 CD2 HIS A 16 -13.904 -14.101 9.854 1.00 0.00 C ATOM 260 CE1 HIS A 16 -15.063 -13.925 11.677 1.00 0.00 C ATOM 261 NE2 HIS A 16 -14.019 -13.386 11.042 1.00 0.00 N ATOM 0 H HIS A 16 -16.117 -17.219 10.788 1.00 0.00 H new ATOM 0 HA HIS A 16 -14.866 -18.192 8.418 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -14.774 -15.821 7.800 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -16.300 -16.134 8.603 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -13.157 -13.928 9.093 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -15.423 -13.595 12.641 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -13.432 -12.615 11.360 1.00 0.00 H new ATOM 269 N GLU A 17 -12.855 -16.852 10.661 1.00 0.00 N ATOM 270 CA GLU A 17 -11.412 -16.728 11.013 1.00 0.00 C ATOM 271 C GLU A 17 -10.720 -18.077 10.802 1.00 0.00 C ATOM 272 O GLU A 17 -9.712 -18.168 10.129 1.00 0.00 O ATOM 273 CB GLU A 17 -11.277 -16.308 12.477 1.00 0.00 C ATOM 274 CG GLU A 17 -11.934 -14.941 12.678 1.00 0.00 C ATOM 275 CD GLU A 17 -11.705 -14.472 14.116 1.00 0.00 C ATOM 276 OE1 GLU A 17 -11.229 -15.267 14.909 1.00 0.00 O ATOM 277 OE2 GLU A 17 -12.008 -13.325 14.400 1.00 0.00 O ATOM 0 H GLU A 17 -13.506 -16.517 11.372 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.946 -15.976 10.377 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.748 -17.048 13.124 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.225 -16.263 12.758 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.516 -14.218 11.977 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -13.002 -15.005 12.471 1.00 0.00 H new ATOM 284 N LEU A 18 -11.252 -19.123 11.371 1.00 0.00 N ATOM 285 CA LEU A 18 -10.623 -20.463 11.200 1.00 0.00 C ATOM 286 C LEU A 18 -10.577 -20.811 9.711 1.00 0.00 C ATOM 287 O LEU A 18 -9.584 -21.294 9.206 1.00 0.00 O ATOM 288 CB LEU A 18 -11.447 -21.514 11.944 1.00 0.00 C ATOM 289 CG LEU A 18 -11.150 -21.426 13.444 1.00 0.00 C ATOM 290 CD1 LEU A 18 -11.416 -20.001 13.934 1.00 0.00 C ATOM 291 CD2 LEU A 18 -12.053 -22.402 14.200 1.00 0.00 C ATOM 0 H LEU A 18 -12.094 -19.108 11.946 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.611 -20.446 11.604 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.510 -21.354 11.763 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.207 -22.510 11.572 1.00 0.00 H new ATOM 0 HG LEU A 18 -10.106 -21.683 13.624 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -11.205 -19.938 15.001 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.773 -19.305 13.395 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -12.460 -19.744 13.755 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.842 -22.340 15.268 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -13.097 -22.145 14.021 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.864 -23.417 13.851 1.00 0.00 H new ATOM 303 N LEU A 19 -11.646 -20.566 9.004 1.00 0.00 N ATOM 304 CA LEU A 19 -11.665 -20.878 7.547 1.00 0.00 C ATOM 305 C LEU A 19 -10.660 -19.980 6.824 1.00 0.00 C ATOM 306 O LEU A 19 -10.095 -20.350 5.814 1.00 0.00 O ATOM 307 CB LEU A 19 -13.068 -20.624 6.991 1.00 0.00 C ATOM 308 CG LEU A 19 -13.271 -21.450 5.722 1.00 0.00 C ATOM 309 CD1 LEU A 19 -13.018 -22.928 6.029 1.00 0.00 C ATOM 310 CD2 LEU A 19 -14.705 -21.271 5.221 1.00 0.00 C ATOM 0 H LEU A 19 -12.507 -20.163 9.373 1.00 0.00 H new ATOM 0 HA LEU A 19 -11.397 -21.923 7.393 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -13.819 -20.890 7.735 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -13.198 -19.564 6.772 1.00 0.00 H new ATOM 0 HG LEU A 19 -12.574 -21.114 4.955 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -13.163 -23.518 5.124 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -11.996 -23.056 6.386 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -13.715 -23.265 6.797 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -14.850 -21.860 4.316 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -15.403 -21.606 5.988 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -14.885 -20.219 5.002 1.00 0.00 H new ATOM 322 N ASP A 20 -10.434 -18.801 7.334 1.00 0.00 N ATOM 323 CA ASP A 20 -9.466 -17.876 6.679 1.00 0.00 C ATOM 324 C ASP A 20 -8.052 -18.445 6.797 1.00 0.00 C ATOM 325 O ASP A 20 -7.271 -18.394 5.868 1.00 0.00 O ATOM 326 CB ASP A 20 -9.525 -16.511 7.366 1.00 0.00 C ATOM 327 CG ASP A 20 -10.786 -15.767 6.919 1.00 0.00 C ATOM 328 OD1 ASP A 20 -11.363 -16.166 5.921 1.00 0.00 O ATOM 329 OD2 ASP A 20 -11.152 -14.811 7.583 1.00 0.00 O ATOM 0 H ASP A 20 -10.878 -18.437 8.177 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.724 -17.767 5.626 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.529 -16.637 8.449 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -8.638 -15.928 7.116 1.00 0.00 H new ATOM 334 N GLU A 21 -7.713 -18.989 7.935 1.00 0.00 N ATOM 335 CA GLU A 21 -6.348 -19.560 8.112 1.00 0.00 C ATOM 336 C GLU A 21 -6.210 -20.828 7.267 1.00 0.00 C ATOM 337 O GLU A 21 -5.159 -21.115 6.729 1.00 0.00 O ATOM 338 CB GLU A 21 -6.128 -19.904 9.586 1.00 0.00 C ATOM 339 CG GLU A 21 -6.160 -18.622 10.420 1.00 0.00 C ATOM 340 CD GLU A 21 -5.955 -18.969 11.897 1.00 0.00 C ATOM 341 OE1 GLU A 21 -5.959 -20.146 12.215 1.00 0.00 O ATOM 342 OE2 GLU A 21 -5.797 -18.051 12.684 1.00 0.00 O ATOM 0 H GLU A 21 -8.323 -19.062 8.749 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.605 -18.829 7.793 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.900 -20.593 9.929 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.171 -20.409 9.713 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.381 -17.938 10.085 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.113 -18.111 10.284 1.00 0.00 H new ATOM 349 N SER A 22 -7.262 -21.590 7.146 1.00 0.00 N ATOM 350 CA SER A 22 -7.188 -22.839 6.337 1.00 0.00 C ATOM 351 C SER A 22 -6.897 -22.486 4.877 1.00 0.00 C ATOM 352 O SER A 22 -6.133 -23.152 4.208 1.00 0.00 O ATOM 353 CB SER A 22 -8.521 -23.583 6.426 1.00 0.00 C ATOM 354 OG SER A 22 -8.868 -23.771 7.791 1.00 0.00 O ATOM 0 H SER A 22 -8.169 -21.402 7.572 1.00 0.00 H new ATOM 0 HA SER A 22 -6.390 -23.474 6.722 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.300 -23.017 5.916 1.00 0.00 H new ATOM 0 HB3 SER A 22 -8.446 -24.547 5.923 1.00 0.00 H new ATOM 0 HG SER A 22 -9.228 -22.935 8.155 1.00 0.00 H new ATOM 360 N ALA A 23 -7.503 -21.444 4.376 1.00 0.00 N ATOM 361 CA ALA A 23 -7.263 -21.052 2.959 1.00 0.00 C ATOM 362 C ALA A 23 -5.841 -20.504 2.812 1.00 0.00 C ATOM 363 O ALA A 23 -5.183 -20.720 1.815 1.00 0.00 O ATOM 364 CB ALA A 23 -8.268 -19.973 2.552 1.00 0.00 C ATOM 0 H ALA A 23 -8.154 -20.848 4.887 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.384 -21.924 2.317 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.093 -19.685 1.515 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -9.281 -20.362 2.655 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -8.147 -19.102 3.196 1.00 0.00 H new ATOM 370 N LYS A 24 -5.363 -19.794 3.797 1.00 0.00 N ATOM 371 CA LYS A 24 -3.985 -19.231 3.711 1.00 0.00 C ATOM 372 C LYS A 24 -2.964 -20.370 3.723 1.00 0.00 C ATOM 373 O LYS A 24 -1.977 -20.338 3.014 1.00 0.00 O ATOM 374 CB LYS A 24 -3.736 -18.311 4.908 1.00 0.00 C ATOM 375 CG LYS A 24 -2.358 -17.659 4.771 1.00 0.00 C ATOM 376 CD LYS A 24 -2.064 -16.823 6.018 1.00 0.00 C ATOM 377 CE LYS A 24 -0.773 -16.029 5.806 1.00 0.00 C ATOM 378 NZ LYS A 24 -1.070 -14.571 5.878 1.00 0.00 N ATOM 0 H LYS A 24 -5.867 -19.579 4.658 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.883 -18.663 2.786 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.510 -17.545 4.959 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.790 -18.881 5.836 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -1.592 -18.425 4.644 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.329 -17.029 3.882 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -2.893 -16.144 6.217 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -1.966 -17.471 6.889 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.038 -16.299 6.564 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.337 -16.275 4.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.193 -14.031 5.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -1.757 -14.320 5.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.468 -14.343 6.812 1.00 0.00 H new ATOM 392 N LYS A 25 -3.190 -21.376 4.522 1.00 0.00 N ATOM 393 CA LYS A 25 -2.229 -22.514 4.579 1.00 0.00 C ATOM 394 C LYS A 25 -2.214 -23.241 3.233 1.00 0.00 C ATOM 395 O LYS A 25 -1.171 -23.585 2.713 1.00 0.00 O ATOM 396 CB LYS A 25 -2.656 -23.488 5.679 1.00 0.00 C ATOM 397 CG LYS A 25 -2.541 -22.801 7.041 1.00 0.00 C ATOM 398 CD LYS A 25 -2.834 -23.815 8.150 1.00 0.00 C ATOM 399 CE LYS A 25 -2.856 -23.098 9.503 1.00 0.00 C ATOM 400 NZ LYS A 25 -1.464 -22.746 9.901 1.00 0.00 N ATOM 0 H LYS A 25 -3.999 -21.460 5.138 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.231 -22.134 4.796 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -3.682 -23.816 5.511 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -2.028 -24.379 5.655 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.541 -22.386 7.168 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -3.242 -21.968 7.101 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -3.792 -24.302 7.969 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -2.075 -24.597 8.153 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -3.466 -22.197 9.439 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -3.311 -23.738 10.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.463 -22.383 10.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.863 -23.593 9.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -1.094 -22.016 9.259 1.00 0.00 H new ATOM 414 N ILE A 26 -3.364 -23.479 2.663 1.00 0.00 N ATOM 415 CA ILE A 26 -3.414 -24.186 1.352 1.00 0.00 C ATOM 416 C ILE A 26 -2.854 -23.275 0.257 1.00 0.00 C ATOM 417 O ILE A 26 -2.152 -23.716 -0.632 1.00 0.00 O ATOM 418 CB ILE A 26 -4.865 -24.546 1.022 1.00 0.00 C ATOM 419 CG1 ILE A 26 -5.443 -25.413 2.143 1.00 0.00 C ATOM 420 CG2 ILE A 26 -4.910 -25.320 -0.297 1.00 0.00 C ATOM 421 CD1 ILE A 26 -4.467 -26.545 2.467 1.00 0.00 C ATOM 0 H ILE A 26 -4.271 -23.214 3.048 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.816 -25.096 1.408 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.454 -23.634 0.928 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.621 -24.807 3.031 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -6.406 -25.824 1.840 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -5.943 -25.577 -0.533 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -4.498 -24.703 -1.095 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.321 -26.233 -0.204 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -4.878 -27.163 3.265 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.311 -27.157 1.578 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.515 -26.123 2.789 1.00 0.00 H new ATOM 433 N VAL A 27 -3.160 -22.008 0.311 1.00 0.00 N ATOM 434 CA VAL A 27 -2.647 -21.072 -0.728 1.00 0.00 C ATOM 435 C VAL A 27 -1.117 -21.040 -0.679 1.00 0.00 C ATOM 436 O VAL A 27 -0.455 -21.065 -1.698 1.00 0.00 O ATOM 437 CB VAL A 27 -3.194 -19.667 -0.463 1.00 0.00 C ATOM 438 CG1 VAL A 27 -2.522 -18.672 -1.411 1.00 0.00 C ATOM 439 CG2 VAL A 27 -4.705 -19.655 -0.699 1.00 0.00 C ATOM 0 H VAL A 27 -3.743 -21.580 1.030 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.971 -21.410 -1.712 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.985 -19.384 0.569 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.911 -17.671 -1.223 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.445 -18.680 -1.243 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.731 -18.955 -2.443 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -5.095 -18.655 -0.510 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.914 -19.937 -1.731 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.184 -20.364 -0.024 1.00 0.00 H new ATOM 449 N GLU A 28 -0.551 -20.982 0.495 1.00 0.00 N ATOM 450 CA GLU A 28 0.934 -20.946 0.605 1.00 0.00 C ATOM 451 C GLU A 28 1.519 -22.259 0.081 1.00 0.00 C ATOM 452 O GLU A 28 2.550 -22.277 -0.562 1.00 0.00 O ATOM 453 CB GLU A 28 1.331 -20.760 2.071 1.00 0.00 C ATOM 454 CG GLU A 28 0.867 -19.385 2.555 1.00 0.00 C ATOM 455 CD GLU A 28 1.298 -19.182 4.008 1.00 0.00 C ATOM 456 OE1 GLU A 28 1.785 -20.133 4.599 1.00 0.00 O ATOM 457 OE2 GLU A 28 1.135 -18.080 4.506 1.00 0.00 O ATOM 0 H GLU A 28 -1.053 -20.958 1.383 1.00 0.00 H new ATOM 0 HA GLU A 28 1.321 -20.116 0.014 1.00 0.00 H new ATOM 0 HB2 GLU A 28 0.882 -21.543 2.682 1.00 0.00 H new ATOM 0 HB3 GLU A 28 2.412 -20.850 2.180 1.00 0.00 H new ATOM 0 HG2 GLU A 28 1.293 -18.604 1.926 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -0.217 -19.305 2.472 1.00 0.00 H new ATOM 464 N VAL A 29 0.873 -23.359 0.352 1.00 0.00 N ATOM 465 CA VAL A 29 1.394 -24.669 -0.130 1.00 0.00 C ATOM 466 C VAL A 29 1.206 -24.769 -1.646 1.00 0.00 C ATOM 467 O VAL A 29 2.066 -25.249 -2.358 1.00 0.00 O ATOM 468 CB VAL A 29 0.633 -25.804 0.555 1.00 0.00 C ATOM 469 CG1 VAL A 29 1.243 -27.147 0.147 1.00 0.00 C ATOM 470 CG2 VAL A 29 0.730 -25.640 2.073 1.00 0.00 C ATOM 0 H VAL A 29 0.006 -23.407 0.887 1.00 0.00 H new ATOM 0 HA VAL A 29 2.455 -24.747 0.109 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.414 -25.774 0.252 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.700 -27.956 0.635 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.174 -27.265 -0.934 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.290 -27.178 0.449 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.187 -26.449 2.562 1.00 0.00 H new ATOM 0 HG22 VAL A 29 1.777 -25.670 2.376 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.295 -24.684 2.364 1.00 0.00 H new ATOM 480 N ALA A 30 0.086 -24.321 -2.145 1.00 0.00 N ATOM 481 CA ALA A 30 -0.156 -24.393 -3.613 1.00 0.00 C ATOM 482 C ALA A 30 0.833 -23.479 -4.340 1.00 0.00 C ATOM 483 O ALA A 30 1.445 -23.864 -5.317 1.00 0.00 O ATOM 484 CB ALA A 30 -1.585 -23.941 -3.918 1.00 0.00 C ATOM 0 H ALA A 30 -0.671 -23.909 -1.600 1.00 0.00 H new ATOM 0 HA ALA A 30 -0.019 -25.420 -3.952 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -1.762 -23.994 -4.992 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -2.291 -24.592 -3.402 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -1.722 -22.915 -3.578 1.00 0.00 H new ATOM 490 N LYS A 31 0.993 -22.272 -3.873 1.00 0.00 N ATOM 491 CA LYS A 31 1.941 -21.334 -4.538 1.00 0.00 C ATOM 492 C LYS A 31 3.350 -21.934 -4.523 1.00 0.00 C ATOM 493 O LYS A 31 4.095 -21.816 -5.475 1.00 0.00 O ATOM 494 CB LYS A 31 1.948 -19.999 -3.792 1.00 0.00 C ATOM 495 CG LYS A 31 2.702 -18.956 -4.619 1.00 0.00 C ATOM 496 CD LYS A 31 2.760 -17.636 -3.846 1.00 0.00 C ATOM 497 CE LYS A 31 3.444 -16.571 -4.707 1.00 0.00 C ATOM 498 NZ LYS A 31 4.643 -16.050 -3.992 1.00 0.00 N ATOM 0 H LYS A 31 0.508 -21.894 -3.059 1.00 0.00 H new ATOM 0 HA LYS A 31 1.626 -21.172 -5.569 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.926 -19.666 -3.611 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.422 -20.117 -2.817 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.711 -19.308 -4.835 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.204 -18.807 -5.577 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.753 -17.313 -3.580 1.00 0.00 H new ATOM 0 HD3 LYS A 31 3.308 -17.772 -2.913 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.736 -16.997 -5.667 1.00 0.00 H new ATOM 0 HE3 LYS A 31 2.750 -15.757 -4.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.108 -15.326 -4.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.352 -15.629 -3.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.307 -16.830 -3.813 1.00 0.00 H new ATOM 512 N SER A 32 3.719 -22.574 -3.448 1.00 0.00 N ATOM 513 CA SER A 32 5.079 -23.179 -3.372 1.00 0.00 C ATOM 514 C SER A 32 5.243 -24.210 -4.492 1.00 0.00 C ATOM 515 O SER A 32 6.321 -24.402 -5.019 1.00 0.00 O ATOM 516 CB SER A 32 5.258 -23.867 -2.018 1.00 0.00 C ATOM 517 OG SER A 32 5.005 -22.935 -0.977 1.00 0.00 O ATOM 0 H SER A 32 3.138 -22.704 -2.620 1.00 0.00 H new ATOM 0 HA SER A 32 5.830 -22.397 -3.484 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.577 -24.714 -1.936 1.00 0.00 H new ATOM 0 HB3 SER A 32 6.270 -24.262 -1.929 1.00 0.00 H new ATOM 0 HG SER A 32 4.042 -22.896 -0.800 1.00 0.00 H new ATOM 523 N THR A 33 4.183 -24.875 -4.860 1.00 0.00 N ATOM 524 CA THR A 33 4.280 -25.893 -5.943 1.00 0.00 C ATOM 525 C THR A 33 4.318 -25.192 -7.303 1.00 0.00 C ATOM 526 O THR A 33 3.981 -24.030 -7.422 1.00 0.00 O ATOM 527 CB THR A 33 3.064 -26.820 -5.883 1.00 0.00 C ATOM 528 OG1 THR A 33 1.910 -26.114 -6.318 1.00 0.00 O ATOM 529 CG2 THR A 33 2.858 -27.302 -4.446 1.00 0.00 C ATOM 0 H THR A 33 3.253 -24.757 -4.457 1.00 0.00 H new ATOM 0 HA THR A 33 5.191 -26.477 -5.810 1.00 0.00 H new ATOM 0 HB THR A 33 3.230 -27.680 -6.532 1.00 0.00 H new ATOM 0 HG1 THR A 33 1.853 -25.257 -5.846 1.00 0.00 H new ATOM 0 HG21 THR A 33 1.992 -27.962 -4.404 1.00 0.00 H new ATOM 0 HG22 THR A 33 3.743 -27.844 -4.114 1.00 0.00 H new ATOM 0 HG23 THR A 33 2.692 -26.444 -3.795 1.00 0.00 H new ATOM 537 N ASN A 34 4.725 -25.888 -8.329 1.00 0.00 N ATOM 538 CA ASN A 34 4.784 -25.260 -9.679 1.00 0.00 C ATOM 539 C ASN A 34 3.407 -24.698 -10.038 1.00 0.00 C ATOM 540 O ASN A 34 3.293 -23.665 -10.668 1.00 0.00 O ATOM 541 CB ASN A 34 5.191 -26.312 -10.713 1.00 0.00 C ATOM 542 CG ASN A 34 5.519 -25.623 -12.039 1.00 0.00 C ATOM 543 OD1 ASN A 34 6.430 -24.823 -12.112 1.00 0.00 O ATOM 544 ND2 ASN A 34 4.810 -25.904 -13.099 1.00 0.00 N ATOM 0 H ASN A 34 5.019 -26.864 -8.291 1.00 0.00 H new ATOM 0 HA ASN A 34 5.517 -24.453 -9.674 1.00 0.00 H new ATOM 0 HB2 ASN A 34 6.057 -26.871 -10.357 1.00 0.00 H new ATOM 0 HB3 ASN A 34 4.383 -27.030 -10.854 1.00 0.00 H new ATOM 0 HD21 ASN A 34 5.021 -25.452 -13.988 1.00 0.00 H new ATOM 0 HD22 ASN A 34 4.045 -26.576 -13.037 1.00 0.00 H new ATOM 551 N SER A 35 2.361 -25.369 -9.643 1.00 0.00 N ATOM 552 CA SER A 35 0.993 -24.874 -9.962 1.00 0.00 C ATOM 553 C SER A 35 0.739 -23.564 -9.214 1.00 0.00 C ATOM 554 O SER A 35 1.372 -23.273 -8.219 1.00 0.00 O ATOM 555 CB SER A 35 -0.041 -25.915 -9.529 1.00 0.00 C ATOM 556 OG SER A 35 -0.149 -25.914 -8.114 1.00 0.00 O ATOM 0 H SER A 35 2.395 -26.240 -9.113 1.00 0.00 H new ATOM 0 HA SER A 35 0.910 -24.704 -11.035 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.008 -25.691 -9.978 1.00 0.00 H new ATOM 0 HB3 SER A 35 0.253 -26.904 -9.881 1.00 0.00 H new ATOM 0 HG SER A 35 0.743 -26.000 -7.718 1.00 0.00 H new ATOM 562 N LYS A 36 -0.184 -22.770 -9.685 1.00 0.00 N ATOM 563 CA LYS A 36 -0.479 -21.480 -9.000 1.00 0.00 C ATOM 564 C LYS A 36 -1.874 -21.544 -8.373 1.00 0.00 C ATOM 565 O LYS A 36 -2.764 -22.193 -8.885 1.00 0.00 O ATOM 566 CB LYS A 36 -0.426 -20.339 -10.017 1.00 0.00 C ATOM 567 CG LYS A 36 0.987 -20.236 -10.595 1.00 0.00 C ATOM 568 CD LYS A 36 1.070 -19.025 -11.525 1.00 0.00 C ATOM 569 CE LYS A 36 2.440 -18.999 -12.208 1.00 0.00 C ATOM 570 NZ LYS A 36 2.774 -17.601 -12.599 1.00 0.00 N ATOM 0 H LYS A 36 -0.746 -22.959 -10.515 1.00 0.00 H new ATOM 0 HA LYS A 36 0.261 -21.304 -8.220 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.145 -20.516 -10.816 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -0.705 -19.399 -9.540 1.00 0.00 H new ATOM 0 HG2 LYS A 36 1.715 -20.140 -9.789 1.00 0.00 H new ATOM 0 HG3 LYS A 36 1.235 -21.146 -11.142 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.279 -19.073 -12.274 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.917 -18.107 -10.958 1.00 0.00 H new ATOM 0 HE2 LYS A 36 3.202 -19.391 -11.534 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.432 -19.642 -13.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 3.705 -17.583 -13.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 2.052 -17.243 -13.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 2.799 -17.000 -11.751 1.00 0.00 H new ATOM 584 N VAL A 37 -2.070 -20.878 -7.269 1.00 0.00 N ATOM 585 CA VAL A 37 -3.408 -20.904 -6.613 1.00 0.00 C ATOM 586 C VAL A 37 -4.001 -19.493 -6.604 1.00 0.00 C ATOM 587 O VAL A 37 -3.292 -18.511 -6.512 1.00 0.00 O ATOM 588 CB VAL A 37 -3.262 -21.404 -5.176 1.00 0.00 C ATOM 589 CG1 VAL A 37 -2.239 -20.540 -4.436 1.00 0.00 C ATOM 590 CG2 VAL A 37 -4.614 -21.316 -4.464 1.00 0.00 C ATOM 0 H VAL A 37 -1.363 -20.318 -6.793 1.00 0.00 H new ATOM 0 HA VAL A 37 -4.069 -21.572 -7.165 1.00 0.00 H new ATOM 0 HB VAL A 37 -2.923 -22.440 -5.186 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -2.135 -20.897 -3.411 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.276 -20.603 -4.942 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -2.577 -19.504 -4.427 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.509 -21.673 -3.439 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -4.954 -20.280 -4.455 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -5.343 -21.932 -4.990 1.00 0.00 H new ATOM 600 N SER A 38 -5.297 -19.386 -6.700 1.00 0.00 N ATOM 601 CA SER A 38 -5.938 -18.040 -6.697 1.00 0.00 C ATOM 602 C SER A 38 -6.981 -17.976 -5.580 1.00 0.00 C ATOM 603 O SER A 38 -7.655 -18.945 -5.290 1.00 0.00 O ATOM 604 CB SER A 38 -6.617 -17.795 -8.044 1.00 0.00 C ATOM 605 OG SER A 38 -5.649 -17.862 -9.081 1.00 0.00 O ATOM 0 H SER A 38 -5.941 -20.173 -6.781 1.00 0.00 H new ATOM 0 HA SER A 38 -5.179 -17.276 -6.530 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.397 -18.538 -8.211 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.102 -16.819 -8.047 1.00 0.00 H new ATOM 0 HG SER A 38 -6.084 -17.707 -9.945 1.00 0.00 H new ATOM 611 N GLY A 39 -7.122 -16.842 -4.951 1.00 0.00 N ATOM 612 CA GLY A 39 -8.123 -16.716 -3.855 1.00 0.00 C ATOM 613 C GLY A 39 -7.407 -16.357 -2.550 1.00 0.00 C ATOM 614 O GLY A 39 -6.341 -15.776 -2.556 1.00 0.00 O ATOM 0 H GLY A 39 -6.587 -15.997 -5.149 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.856 -15.948 -4.104 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.669 -17.652 -3.737 1.00 0.00 H new ATOM 618 N PRO A 40 -8.014 -16.715 -1.409 1.00 0.00 N ATOM 619 CA PRO A 40 -9.304 -17.418 -1.382 1.00 0.00 C ATOM 620 C PRO A 40 -10.454 -16.510 -1.826 1.00 0.00 C ATOM 621 O PRO A 40 -10.477 -15.332 -1.531 1.00 0.00 O ATOM 622 CB PRO A 40 -9.475 -17.794 0.089 1.00 0.00 C ATOM 623 CG PRO A 40 -8.658 -16.791 0.831 1.00 0.00 C ATOM 624 CD PRO A 40 -7.491 -16.461 -0.056 1.00 0.00 C ATOM 0 HA PRO A 40 -9.319 -18.272 -2.059 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -10.522 -17.753 0.390 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -9.128 -18.809 0.282 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -9.244 -15.899 1.052 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -8.320 -17.194 1.785 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -7.173 -15.425 0.065 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -6.627 -17.087 0.166 1.00 0.00 H new ATOM 632 N ILE A 41 -11.410 -17.050 -2.533 1.00 0.00 N ATOM 633 CA ILE A 41 -12.557 -16.215 -2.992 1.00 0.00 C ATOM 634 C ILE A 41 -13.701 -16.322 -1.981 1.00 0.00 C ATOM 635 O ILE A 41 -14.129 -17.402 -1.628 1.00 0.00 O ATOM 636 CB ILE A 41 -13.035 -16.713 -4.358 1.00 0.00 C ATOM 637 CG1 ILE A 41 -11.882 -16.638 -5.361 1.00 0.00 C ATOM 638 CG2 ILE A 41 -14.191 -15.837 -4.844 1.00 0.00 C ATOM 639 CD1 ILE A 41 -11.505 -18.051 -5.810 1.00 0.00 C ATOM 0 H ILE A 41 -11.446 -18.030 -2.812 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.241 -15.175 -3.075 1.00 0.00 H new ATOM 0 HB ILE A 41 -13.373 -17.745 -4.270 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -12.173 -16.037 -6.222 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -11.021 -16.147 -4.906 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.532 -16.191 -5.817 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -15.013 -15.890 -4.130 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -13.853 -14.804 -4.932 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -10.684 -17.999 -6.525 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -11.196 -18.638 -4.945 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -12.366 -18.525 -6.281 1.00 0.00 H new ATOM 651 N PRO A 42 -14.200 -15.171 -1.509 1.00 0.00 N ATOM 652 CA PRO A 42 -15.296 -15.123 -0.534 1.00 0.00 C ATOM 653 C PRO A 42 -16.630 -15.546 -1.155 1.00 0.00 C ATOM 654 O PRO A 42 -16.962 -15.161 -2.258 1.00 0.00 O ATOM 655 CB PRO A 42 -15.352 -13.650 -0.131 1.00 0.00 C ATOM 656 CG PRO A 42 -14.771 -12.918 -1.293 1.00 0.00 C ATOM 657 CD PRO A 42 -13.733 -13.826 -1.889 1.00 0.00 C ATOM 0 HA PRO A 42 -15.129 -15.802 0.302 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -16.376 -13.332 0.066 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -14.781 -13.466 0.779 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -15.542 -12.676 -2.025 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -14.326 -11.975 -0.975 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -13.673 -13.712 -2.971 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -12.740 -13.618 -1.491 1.00 0.00 H new ATOM 665 N LEU A 43 -17.398 -16.334 -0.453 1.00 0.00 N ATOM 666 CA LEU A 43 -18.709 -16.781 -1.002 1.00 0.00 C ATOM 667 C LEU A 43 -19.813 -16.482 0.015 1.00 0.00 C ATOM 668 O LEU A 43 -19.551 -16.025 1.110 1.00 0.00 O ATOM 669 CB LEU A 43 -18.659 -18.285 -1.277 1.00 0.00 C ATOM 670 CG LEU A 43 -18.739 -18.529 -2.785 1.00 0.00 C ATOM 671 CD1 LEU A 43 -17.353 -18.340 -3.405 1.00 0.00 C ATOM 672 CD2 LEU A 43 -19.225 -19.956 -3.047 1.00 0.00 C ATOM 0 H LEU A 43 -17.174 -16.687 0.477 1.00 0.00 H new ATOM 0 HA LEU A 43 -18.917 -16.250 -1.931 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -17.738 -18.708 -0.877 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -19.485 -18.786 -0.772 1.00 0.00 H new ATOM 0 HG LEU A 43 -19.437 -17.821 -3.231 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -17.408 -18.514 -4.480 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -17.007 -17.323 -3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -16.655 -19.048 -2.959 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -19.282 -20.129 -4.122 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -18.528 -20.665 -2.601 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -20.212 -20.091 -2.605 1.00 0.00 H new ATOM 684 N PRO A 44 -21.075 -16.745 -0.358 1.00 0.00 N ATOM 685 CA PRO A 44 -22.227 -16.506 0.522 1.00 0.00 C ATOM 686 C PRO A 44 -22.244 -17.472 1.709 1.00 0.00 C ATOM 687 O PRO A 44 -21.922 -18.637 1.578 1.00 0.00 O ATOM 688 CB PRO A 44 -23.430 -16.765 -0.385 1.00 0.00 C ATOM 689 CG PRO A 44 -22.913 -17.687 -1.437 1.00 0.00 C ATOM 690 CD PRO A 44 -21.480 -17.299 -1.662 1.00 0.00 C ATOM 0 HA PRO A 44 -22.213 -15.506 0.955 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -24.254 -17.216 0.168 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -23.806 -15.839 -0.819 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -22.990 -18.726 -1.117 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -23.491 -17.593 -2.356 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -20.869 -18.157 -1.943 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -21.382 -16.563 -2.460 1.00 0.00 H new ATOM 698 N THR A 45 -22.614 -16.998 2.867 1.00 0.00 N ATOM 699 CA THR A 45 -22.647 -17.889 4.061 1.00 0.00 C ATOM 700 C THR A 45 -24.063 -18.435 4.255 1.00 0.00 C ATOM 701 O THR A 45 -25.020 -17.910 3.722 1.00 0.00 O ATOM 702 CB THR A 45 -22.235 -17.092 5.301 1.00 0.00 C ATOM 703 OG1 THR A 45 -23.308 -16.249 5.696 1.00 0.00 O ATOM 704 CG2 THR A 45 -21.006 -16.242 4.979 1.00 0.00 C ATOM 0 H THR A 45 -22.895 -16.032 3.038 1.00 0.00 H new ATOM 0 HA THR A 45 -21.956 -18.719 3.913 1.00 0.00 H new ATOM 0 HB THR A 45 -21.994 -17.779 6.112 1.00 0.00 H new ATOM 0 HG1 THR A 45 -23.047 -15.739 6.491 1.00 0.00 H new ATOM 0 HG21 THR A 45 -20.714 -15.675 5.863 1.00 0.00 H new ATOM 0 HG22 THR A 45 -20.184 -16.891 4.676 1.00 0.00 H new ATOM 0 HG23 THR A 45 -21.242 -15.553 4.168 1.00 0.00 H new ATOM 712 N GLU A 46 -24.202 -19.487 5.015 1.00 0.00 N ATOM 713 CA GLU A 46 -25.554 -20.068 5.246 1.00 0.00 C ATOM 714 C GLU A 46 -25.840 -20.108 6.749 1.00 0.00 C ATOM 715 O GLU A 46 -25.048 -20.600 7.528 1.00 0.00 O ATOM 716 CB GLU A 46 -25.605 -21.489 4.681 1.00 0.00 C ATOM 717 CG GLU A 46 -25.315 -21.453 3.179 1.00 0.00 C ATOM 718 CD GLU A 46 -25.386 -22.873 2.613 1.00 0.00 C ATOM 719 OE1 GLU A 46 -25.465 -23.800 3.401 1.00 0.00 O ATOM 720 OE2 GLU A 46 -25.361 -23.007 1.401 1.00 0.00 O ATOM 0 H GLU A 46 -23.437 -19.969 5.486 1.00 0.00 H new ATOM 0 HA GLU A 46 -26.303 -19.453 4.747 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -24.875 -22.120 5.188 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -26.586 -21.929 4.862 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -26.037 -20.812 2.673 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -24.328 -21.027 2.998 1.00 0.00 H new ATOM 727 N SER A 47 -26.966 -19.595 7.162 1.00 0.00 N ATOM 728 CA SER A 47 -27.301 -19.605 8.615 1.00 0.00 C ATOM 729 C SER A 47 -26.136 -19.015 9.411 1.00 0.00 C ATOM 730 O SER A 47 -26.069 -17.825 9.642 1.00 0.00 O ATOM 731 CB SER A 47 -27.555 -21.044 9.070 1.00 0.00 C ATOM 732 OG SER A 47 -27.712 -21.073 10.481 1.00 0.00 O ATOM 0 H SER A 47 -27.669 -19.169 6.557 1.00 0.00 H new ATOM 0 HA SER A 47 -28.196 -19.007 8.786 1.00 0.00 H new ATOM 0 HB2 SER A 47 -28.449 -21.438 8.586 1.00 0.00 H new ATOM 0 HB3 SER A 47 -26.724 -21.683 8.773 1.00 0.00 H new ATOM 0 HG SER A 47 -27.876 -21.994 10.773 1.00 0.00 H new ATOM 738 N ARG A 48 -25.216 -19.839 9.834 1.00 0.00 N ATOM 739 CA ARG A 48 -24.057 -19.324 10.616 1.00 0.00 C ATOM 740 C ARG A 48 -22.774 -20.011 10.145 1.00 0.00 C ATOM 741 O ARG A 48 -21.860 -20.232 10.913 1.00 0.00 O ATOM 742 CB ARG A 48 -24.274 -19.615 12.103 1.00 0.00 C ATOM 743 CG ARG A 48 -25.559 -18.931 12.575 1.00 0.00 C ATOM 744 CD ARG A 48 -25.346 -17.416 12.617 1.00 0.00 C ATOM 745 NE ARG A 48 -24.345 -17.085 13.669 1.00 0.00 N ATOM 746 CZ ARG A 48 -23.584 -16.033 13.537 1.00 0.00 C ATOM 747 NH1 ARG A 48 -22.948 -15.824 12.416 1.00 0.00 N ATOM 748 NH2 ARG A 48 -23.458 -15.189 14.525 1.00 0.00 N ATOM 0 H ARG A 48 -25.217 -20.846 9.672 1.00 0.00 H new ATOM 0 HA ARG A 48 -23.969 -18.248 10.464 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -24.340 -20.690 12.268 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -23.424 -19.255 12.683 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -26.381 -19.175 11.902 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -25.836 -19.297 13.563 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -25.001 -17.059 11.646 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -26.289 -16.911 12.825 1.00 0.00 H new ATOM 0 HE ARG A 48 -24.254 -17.680 14.492 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -23.046 -16.483 11.644 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -22.353 -15.002 12.313 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -23.955 -15.352 15.401 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -22.863 -14.367 14.421 1.00 0.00 H new ATOM 762 N VAL A 49 -22.698 -20.353 8.888 1.00 0.00 N ATOM 763 CA VAL A 49 -21.473 -21.027 8.372 1.00 0.00 C ATOM 764 C VAL A 49 -20.887 -20.209 7.219 1.00 0.00 C ATOM 765 O VAL A 49 -21.584 -19.829 6.298 1.00 0.00 O ATOM 766 CB VAL A 49 -21.833 -22.428 7.874 1.00 0.00 C ATOM 767 CG1 VAL A 49 -20.561 -23.155 7.434 1.00 0.00 C ATOM 768 CG2 VAL A 49 -22.506 -23.214 9.002 1.00 0.00 C ATOM 0 H VAL A 49 -23.431 -20.195 8.196 1.00 0.00 H new ATOM 0 HA VAL A 49 -20.737 -21.104 9.172 1.00 0.00 H new ATOM 0 HB VAL A 49 -22.517 -22.348 7.029 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -20.817 -24.153 7.079 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -20.082 -22.596 6.630 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -19.877 -23.235 8.279 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -22.763 -24.212 8.647 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -21.823 -23.294 9.848 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -23.413 -22.696 9.316 1.00 0.00 H new ATOM 778 N HIS A 50 -19.611 -19.938 7.260 1.00 0.00 N ATOM 779 CA HIS A 50 -18.982 -19.146 6.165 1.00 0.00 C ATOM 780 C HIS A 50 -18.508 -20.093 5.060 1.00 0.00 C ATOM 781 O HIS A 50 -18.137 -21.222 5.314 1.00 0.00 O ATOM 782 CB HIS A 50 -17.788 -18.368 6.719 1.00 0.00 C ATOM 783 CG HIS A 50 -18.266 -17.393 7.761 1.00 0.00 C ATOM 784 ND1 HIS A 50 -18.913 -16.214 7.427 1.00 0.00 N ATOM 785 CD2 HIS A 50 -18.199 -17.409 9.132 1.00 0.00 C ATOM 786 CE1 HIS A 50 -19.209 -15.574 8.574 1.00 0.00 C ATOM 787 NE2 HIS A 50 -18.795 -16.260 9.643 1.00 0.00 N ATOM 0 H HIS A 50 -18.977 -20.230 8.004 1.00 0.00 H new ATOM 0 HA HIS A 50 -19.711 -18.447 5.756 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -17.062 -19.055 7.154 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -17.281 -17.837 5.914 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -17.752 -18.194 9.724 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -19.718 -14.623 8.624 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -18.894 -15.998 10.624 1.00 0.00 H new ATOM 795 N LYS A 51 -18.519 -19.644 3.834 1.00 0.00 N ATOM 796 CA LYS A 51 -18.072 -20.522 2.716 1.00 0.00 C ATOM 797 C LYS A 51 -16.981 -19.815 1.909 1.00 0.00 C ATOM 798 O LYS A 51 -17.140 -18.686 1.487 1.00 0.00 O ATOM 799 CB LYS A 51 -19.260 -20.829 1.803 1.00 0.00 C ATOM 800 CG LYS A 51 -20.330 -21.584 2.593 1.00 0.00 C ATOM 801 CD LYS A 51 -21.593 -21.723 1.739 1.00 0.00 C ATOM 802 CE LYS A 51 -21.274 -22.535 0.483 1.00 0.00 C ATOM 803 NZ LYS A 51 -22.431 -22.477 -0.453 1.00 0.00 N ATOM 0 H LYS A 51 -18.818 -18.708 3.559 1.00 0.00 H new ATOM 0 HA LYS A 51 -17.675 -21.451 3.125 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -19.674 -19.903 1.403 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -18.933 -21.426 0.951 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -19.960 -22.569 2.877 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -20.559 -21.051 3.516 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -22.380 -22.214 2.312 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -21.968 -20.738 1.462 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -20.381 -22.140 -0.001 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -21.061 -23.570 0.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -22.766 -23.441 -0.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -23.200 -21.926 -0.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -22.137 -22.023 -1.341 1.00 0.00 H new ATOM 817 N ARG A 52 -15.875 -20.472 1.690 1.00 0.00 N ATOM 818 CA ARG A 52 -14.775 -19.843 0.906 1.00 0.00 C ATOM 819 C ARG A 52 -14.379 -20.771 -0.244 1.00 0.00 C ATOM 820 O ARG A 52 -14.392 -21.979 -0.110 1.00 0.00 O ATOM 821 CB ARG A 52 -13.566 -19.612 1.816 1.00 0.00 C ATOM 822 CG ARG A 52 -13.950 -18.642 2.936 1.00 0.00 C ATOM 823 CD ARG A 52 -12.732 -18.381 3.825 1.00 0.00 C ATOM 824 NE ARG A 52 -13.143 -17.571 5.006 1.00 0.00 N ATOM 825 CZ ARG A 52 -13.821 -16.469 4.837 1.00 0.00 C ATOM 826 NH1 ARG A 52 -13.286 -15.465 4.198 1.00 0.00 N ATOM 827 NH2 ARG A 52 -15.035 -16.370 5.308 1.00 0.00 N ATOM 0 H ARG A 52 -15.686 -21.418 2.021 1.00 0.00 H new ATOM 0 HA ARG A 52 -15.113 -18.888 0.504 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -13.230 -20.558 2.239 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -12.735 -19.207 1.239 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.312 -17.705 2.512 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -14.764 -19.059 3.529 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -12.298 -19.326 4.152 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -11.962 -17.855 3.260 1.00 0.00 H new ATOM 0 HE ARG A 52 -12.894 -17.878 5.946 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.338 -15.542 3.830 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -13.816 -14.604 4.066 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -15.454 -17.154 5.808 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -15.565 -15.508 5.176 1.00 0.00 H new ATOM 841 N LEU A 53 -14.028 -20.219 -1.373 1.00 0.00 N ATOM 842 CA LEU A 53 -13.636 -21.075 -2.529 1.00 0.00 C ATOM 843 C LEU A 53 -12.209 -20.732 -2.960 1.00 0.00 C ATOM 844 O LEU A 53 -11.817 -19.582 -2.989 1.00 0.00 O ATOM 845 CB LEU A 53 -14.592 -20.821 -3.699 1.00 0.00 C ATOM 846 CG LEU A 53 -15.879 -21.629 -3.506 1.00 0.00 C ATOM 847 CD1 LEU A 53 -15.580 -23.120 -3.680 1.00 0.00 C ATOM 848 CD2 LEU A 53 -16.439 -21.379 -2.105 1.00 0.00 C ATOM 0 H LEU A 53 -13.996 -19.214 -1.545 1.00 0.00 H new ATOM 0 HA LEU A 53 -13.686 -22.124 -2.235 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -14.826 -19.758 -3.765 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -14.114 -21.101 -4.638 1.00 0.00 H new ATOM 0 HG LEU A 53 -16.614 -21.318 -4.249 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -16.497 -23.693 -3.542 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -15.188 -23.298 -4.681 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -14.842 -23.432 -2.940 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -17.354 -21.955 -1.971 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -15.705 -21.685 -1.360 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -16.657 -20.318 -1.984 1.00 0.00 H new ATOM 860 N ILE A 54 -11.429 -21.722 -3.300 1.00 0.00 N ATOM 861 CA ILE A 54 -10.030 -21.455 -3.735 1.00 0.00 C ATOM 862 C ILE A 54 -9.820 -22.025 -5.139 1.00 0.00 C ATOM 863 O ILE A 54 -10.011 -23.200 -5.376 1.00 0.00 O ATOM 864 CB ILE A 54 -9.056 -22.122 -2.761 1.00 0.00 C ATOM 865 CG1 ILE A 54 -9.315 -21.605 -1.345 1.00 0.00 C ATOM 866 CG2 ILE A 54 -7.619 -21.790 -3.170 1.00 0.00 C ATOM 867 CD1 ILE A 54 -8.392 -22.327 -0.361 1.00 0.00 C ATOM 0 H ILE A 54 -11.701 -22.705 -3.295 1.00 0.00 H new ATOM 0 HA ILE A 54 -9.850 -20.380 -3.747 1.00 0.00 H new ATOM 0 HB ILE A 54 -9.201 -23.202 -2.785 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -9.141 -20.530 -1.301 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -10.357 -21.770 -1.071 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.925 -22.265 -2.477 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.433 -22.159 -4.179 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -7.474 -20.710 -3.146 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.576 -21.959 0.648 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -8.588 -23.399 -0.398 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -7.353 -22.139 -0.632 1.00 0.00 H new ATOM 879 N ASP A 55 -9.435 -21.199 -6.074 1.00 0.00 N ATOM 880 CA ASP A 55 -9.221 -21.697 -7.463 1.00 0.00 C ATOM 881 C ASP A 55 -7.754 -22.086 -7.655 1.00 0.00 C ATOM 882 O ASP A 55 -6.861 -21.465 -7.114 1.00 0.00 O ATOM 883 CB ASP A 55 -9.589 -20.595 -8.460 1.00 0.00 C ATOM 884 CG ASP A 55 -11.088 -20.301 -8.365 1.00 0.00 C ATOM 885 OD1 ASP A 55 -11.787 -21.087 -7.747 1.00 0.00 O ATOM 886 OD2 ASP A 55 -11.510 -19.295 -8.911 1.00 0.00 O ATOM 0 H ASP A 55 -9.260 -20.204 -5.937 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.850 -22.571 -7.632 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -9.016 -19.692 -8.248 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -9.332 -20.905 -9.473 1.00 0.00 H new ATOM 891 N ILE A 56 -7.500 -23.108 -8.425 1.00 0.00 N ATOM 892 CA ILE A 56 -6.092 -23.538 -8.659 1.00 0.00 C ATOM 893 C ILE A 56 -5.810 -23.544 -10.163 1.00 0.00 C ATOM 894 O ILE A 56 -6.559 -24.101 -10.941 1.00 0.00 O ATOM 895 CB ILE A 56 -5.888 -24.946 -8.096 1.00 0.00 C ATOM 896 CG1 ILE A 56 -6.187 -24.945 -6.595 1.00 0.00 C ATOM 897 CG2 ILE A 56 -4.440 -25.382 -8.326 1.00 0.00 C ATOM 898 CD1 ILE A 56 -6.030 -26.363 -6.043 1.00 0.00 C ATOM 0 H ILE A 56 -8.208 -23.665 -8.903 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.411 -22.847 -8.162 1.00 0.00 H new ATOM 0 HB ILE A 56 -6.562 -25.639 -8.600 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.509 -24.265 -6.079 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -7.199 -24.583 -6.415 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -4.294 -26.385 -7.925 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -4.226 -25.384 -9.395 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.767 -24.688 -7.822 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.243 -26.363 -4.974 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -6.726 -27.030 -6.551 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -5.009 -26.707 -6.210 1.00 0.00 H new ATOM 910 N ILE A 57 -4.741 -22.924 -10.579 1.00 0.00 N ATOM 911 CA ILE A 57 -4.419 -22.893 -12.033 1.00 0.00 C ATOM 912 C ILE A 57 -3.224 -23.806 -12.316 1.00 0.00 C ATOM 913 O ILE A 57 -2.291 -23.883 -11.542 1.00 0.00 O ATOM 914 CB ILE A 57 -4.076 -21.461 -12.448 1.00 0.00 C ATOM 915 CG1 ILE A 57 -5.228 -20.529 -12.069 1.00 0.00 C ATOM 916 CG2 ILE A 57 -3.853 -21.408 -13.961 1.00 0.00 C ATOM 917 CD1 ILE A 57 -4.827 -19.080 -12.352 1.00 0.00 C ATOM 0 H ILE A 57 -4.077 -22.438 -9.976 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.281 -23.241 -12.601 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.168 -21.142 -11.935 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.121 -20.788 -12.638 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -5.475 -20.650 -11.014 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.609 -20.388 -14.257 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -3.031 -22.071 -14.231 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -4.760 -21.727 -14.474 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -5.648 -18.416 -12.082 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.945 -18.825 -11.764 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -4.601 -18.965 -13.412 1.00 0.00 H new ATOM 929 N ASP A 58 -3.246 -24.497 -13.424 1.00 0.00 N ATOM 930 CA ASP A 58 -2.112 -25.403 -13.762 1.00 0.00 C ATOM 931 C ASP A 58 -1.748 -26.249 -12.539 1.00 0.00 C ATOM 932 O ASP A 58 -0.648 -26.179 -12.031 1.00 0.00 O ATOM 933 CB ASP A 58 -0.902 -24.570 -14.183 1.00 0.00 C ATOM 934 CG ASP A 58 -1.367 -23.402 -15.056 1.00 0.00 C ATOM 935 OD1 ASP A 58 -2.495 -23.448 -15.520 1.00 0.00 O ATOM 936 OD2 ASP A 58 -0.589 -22.483 -15.246 1.00 0.00 O ATOM 0 H ASP A 58 -4.001 -24.473 -14.110 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.406 -26.059 -14.582 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -0.381 -24.195 -13.302 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -0.194 -25.190 -14.733 1.00 0.00 H new ATOM 941 N PRO A 59 -2.700 -27.066 -12.062 1.00 0.00 N ATOM 942 CA PRO A 59 -2.488 -27.935 -10.898 1.00 0.00 C ATOM 943 C PRO A 59 -1.518 -29.079 -11.214 1.00 0.00 C ATOM 944 O PRO A 59 -1.524 -29.626 -12.298 1.00 0.00 O ATOM 945 CB PRO A 59 -3.881 -28.494 -10.611 1.00 0.00 C ATOM 946 CG PRO A 59 -4.592 -28.421 -11.920 1.00 0.00 C ATOM 947 CD PRO A 59 -4.055 -27.206 -12.622 1.00 0.00 C ATOM 0 HA PRO A 59 -2.050 -27.396 -10.058 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -3.829 -29.519 -10.245 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -4.394 -27.908 -9.848 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.416 -29.321 -12.509 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -5.669 -28.342 -11.774 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -4.032 -27.343 -13.703 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -4.665 -26.325 -12.425 1.00 0.00 H new ATOM 955 N SER A 60 -0.688 -29.442 -10.276 1.00 0.00 N ATOM 956 CA SER A 60 0.278 -30.549 -10.524 1.00 0.00 C ATOM 957 C SER A 60 0.147 -31.600 -9.420 1.00 0.00 C ATOM 958 O SER A 60 -0.487 -31.374 -8.408 1.00 0.00 O ATOM 959 CB SER A 60 1.702 -29.990 -10.530 1.00 0.00 C ATOM 960 OG SER A 60 1.733 -28.765 -9.812 1.00 0.00 O ATOM 0 H SER A 60 -0.637 -29.020 -9.349 1.00 0.00 H new ATOM 0 HA SER A 60 0.063 -31.009 -11.489 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.387 -30.707 -10.077 1.00 0.00 H new ATOM 0 HB3 SER A 60 2.038 -29.832 -11.555 1.00 0.00 H new ATOM 0 HG SER A 60 2.645 -28.408 -9.814 1.00 0.00 H new ATOM 966 N PRO A 61 0.765 -32.773 -9.623 1.00 0.00 N ATOM 967 CA PRO A 61 0.724 -33.870 -8.648 1.00 0.00 C ATOM 968 C PRO A 61 1.478 -33.513 -7.366 1.00 0.00 C ATOM 969 O PRO A 61 1.173 -34.004 -6.297 1.00 0.00 O ATOM 970 CB PRO A 61 1.427 -35.019 -9.374 1.00 0.00 C ATOM 971 CG PRO A 61 2.306 -34.345 -10.370 1.00 0.00 C ATOM 972 CD PRO A 61 1.558 -33.121 -10.815 1.00 0.00 C ATOM 0 HA PRO A 61 -0.293 -34.108 -8.336 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.006 -35.631 -8.682 1.00 0.00 H new ATOM 0 HB3 PRO A 61 0.710 -35.680 -9.860 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.265 -34.077 -9.927 1.00 0.00 H new ATOM 0 HG3 PRO A 61 2.517 -35.002 -11.213 1.00 0.00 H new ATOM 0 HD2 PRO A 61 2.234 -32.315 -11.101 1.00 0.00 H new ATOM 0 HD3 PRO A 61 0.924 -33.326 -11.677 1.00 0.00 H new ATOM 980 N LYS A 62 2.457 -32.657 -7.462 1.00 0.00 N ATOM 981 CA LYS A 62 3.223 -32.264 -6.248 1.00 0.00 C ATOM 982 C LYS A 62 2.280 -31.571 -5.264 1.00 0.00 C ATOM 983 O LYS A 62 2.499 -31.577 -4.069 1.00 0.00 O ATOM 984 CB LYS A 62 4.347 -31.303 -6.641 1.00 0.00 C ATOM 985 CG LYS A 62 5.334 -32.021 -7.563 1.00 0.00 C ATOM 986 CD LYS A 62 6.465 -31.064 -7.941 1.00 0.00 C ATOM 987 CE LYS A 62 7.288 -30.728 -6.695 1.00 0.00 C ATOM 988 NZ LYS A 62 8.722 -31.046 -6.945 1.00 0.00 N ATOM 0 H LYS A 62 2.759 -32.213 -8.329 1.00 0.00 H new ATOM 0 HA LYS A 62 3.654 -33.151 -5.783 1.00 0.00 H new ATOM 0 HB2 LYS A 62 3.933 -30.429 -7.144 1.00 0.00 H new ATOM 0 HB3 LYS A 62 4.861 -30.944 -5.749 1.00 0.00 H new ATOM 0 HG2 LYS A 62 5.739 -32.902 -7.065 1.00 0.00 H new ATOM 0 HG3 LYS A 62 4.823 -32.370 -8.460 1.00 0.00 H new ATOM 0 HD2 LYS A 62 7.103 -31.519 -8.699 1.00 0.00 H new ATOM 0 HD3 LYS A 62 6.054 -30.152 -8.375 1.00 0.00 H new ATOM 0 HE2 LYS A 62 7.177 -29.673 -6.447 1.00 0.00 H new ATOM 0 HE3 LYS A 62 6.922 -31.297 -5.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 9.281 -30.818 -6.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 8.820 -32.058 -7.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 9.067 -30.484 -7.749 1.00 0.00 H new ATOM 1002 N THR A 63 1.227 -30.978 -5.758 1.00 0.00 N ATOM 1003 CA THR A 63 0.267 -30.289 -4.852 1.00 0.00 C ATOM 1004 C THR A 63 -0.456 -31.330 -3.999 1.00 0.00 C ATOM 1005 O THR A 63 -0.634 -31.159 -2.809 1.00 0.00 O ATOM 1006 CB THR A 63 -0.755 -29.511 -5.686 1.00 0.00 C ATOM 1007 OG1 THR A 63 -0.071 -28.634 -6.570 1.00 0.00 O ATOM 1008 CG2 THR A 63 -1.662 -28.702 -4.760 1.00 0.00 C ATOM 0 H THR A 63 0.991 -30.941 -6.750 1.00 0.00 H new ATOM 0 HA THR A 63 0.806 -29.597 -4.205 1.00 0.00 H new ATOM 0 HB THR A 63 -1.362 -30.209 -6.263 1.00 0.00 H new ATOM 0 HG1 THR A 63 0.468 -28.001 -6.051 1.00 0.00 H new ATOM 0 HG21 THR A 63 -2.389 -28.149 -5.355 1.00 0.00 H new ATOM 0 HG22 THR A 63 -2.186 -29.377 -4.083 1.00 0.00 H new ATOM 0 HG23 THR A 63 -1.059 -28.002 -4.181 1.00 0.00 H new ATOM 1016 N ILE A 64 -0.874 -32.412 -4.597 1.00 0.00 N ATOM 1017 CA ILE A 64 -1.584 -33.466 -3.821 1.00 0.00 C ATOM 1018 C ILE A 64 -0.644 -34.028 -2.752 1.00 0.00 C ATOM 1019 O ILE A 64 -1.035 -34.257 -1.625 1.00 0.00 O ATOM 1020 CB ILE A 64 -2.016 -34.592 -4.762 1.00 0.00 C ATOM 1021 CG1 ILE A 64 -2.924 -34.023 -5.854 1.00 0.00 C ATOM 1022 CG2 ILE A 64 -2.777 -35.656 -3.967 1.00 0.00 C ATOM 1023 CD1 ILE A 64 -3.191 -35.101 -6.907 1.00 0.00 C ATOM 0 H ILE A 64 -0.754 -32.611 -5.590 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.465 -33.035 -3.344 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.135 -35.042 -5.220 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -3.864 -33.683 -5.420 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.454 -33.155 -6.317 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.085 -36.459 -4.636 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.130 -36.061 -3.189 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.658 -35.207 -3.509 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.838 -34.697 -7.686 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.247 -35.420 -7.349 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.679 -35.955 -6.438 1.00 0.00 H new ATOM 1035 N ASP A 65 0.596 -34.246 -3.096 1.00 0.00 N ATOM 1036 CA ASP A 65 1.560 -34.789 -2.099 1.00 0.00 C ATOM 1037 C ASP A 65 1.597 -33.863 -0.882 1.00 0.00 C ATOM 1038 O ASP A 65 1.582 -34.306 0.249 1.00 0.00 O ATOM 1039 CB ASP A 65 2.953 -34.870 -2.724 1.00 0.00 C ATOM 1040 CG ASP A 65 2.949 -35.911 -3.844 1.00 0.00 C ATOM 1041 OD1 ASP A 65 1.996 -36.669 -3.918 1.00 0.00 O ATOM 1042 OD2 ASP A 65 3.899 -35.934 -4.609 1.00 0.00 O ATOM 0 H ASP A 65 0.982 -34.072 -4.024 1.00 0.00 H new ATOM 0 HA ASP A 65 1.247 -35.787 -1.792 1.00 0.00 H new ATOM 0 HB2 ASP A 65 3.243 -33.896 -3.119 1.00 0.00 H new ATOM 0 HB3 ASP A 65 3.689 -35.139 -1.966 1.00 0.00 H new ATOM 1047 N ALA A 66 1.642 -32.577 -1.106 1.00 0.00 N ATOM 1048 CA ALA A 66 1.676 -31.624 0.038 1.00 0.00 C ATOM 1049 C ALA A 66 0.353 -31.704 0.802 1.00 0.00 C ATOM 1050 O ALA A 66 0.314 -31.584 2.011 1.00 0.00 O ATOM 1051 CB ALA A 66 1.878 -30.202 -0.486 1.00 0.00 C ATOM 0 H ALA A 66 1.657 -32.147 -2.031 1.00 0.00 H new ATOM 0 HA ALA A 66 2.499 -31.883 0.704 1.00 0.00 H new ATOM 0 HB1 ALA A 66 1.903 -29.505 0.352 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.820 -30.146 -1.032 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.056 -29.939 -1.152 1.00 0.00 H new ATOM 1057 N LEU A 67 -0.731 -31.909 0.107 1.00 0.00 N ATOM 1058 CA LEU A 67 -2.051 -32.001 0.793 1.00 0.00 C ATOM 1059 C LEU A 67 -2.055 -33.217 1.720 1.00 0.00 C ATOM 1060 O LEU A 67 -2.753 -33.252 2.714 1.00 0.00 O ATOM 1061 CB LEU A 67 -3.160 -32.152 -0.250 1.00 0.00 C ATOM 1062 CG LEU A 67 -4.522 -32.123 0.447 1.00 0.00 C ATOM 1063 CD1 LEU A 67 -4.577 -30.937 1.412 1.00 0.00 C ATOM 1064 CD2 LEU A 67 -5.629 -31.980 -0.600 1.00 0.00 C ATOM 0 H LEU A 67 -0.760 -32.017 -0.907 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.223 -31.096 1.376 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.097 -31.347 -0.983 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.038 -33.089 -0.794 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.665 -33.050 1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.547 -30.916 1.908 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.789 -31.039 2.159 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.434 -30.010 0.857 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.599 -31.959 -0.103 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -5.486 -31.053 -1.156 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -5.591 -32.825 -1.287 1.00 0.00 H new ATOM 1076 N MET A 68 -1.277 -34.216 1.402 1.00 0.00 N ATOM 1077 CA MET A 68 -1.231 -35.429 2.264 1.00 0.00 C ATOM 1078 C MET A 68 -0.289 -35.174 3.440 1.00 0.00 C ATOM 1079 O MET A 68 -0.451 -35.723 4.512 1.00 0.00 O ATOM 1080 CB MET A 68 -0.719 -36.615 1.447 1.00 0.00 C ATOM 1081 CG MET A 68 -1.810 -37.075 0.478 1.00 0.00 C ATOM 1082 SD MET A 68 -1.317 -38.638 -0.291 1.00 0.00 S ATOM 1083 CE MET A 68 0.060 -37.987 -1.268 1.00 0.00 C ATOM 0 H MET A 68 -0.671 -34.243 0.582 1.00 0.00 H new ATOM 0 HA MET A 68 -2.230 -35.652 2.637 1.00 0.00 H new ATOM 0 HB2 MET A 68 0.177 -36.330 0.895 1.00 0.00 H new ATOM 0 HB3 MET A 68 -0.438 -37.433 2.110 1.00 0.00 H new ATOM 0 HG2 MET A 68 -2.753 -37.201 1.009 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.974 -36.317 -0.288 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.405 -38.751 -1.964 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.272 -37.111 -1.826 1.00 0.00 H new ATOM 0 HE3 MET A 68 0.877 -37.706 -0.603 1.00 0.00 H new ATOM 1093 N ARG A 69 0.696 -34.339 3.247 1.00 0.00 N ATOM 1094 CA ARG A 69 1.649 -34.041 4.350 1.00 0.00 C ATOM 1095 C ARG A 69 0.990 -33.081 5.341 1.00 0.00 C ATOM 1096 O ARG A 69 1.368 -33.004 6.493 1.00 0.00 O ATOM 1097 CB ARG A 69 2.908 -33.398 3.768 1.00 0.00 C ATOM 1098 CG ARG A 69 3.807 -32.913 4.906 1.00 0.00 C ATOM 1099 CD ARG A 69 4.992 -32.143 4.324 1.00 0.00 C ATOM 1100 NE ARG A 69 6.056 -32.011 5.357 1.00 0.00 N ATOM 1101 CZ ARG A 69 7.313 -32.037 5.006 1.00 0.00 C ATOM 1102 NH1 ARG A 69 7.863 -33.159 4.630 1.00 0.00 N ATOM 1103 NH2 ARG A 69 8.021 -30.942 5.033 1.00 0.00 N ATOM 0 H ARG A 69 0.881 -33.850 2.371 1.00 0.00 H new ATOM 0 HA ARG A 69 1.919 -34.963 4.865 1.00 0.00 H new ATOM 0 HB2 ARG A 69 3.444 -34.118 3.149 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.637 -32.562 3.123 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.241 -32.274 5.584 1.00 0.00 H new ATOM 0 HG3 ARG A 69 4.162 -33.762 5.490 1.00 0.00 H new ATOM 0 HD2 ARG A 69 5.383 -32.663 3.449 1.00 0.00 H new ATOM 0 HD3 ARG A 69 4.670 -31.156 3.991 1.00 0.00 H new ATOM 0 HE ARG A 69 5.803 -31.900 6.339 1.00 0.00 H new ATOM 0 HH11 ARG A 69 7.311 -34.016 4.610 1.00 0.00 H new ATOM 0 HH12 ARG A 69 8.845 -33.179 4.356 1.00 0.00 H new ATOM 0 HH21 ARG A 69 7.593 -30.065 5.329 1.00 0.00 H new ATOM 0 HH22 ARG A 69 9.003 -30.963 4.759 1.00 0.00 H new ATOM 1117 N ILE A 70 0.005 -32.346 4.900 1.00 0.00 N ATOM 1118 CA ILE A 70 -0.684 -31.392 5.813 1.00 0.00 C ATOM 1119 C ILE A 70 -2.161 -31.772 5.923 1.00 0.00 C ATOM 1120 O ILE A 70 -2.825 -32.012 4.935 1.00 0.00 O ATOM 1121 CB ILE A 70 -0.564 -29.973 5.253 1.00 0.00 C ATOM 1122 CG1 ILE A 70 0.907 -29.652 4.985 1.00 0.00 C ATOM 1123 CG2 ILE A 70 -1.127 -28.976 6.267 1.00 0.00 C ATOM 1124 CD1 ILE A 70 1.023 -28.241 4.408 1.00 0.00 C ATOM 0 H ILE A 70 -0.352 -32.366 3.945 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.222 -31.434 6.799 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.126 -29.902 4.322 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.481 -29.727 5.909 1.00 0.00 H new ATOM 0 HG13 ILE A 70 1.328 -30.377 4.288 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.042 -27.965 5.869 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.176 -29.204 6.458 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.565 -29.048 7.198 1.00 0.00 H new ATOM 0 HD11 ILE A 70 2.071 -28.011 4.217 1.00 0.00 H new ATOM 0 HD12 ILE A 70 0.462 -28.182 3.475 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.618 -27.522 5.120 1.00 0.00 H new ATOM 1136 N ASN A 71 -2.680 -31.831 7.119 1.00 0.00 N ATOM 1137 CA ASN A 71 -4.114 -32.199 7.289 1.00 0.00 C ATOM 1138 C ASN A 71 -4.917 -30.958 7.683 1.00 0.00 C ATOM 1139 O ASN A 71 -4.489 -30.159 8.491 1.00 0.00 O ATOM 1140 CB ASN A 71 -4.241 -33.260 8.383 1.00 0.00 C ATOM 1141 CG ASN A 71 -3.542 -34.543 7.932 1.00 0.00 C ATOM 1142 OD1 ASN A 71 -3.267 -34.719 6.762 1.00 0.00 O ATOM 1143 ND2 ASN A 71 -3.239 -35.453 8.817 1.00 0.00 N ATOM 0 H ASN A 71 -2.174 -31.641 7.984 1.00 0.00 H new ATOM 0 HA ASN A 71 -4.501 -32.597 6.351 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -3.796 -32.897 9.310 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -5.292 -33.460 8.591 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.771 -36.312 8.526 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -3.470 -35.306 9.800 1.00 0.00 H new ATOM 1150 N LEU A 72 -6.083 -30.793 7.118 1.00 0.00 N ATOM 1151 CA LEU A 72 -6.915 -29.605 7.462 1.00 0.00 C ATOM 1152 C LEU A 72 -7.186 -29.593 8.968 1.00 0.00 C ATOM 1153 O LEU A 72 -7.281 -30.628 9.597 1.00 0.00 O ATOM 1154 CB LEU A 72 -8.243 -29.677 6.706 1.00 0.00 C ATOM 1155 CG LEU A 72 -8.214 -28.700 5.528 1.00 0.00 C ATOM 1156 CD1 LEU A 72 -7.695 -29.419 4.281 1.00 0.00 C ATOM 1157 CD2 LEU A 72 -9.628 -28.179 5.264 1.00 0.00 C ATOM 0 H LEU A 72 -6.494 -31.429 6.434 1.00 0.00 H new ATOM 0 HA LEU A 72 -6.385 -28.695 7.180 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -8.414 -30.692 6.346 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -9.068 -29.432 7.375 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.556 -27.864 5.765 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.674 -28.723 3.442 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -6.688 -29.791 4.468 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -8.353 -30.255 4.043 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -9.609 -27.483 4.425 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -10.285 -29.015 5.027 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -9.999 -27.667 6.152 1.00 0.00 H new ATOM 1169 N PRO A 73 -7.311 -28.393 9.552 1.00 0.00 N ATOM 1170 CA PRO A 73 -7.573 -28.235 10.989 1.00 0.00 C ATOM 1171 C PRO A 73 -8.988 -28.684 11.362 1.00 0.00 C ATOM 1172 O PRO A 73 -9.921 -28.532 10.598 1.00 0.00 O ATOM 1173 CB PRO A 73 -7.427 -26.730 11.214 1.00 0.00 C ATOM 1174 CG PRO A 73 -7.713 -26.122 9.883 1.00 0.00 C ATOM 1175 CD PRO A 73 -7.209 -27.097 8.858 1.00 0.00 C ATOM 0 HA PRO A 73 -6.900 -28.839 11.597 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -8.125 -26.373 11.971 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.425 -26.476 11.559 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.781 -25.944 9.758 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.215 -25.158 9.781 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.813 -27.077 7.951 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -6.183 -26.877 8.563 1.00 0.00 H new ATOM 1183 N ALA A 74 -9.155 -29.239 12.531 1.00 0.00 N ATOM 1184 CA ALA A 74 -10.508 -29.699 12.952 1.00 0.00 C ATOM 1185 C ALA A 74 -11.468 -28.506 12.979 1.00 0.00 C ATOM 1186 O ALA A 74 -11.071 -27.384 13.223 1.00 0.00 O ATOM 1187 CB ALA A 74 -10.426 -30.317 14.349 1.00 0.00 C ATOM 0 H ALA A 74 -8.412 -29.394 13.213 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.873 -30.444 12.245 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -11.416 -30.653 14.657 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.743 -31.167 14.332 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.060 -29.572 15.056 1.00 0.00 H new ATOM 1193 N GLY A 75 -12.727 -28.740 12.731 1.00 0.00 N ATOM 1194 CA GLY A 75 -13.710 -27.621 12.744 1.00 0.00 C ATOM 1195 C GLY A 75 -13.899 -27.090 11.321 1.00 0.00 C ATOM 1196 O GLY A 75 -14.515 -26.065 11.108 1.00 0.00 O ATOM 0 H GLY A 75 -13.118 -29.658 12.520 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -14.663 -27.965 13.145 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -13.359 -26.822 13.398 1.00 0.00 H new ATOM 1200 N VAL A 76 -13.375 -27.780 10.346 1.00 0.00 N ATOM 1201 CA VAL A 76 -13.525 -27.314 8.939 1.00 0.00 C ATOM 1202 C VAL A 76 -14.164 -28.422 8.099 1.00 0.00 C ATOM 1203 O VAL A 76 -13.974 -29.595 8.354 1.00 0.00 O ATOM 1204 CB VAL A 76 -12.150 -26.968 8.366 1.00 0.00 C ATOM 1205 CG1 VAL A 76 -12.311 -26.417 6.948 1.00 0.00 C ATOM 1206 CG2 VAL A 76 -11.479 -25.915 9.249 1.00 0.00 C ATOM 0 H VAL A 76 -12.849 -28.646 10.463 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.161 -26.429 8.916 1.00 0.00 H new ATOM 0 HB VAL A 76 -11.533 -27.866 8.339 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -11.331 -26.170 6.540 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -12.788 -27.168 6.318 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -12.929 -25.520 6.974 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.499 -25.669 8.840 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -12.096 -25.017 9.278 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -11.363 -26.308 10.259 1.00 0.00 H new ATOM 1216 N ASP A 77 -14.920 -28.061 7.098 1.00 0.00 N ATOM 1217 CA ASP A 77 -15.569 -29.095 6.245 1.00 0.00 C ATOM 1218 C ASP A 77 -15.138 -28.898 4.790 1.00 0.00 C ATOM 1219 O ASP A 77 -14.909 -27.792 4.344 1.00 0.00 O ATOM 1220 CB ASP A 77 -17.089 -28.961 6.349 1.00 0.00 C ATOM 1221 CG ASP A 77 -17.536 -29.316 7.769 1.00 0.00 C ATOM 1222 OD1 ASP A 77 -16.732 -29.867 8.501 1.00 0.00 O ATOM 1223 OD2 ASP A 77 -18.675 -29.028 8.100 1.00 0.00 O ATOM 0 H ASP A 77 -15.116 -27.095 6.835 1.00 0.00 H new ATOM 0 HA ASP A 77 -15.268 -30.087 6.583 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -17.393 -27.943 6.104 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -17.573 -29.620 5.628 1.00 0.00 H new ATOM 1228 N VAL A 78 -15.028 -29.965 4.045 1.00 0.00 N ATOM 1229 CA VAL A 78 -14.613 -29.839 2.619 1.00 0.00 C ATOM 1230 C VAL A 78 -15.641 -30.533 1.725 1.00 0.00 C ATOM 1231 O VAL A 78 -16.042 -31.652 1.978 1.00 0.00 O ATOM 1232 CB VAL A 78 -13.245 -30.493 2.426 1.00 0.00 C ATOM 1233 CG1 VAL A 78 -12.766 -30.261 0.992 1.00 0.00 C ATOM 1234 CG2 VAL A 78 -12.242 -29.877 3.404 1.00 0.00 C ATOM 0 H VAL A 78 -15.208 -30.918 4.362 1.00 0.00 H new ATOM 0 HA VAL A 78 -14.552 -28.784 2.351 1.00 0.00 H new ATOM 0 HB VAL A 78 -13.325 -31.564 2.614 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -11.790 -30.727 0.854 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -13.480 -30.700 0.295 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -12.686 -29.190 0.804 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.266 -30.343 3.267 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.162 -28.806 3.217 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -12.582 -30.042 4.426 1.00 0.00 H new ATOM 1244 N GLU A 79 -16.072 -29.880 0.682 1.00 0.00 N ATOM 1245 CA GLU A 79 -17.075 -30.505 -0.227 1.00 0.00 C ATOM 1246 C GLU A 79 -16.437 -30.757 -1.595 1.00 0.00 C ATOM 1247 O GLU A 79 -15.824 -29.882 -2.175 1.00 0.00 O ATOM 1248 CB GLU A 79 -18.273 -29.567 -0.387 1.00 0.00 C ATOM 1249 CG GLU A 79 -19.366 -30.269 -1.195 1.00 0.00 C ATOM 1250 CD GLU A 79 -20.530 -29.303 -1.427 1.00 0.00 C ATOM 1251 OE1 GLU A 79 -20.430 -28.169 -0.987 1.00 0.00 O ATOM 1252 OE2 GLU A 79 -21.501 -29.713 -2.041 1.00 0.00 O ATOM 0 H GLU A 79 -15.774 -28.941 0.419 1.00 0.00 H new ATOM 0 HA GLU A 79 -17.410 -31.452 0.197 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -18.657 -29.280 0.592 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -17.966 -28.650 -0.890 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -18.965 -30.609 -2.150 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -19.715 -31.154 -0.663 1.00 0.00 H new ATOM 1259 N ILE A 80 -16.576 -31.945 -2.115 1.00 0.00 N ATOM 1260 CA ILE A 80 -15.977 -32.252 -3.445 1.00 0.00 C ATOM 1261 C ILE A 80 -17.065 -32.775 -4.385 1.00 0.00 C ATOM 1262 O ILE A 80 -17.836 -33.646 -4.034 1.00 0.00 O ATOM 1263 CB ILE A 80 -14.890 -33.316 -3.282 1.00 0.00 C ATOM 1264 CG1 ILE A 80 -13.830 -32.817 -2.297 1.00 0.00 C ATOM 1265 CG2 ILE A 80 -14.237 -33.589 -4.638 1.00 0.00 C ATOM 1266 CD1 ILE A 80 -12.806 -33.926 -2.046 1.00 0.00 C ATOM 0 H ILE A 80 -17.078 -32.717 -1.677 1.00 0.00 H new ATOM 0 HA ILE A 80 -15.539 -31.346 -3.864 1.00 0.00 H new ATOM 0 HB ILE A 80 -15.336 -34.235 -2.901 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -13.334 -31.933 -2.697 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -14.300 -32.522 -1.359 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -13.462 -34.347 -4.523 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -14.991 -33.945 -5.340 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -13.792 -32.670 -5.019 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -12.051 -33.572 -1.345 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -13.309 -34.798 -1.628 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -12.328 -34.199 -2.987 1.00 0.00 H new ATOM 1278 N LYS A 81 -17.133 -32.251 -5.578 1.00 0.00 N ATOM 1279 CA LYS A 81 -18.171 -32.720 -6.539 1.00 0.00 C ATOM 1280 C LYS A 81 -18.018 -34.227 -6.757 1.00 0.00 C ATOM 1281 O LYS A 81 -18.986 -34.939 -6.935 1.00 0.00 O ATOM 1282 CB LYS A 81 -17.997 -31.992 -7.873 1.00 0.00 C ATOM 1283 CG LYS A 81 -18.286 -30.502 -7.683 1.00 0.00 C ATOM 1284 CD LYS A 81 -18.254 -29.798 -9.041 1.00 0.00 C ATOM 1285 CE LYS A 81 -18.426 -28.291 -8.839 1.00 0.00 C ATOM 1286 NZ LYS A 81 -17.409 -27.563 -9.651 1.00 0.00 N ATOM 0 H LYS A 81 -16.515 -31.519 -5.929 1.00 0.00 H new ATOM 0 HA LYS A 81 -19.162 -32.509 -6.137 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -16.982 -32.132 -8.246 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -18.672 -32.412 -8.619 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -19.261 -30.367 -7.214 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -17.547 -30.060 -7.015 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -17.310 -30.002 -9.546 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -19.048 -30.183 -9.681 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -19.430 -27.986 -9.134 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -18.314 -28.039 -7.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -17.525 -26.538 -9.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -16.455 -27.847 -9.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -17.537 -27.795 -10.657 1.00 0.00 H new ATOM 1300 N LEU A 82 -16.809 -34.718 -6.746 1.00 0.00 N ATOM 1301 CA LEU A 82 -16.595 -36.178 -6.952 1.00 0.00 C ATOM 1302 C LEU A 82 -17.159 -36.950 -5.757 1.00 0.00 C ATOM 1303 O LEU A 82 -17.527 -38.099 -5.941 1.00 0.00 O ATOM 1304 CB LEU A 82 -15.097 -36.460 -7.081 1.00 0.00 C ATOM 1305 CG LEU A 82 -14.511 -35.597 -8.200 1.00 0.00 C ATOM 1306 CD1 LEU A 82 -13.042 -35.969 -8.414 1.00 0.00 C ATOM 1307 CD2 LEU A 82 -15.292 -35.838 -9.493 1.00 0.00 C ATOM 1308 OXT LEU A 82 -17.213 -36.380 -4.681 1.00 0.00 O ATOM 0 H LEU A 82 -15.960 -34.171 -6.603 1.00 0.00 H new ATOM 0 HA LEU A 82 -17.104 -36.495 -7.862 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -14.593 -36.244 -6.139 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -14.932 -37.516 -7.297 1.00 0.00 H new ATOM 0 HG LEU A 82 -14.583 -34.545 -7.923 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -12.624 -35.355 -9.211 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -12.485 -35.797 -7.493 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -12.970 -37.021 -8.691 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -14.874 -35.223 -10.290 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -15.221 -36.890 -9.771 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -16.338 -35.573 -9.341 1.00 0.00 H new TER 1320 LEU A 82