USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 817 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 140:sc= 0.0797 (180deg=-1.33!) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 92:sc= 0.0266 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 101:sc= -1.54! USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 117:sc= 0.927 USER MOD Single : A 37 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot -140:sc= -0.757 USER MOD Single : A 48 ASN : amide:sc= -0.0677 K(o=-0.068,f=-1.4!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -141:sc= -0.306 USER MOD Single : A 59 THR OG1 : rot 89:sc= 0.968 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.109) USER MOD Single : A 78 MET CE :methyl -124:sc= -0.141 (180deg=-0.79) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 140:sc= -2.52! (180deg=-6.65!) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.877 -44.425 -18.100 1.00 0.00 N ATOM 2 CA MET A 1 -12.080 -43.647 -19.033 1.00 0.00 C ATOM 3 C MET A 1 -10.640 -44.162 -19.087 1.00 0.00 C ATOM 4 O MET A 1 -10.061 -44.503 -18.057 1.00 0.00 O ATOM 5 CB MET A 1 -12.081 -42.178 -18.604 1.00 0.00 C ATOM 6 CG MET A 1 -11.884 -42.048 -17.092 1.00 0.00 C ATOM 7 SD MET A 1 -13.427 -41.608 -16.311 1.00 0.00 S ATOM 8 CE MET A 1 -12.860 -41.326 -14.642 1.00 0.00 C ATOM 0 H1 MET A 1 -13.508 -43.791 -17.569 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.446 -45.120 -18.625 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.249 -44.922 -17.437 1.00 0.00 H new ATOM 0 HA MET A 1 -12.519 -43.745 -20.026 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.287 -41.643 -19.125 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.023 -41.712 -18.893 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.515 -42.989 -16.683 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.130 -41.290 -16.879 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.704 -41.040 -14.014 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.410 -42.239 -14.251 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.119 -40.527 -14.640 1.00 0.00 H new ATOM 18 N ASP A 2 -10.105 -44.201 -20.298 1.00 0.00 N ATOM 19 CA ASP A 2 -8.744 -44.669 -20.499 1.00 0.00 C ATOM 20 C ASP A 2 -8.343 -44.444 -21.959 1.00 0.00 C ATOM 21 O ASP A 2 -7.393 -43.715 -22.240 1.00 0.00 O ATOM 22 CB ASP A 2 -8.626 -46.165 -20.201 1.00 0.00 C ATOM 23 CG ASP A 2 -7.870 -46.511 -18.917 1.00 0.00 C ATOM 24 OD1 ASP A 2 -7.904 -45.757 -17.933 1.00 0.00 O ATOM 25 OD2 ASP A 2 -7.217 -47.622 -18.951 1.00 0.00 O ATOM 0 H ASP A 2 -10.589 -43.916 -21.150 1.00 0.00 H new ATOM 0 HA ASP A 2 -8.093 -44.115 -19.823 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -9.629 -46.588 -20.140 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -8.127 -46.649 -21.040 1.00 0.00 H new ATOM 30 N LEU A 3 -9.087 -45.084 -22.849 1.00 0.00 N ATOM 31 CA LEU A 3 -8.821 -44.964 -24.272 1.00 0.00 C ATOM 32 C LEU A 3 -8.671 -43.485 -24.635 1.00 0.00 C ATOM 33 O LEU A 3 -7.566 -43.016 -24.902 1.00 0.00 O ATOM 34 CB LEU A 3 -9.897 -45.689 -25.082 1.00 0.00 C ATOM 35 CG LEU A 3 -9.487 -47.032 -25.691 1.00 0.00 C ATOM 36 CD1 LEU A 3 -10.100 -48.197 -24.912 1.00 0.00 C ATOM 37 CD2 LEU A 3 -9.839 -47.089 -27.179 1.00 0.00 C ATOM 0 H LEU A 3 -9.874 -45.688 -22.612 1.00 0.00 H new ATOM 0 HA LEU A 3 -7.880 -45.453 -24.526 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -10.760 -45.853 -24.437 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -10.222 -45.031 -25.888 1.00 0.00 H new ATOM 0 HG LEU A 3 -8.404 -47.127 -25.612 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -9.793 -49.139 -25.365 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -9.758 -48.163 -23.878 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -11.187 -48.119 -24.937 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -9.537 -48.053 -27.588 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -10.914 -46.963 -27.304 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -9.316 -46.292 -27.707 1.00 0.00 H new ATOM 49 N ILE A 4 -9.800 -42.791 -24.633 1.00 0.00 N ATOM 50 CA ILE A 4 -9.808 -41.375 -24.958 1.00 0.00 C ATOM 51 C ILE A 4 -8.594 -40.701 -24.316 1.00 0.00 C ATOM 52 O ILE A 4 -7.532 -40.613 -24.930 1.00 0.00 O ATOM 53 CB ILE A 4 -11.144 -40.742 -24.562 1.00 0.00 C ATOM 54 CG1 ILE A 4 -11.023 -39.219 -24.470 1.00 0.00 C ATOM 55 CG2 ILE A 4 -11.678 -41.354 -23.266 1.00 0.00 C ATOM 56 CD1 ILE A 4 -12.271 -38.535 -25.030 1.00 0.00 C ATOM 0 H ILE A 4 -10.715 -43.183 -24.411 1.00 0.00 H new ATOM 0 HA ILE A 4 -9.720 -41.231 -26.035 1.00 0.00 H new ATOM 0 HB ILE A 4 -11.871 -40.961 -25.344 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -10.878 -38.924 -23.431 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -10.143 -38.887 -25.021 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -12.628 -40.886 -23.007 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -11.826 -42.425 -23.403 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -10.961 -41.187 -22.462 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -12.159 -37.454 -24.953 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -12.400 -38.813 -26.076 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -13.145 -38.851 -24.461 1.00 0.00 H new ATOM 68 N GLY A 5 -8.791 -40.243 -23.088 1.00 0.00 N ATOM 69 CA GLY A 5 -7.726 -39.580 -22.356 1.00 0.00 C ATOM 70 C GLY A 5 -7.423 -38.205 -22.955 1.00 0.00 C ATOM 71 O GLY A 5 -7.658 -37.180 -22.316 1.00 0.00 O ATOM 0 H GLY A 5 -9.673 -40.318 -22.582 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -8.012 -39.470 -21.310 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -6.827 -40.196 -22.377 1.00 0.00 H new ATOM 75 N PHE A 6 -6.905 -38.227 -24.174 1.00 0.00 N ATOM 76 CA PHE A 6 -6.567 -36.994 -24.866 1.00 0.00 C ATOM 77 C PHE A 6 -7.775 -36.059 -24.941 1.00 0.00 C ATOM 78 O PHE A 6 -7.714 -34.921 -24.477 1.00 0.00 O ATOM 79 CB PHE A 6 -6.146 -37.379 -26.285 1.00 0.00 C ATOM 80 CG PHE A 6 -5.106 -36.441 -26.902 1.00 0.00 C ATOM 81 CD1 PHE A 6 -3.812 -36.494 -26.487 1.00 0.00 C ATOM 82 CD2 PHE A 6 -5.476 -35.555 -27.865 1.00 0.00 C ATOM 83 CE1 PHE A 6 -2.847 -35.623 -27.059 1.00 0.00 C ATOM 84 CE2 PHE A 6 -4.511 -34.685 -28.437 1.00 0.00 C ATOM 85 CZ PHE A 6 -3.217 -34.737 -28.022 1.00 0.00 C ATOM 0 H PHE A 6 -6.711 -39.079 -24.701 1.00 0.00 H new ATOM 0 HA PHE A 6 -5.771 -36.474 -24.333 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -5.744 -38.392 -26.271 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -7.029 -37.395 -26.923 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -3.518 -37.198 -25.723 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -6.504 -35.513 -28.195 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -1.819 -35.664 -26.729 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -4.805 -33.982 -29.202 1.00 0.00 H new ATOM 0 HZ PHE A 6 -2.483 -34.075 -28.457 1.00 0.00 H new ATOM 95 N GLY A 7 -8.846 -36.573 -25.529 1.00 0.00 N ATOM 96 CA GLY A 7 -10.066 -35.797 -25.671 1.00 0.00 C ATOM 97 C GLY A 7 -10.435 -35.110 -24.355 1.00 0.00 C ATOM 98 O GLY A 7 -10.765 -33.925 -24.340 1.00 0.00 O ATOM 0 H GLY A 7 -8.894 -37.517 -25.912 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.936 -35.048 -26.452 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.881 -36.448 -25.986 1.00 0.00 H new ATOM 102 N TYR A 8 -10.367 -35.883 -23.281 1.00 0.00 N ATOM 103 CA TYR A 8 -10.690 -35.363 -21.963 1.00 0.00 C ATOM 104 C TYR A 8 -9.804 -34.165 -21.614 1.00 0.00 C ATOM 105 O TYR A 8 -10.298 -33.138 -21.150 1.00 0.00 O ATOM 106 CB TYR A 8 -10.401 -36.499 -20.979 1.00 0.00 C ATOM 107 CG TYR A 8 -11.151 -36.377 -19.651 1.00 0.00 C ATOM 108 CD1 TYR A 8 -11.040 -35.226 -18.899 1.00 0.00 C ATOM 109 CD2 TYR A 8 -11.938 -37.420 -19.206 1.00 0.00 C ATOM 110 CE1 TYR A 8 -11.746 -35.112 -17.649 1.00 0.00 C ATOM 111 CE2 TYR A 8 -12.644 -37.306 -17.956 1.00 0.00 C ATOM 112 CZ TYR A 8 -12.513 -36.157 -17.239 1.00 0.00 C ATOM 113 OH TYR A 8 -13.179 -36.049 -16.058 1.00 0.00 O ATOM 0 H TYR A 8 -10.093 -36.865 -23.297 1.00 0.00 H new ATOM 0 HA TYR A 8 -11.727 -35.031 -21.925 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -10.664 -37.447 -21.447 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -9.330 -36.529 -20.778 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -10.424 -34.410 -19.248 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -12.024 -38.321 -19.795 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -11.668 -34.216 -17.051 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -13.263 -38.114 -17.596 1.00 0.00 H new ATOM 0 HH TYR A 8 -13.687 -36.870 -15.893 1.00 0.00 H new ATOM 123 N ALA A 9 -8.512 -34.336 -21.851 1.00 0.00 N ATOM 124 CA ALA A 9 -7.553 -33.281 -21.568 1.00 0.00 C ATOM 125 C ALA A 9 -7.717 -32.160 -22.596 1.00 0.00 C ATOM 126 O ALA A 9 -7.354 -31.014 -22.333 1.00 0.00 O ATOM 127 CB ALA A 9 -6.139 -33.865 -21.562 1.00 0.00 C ATOM 0 H ALA A 9 -8.106 -35.189 -22.236 1.00 0.00 H new ATOM 0 HA ALA A 9 -7.733 -32.853 -20.582 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.420 -33.074 -21.350 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -6.067 -34.636 -20.795 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -5.921 -34.301 -22.537 1.00 0.00 H new ATOM 133 N ALA A 10 -8.264 -32.529 -23.745 1.00 0.00 N ATOM 134 CA ALA A 10 -8.480 -31.568 -24.813 1.00 0.00 C ATOM 135 C ALA A 10 -9.559 -30.571 -24.386 1.00 0.00 C ATOM 136 O ALA A 10 -9.307 -29.368 -24.322 1.00 0.00 O ATOM 137 CB ALA A 10 -8.848 -32.309 -26.100 1.00 0.00 C ATOM 0 H ALA A 10 -8.564 -33.480 -23.960 1.00 0.00 H new ATOM 0 HA ALA A 10 -7.569 -31.003 -25.011 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -9.010 -31.588 -26.901 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -8.037 -32.983 -26.377 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -9.760 -32.885 -25.940 1.00 0.00 H new ATOM 143 N LEU A 11 -10.737 -31.107 -24.105 1.00 0.00 N ATOM 144 CA LEU A 11 -11.855 -30.279 -23.686 1.00 0.00 C ATOM 145 C LEU A 11 -11.479 -29.533 -22.404 1.00 0.00 C ATOM 146 O LEU A 11 -11.781 -28.349 -22.259 1.00 0.00 O ATOM 147 CB LEU A 11 -13.127 -31.120 -23.557 1.00 0.00 C ATOM 148 CG LEU A 11 -13.209 -32.028 -22.329 1.00 0.00 C ATOM 149 CD1 LEU A 11 -13.819 -31.285 -21.138 1.00 0.00 C ATOM 150 CD2 LEU A 11 -13.967 -33.317 -22.649 1.00 0.00 C ATOM 0 H LEU A 11 -10.942 -32.105 -24.159 1.00 0.00 H new ATOM 0 HA LEU A 11 -12.075 -29.525 -24.442 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.984 -30.447 -23.544 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -13.221 -31.739 -24.449 1.00 0.00 H new ATOM 0 HG LEU A 11 -12.195 -32.313 -22.047 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -13.866 -31.953 -20.278 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -13.201 -30.421 -20.893 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -14.825 -30.951 -21.394 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.010 -33.944 -21.759 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -14.979 -33.073 -22.971 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.452 -33.854 -23.446 1.00 0.00 H new ATOM 162 N VAL A 12 -10.825 -30.256 -21.506 1.00 0.00 N ATOM 163 CA VAL A 12 -10.405 -29.678 -20.242 1.00 0.00 C ATOM 164 C VAL A 12 -9.604 -28.402 -20.510 1.00 0.00 C ATOM 165 O VAL A 12 -9.910 -27.345 -19.961 1.00 0.00 O ATOM 166 CB VAL A 12 -9.627 -30.712 -19.426 1.00 0.00 C ATOM 167 CG1 VAL A 12 -8.708 -30.031 -18.410 1.00 0.00 C ATOM 168 CG2 VAL A 12 -10.577 -31.693 -18.735 1.00 0.00 C ATOM 0 H VAL A 12 -10.576 -31.237 -21.630 1.00 0.00 H new ATOM 0 HA VAL A 12 -11.272 -29.398 -19.644 1.00 0.00 H new ATOM 0 HB VAL A 12 -9.002 -31.280 -20.115 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -8.167 -30.789 -17.844 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.996 -29.393 -18.934 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.305 -29.426 -17.728 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -9.998 -32.417 -18.162 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -11.240 -31.146 -18.065 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -11.170 -32.215 -19.486 1.00 0.00 H new ATOM 178 N THR A 13 -8.593 -28.544 -21.354 1.00 0.00 N ATOM 179 CA THR A 13 -7.745 -27.416 -21.702 1.00 0.00 C ATOM 180 C THR A 13 -8.564 -26.329 -22.401 1.00 0.00 C ATOM 181 O THR A 13 -8.279 -25.141 -22.254 1.00 0.00 O ATOM 182 CB THR A 13 -6.584 -27.941 -22.549 1.00 0.00 C ATOM 183 OG1 THR A 13 -5.683 -28.498 -21.596 1.00 0.00 O ATOM 184 CG2 THR A 13 -5.782 -26.815 -23.206 1.00 0.00 C ATOM 0 H THR A 13 -8.342 -29.423 -21.807 1.00 0.00 H new ATOM 0 HA THR A 13 -7.329 -26.944 -20.812 1.00 0.00 H new ATOM 0 HB THR A 13 -6.970 -28.609 -23.319 1.00 0.00 H new ATOM 0 HG1 THR A 13 -5.884 -29.449 -21.472 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.970 -27.242 -23.795 1.00 0.00 H new ATOM 0 HG22 THR A 13 -6.436 -26.234 -23.857 1.00 0.00 H new ATOM 0 HG23 THR A 13 -5.368 -26.166 -22.435 1.00 0.00 H new ATOM 192 N PHE A 14 -9.564 -26.774 -23.147 1.00 0.00 N ATOM 193 CA PHE A 14 -10.426 -25.854 -23.869 1.00 0.00 C ATOM 194 C PHE A 14 -11.195 -24.950 -22.903 1.00 0.00 C ATOM 195 O PHE A 14 -11.144 -23.727 -23.017 1.00 0.00 O ATOM 196 CB PHE A 14 -11.425 -26.703 -24.659 1.00 0.00 C ATOM 197 CG PHE A 14 -11.950 -26.027 -25.927 1.00 0.00 C ATOM 198 CD1 PHE A 14 -11.086 -25.674 -26.917 1.00 0.00 C ATOM 199 CD2 PHE A 14 -13.280 -25.779 -26.065 1.00 0.00 C ATOM 200 CE1 PHE A 14 -11.573 -25.047 -28.094 1.00 0.00 C ATOM 201 CE2 PHE A 14 -13.767 -25.151 -27.242 1.00 0.00 C ATOM 202 CZ PHE A 14 -12.903 -24.799 -28.232 1.00 0.00 C ATOM 0 H PHE A 14 -9.797 -27.760 -23.267 1.00 0.00 H new ATOM 0 HA PHE A 14 -9.827 -25.218 -24.521 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -10.950 -27.645 -24.932 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -12.269 -26.947 -24.014 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -10.030 -25.871 -26.807 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -13.966 -26.060 -25.279 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -10.887 -24.767 -28.880 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -14.823 -24.953 -27.351 1.00 0.00 H new ATOM 0 HZ PHE A 14 -13.273 -24.323 -29.128 1.00 0.00 H new ATOM 212 N GLY A 15 -11.891 -25.589 -21.973 1.00 0.00 N ATOM 213 CA GLY A 15 -12.670 -24.858 -20.988 1.00 0.00 C ATOM 214 C GLY A 15 -11.758 -24.115 -20.010 1.00 0.00 C ATOM 215 O GLY A 15 -12.169 -23.130 -19.398 1.00 0.00 O ATOM 0 H GLY A 15 -11.931 -26.604 -21.881 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -13.325 -24.147 -21.492 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -13.311 -25.549 -20.440 1.00 0.00 H new ATOM 219 N SER A 16 -10.537 -24.615 -19.892 1.00 0.00 N ATOM 220 CA SER A 16 -9.563 -24.011 -18.999 1.00 0.00 C ATOM 221 C SER A 16 -9.162 -22.629 -19.519 1.00 0.00 C ATOM 222 O SER A 16 -9.213 -21.646 -18.782 1.00 0.00 O ATOM 223 CB SER A 16 -8.327 -24.900 -18.848 1.00 0.00 C ATOM 224 OG SER A 16 -8.142 -25.334 -17.504 1.00 0.00 O ATOM 0 H SER A 16 -10.200 -25.432 -20.400 1.00 0.00 H new ATOM 0 HA SER A 16 -10.022 -23.904 -18.016 1.00 0.00 H new ATOM 0 HB2 SER A 16 -8.424 -25.769 -19.499 1.00 0.00 H new ATOM 0 HB3 SER A 16 -7.444 -24.352 -19.177 1.00 0.00 H new ATOM 0 HG SER A 16 -7.344 -25.900 -17.450 1.00 0.00 H new ATOM 230 N ILE A 17 -8.773 -22.599 -20.785 1.00 0.00 N ATOM 231 CA ILE A 17 -8.364 -21.354 -21.413 1.00 0.00 C ATOM 232 C ILE A 17 -9.566 -20.412 -21.500 1.00 0.00 C ATOM 233 O ILE A 17 -9.481 -19.252 -21.100 1.00 0.00 O ATOM 234 CB ILE A 17 -7.698 -21.628 -22.763 1.00 0.00 C ATOM 235 CG1 ILE A 17 -6.482 -22.541 -22.599 1.00 0.00 C ATOM 236 CG2 ILE A 17 -7.341 -20.320 -23.473 1.00 0.00 C ATOM 237 CD1 ILE A 17 -5.444 -21.912 -21.667 1.00 0.00 C ATOM 0 H ILE A 17 -8.732 -23.417 -21.393 1.00 0.00 H new ATOM 0 HA ILE A 17 -7.609 -20.852 -20.807 1.00 0.00 H new ATOM 0 HB ILE A 17 -8.412 -22.154 -23.396 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -6.798 -23.505 -22.199 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -6.032 -22.732 -23.573 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -6.869 -20.543 -24.430 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.247 -19.739 -23.642 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -6.652 -19.746 -22.853 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -4.590 -22.582 -21.568 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -5.112 -20.960 -22.082 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -5.889 -21.745 -20.686 1.00 0.00 H new ATOM 249 N PHE A 18 -10.659 -20.947 -22.025 1.00 0.00 N ATOM 250 CA PHE A 18 -11.878 -20.169 -22.169 1.00 0.00 C ATOM 251 C PHE A 18 -12.277 -19.523 -20.841 1.00 0.00 C ATOM 252 O PHE A 18 -12.681 -18.361 -20.808 1.00 0.00 O ATOM 253 CB PHE A 18 -12.979 -21.138 -22.602 1.00 0.00 C ATOM 254 CG PHE A 18 -14.032 -20.514 -23.520 1.00 0.00 C ATOM 255 CD1 PHE A 18 -14.950 -19.648 -23.012 1.00 0.00 C ATOM 256 CD2 PHE A 18 -14.051 -20.826 -24.844 1.00 0.00 C ATOM 257 CE1 PHE A 18 -15.927 -19.069 -23.863 1.00 0.00 C ATOM 258 CE2 PHE A 18 -15.029 -20.247 -25.695 1.00 0.00 C ATOM 259 CZ PHE A 18 -15.946 -19.381 -25.187 1.00 0.00 C ATOM 0 H PHE A 18 -10.726 -21.910 -22.356 1.00 0.00 H new ATOM 0 HA PHE A 18 -11.727 -19.373 -22.898 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -12.522 -21.985 -23.113 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -13.473 -21.531 -21.713 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -14.935 -19.401 -21.961 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -13.323 -21.514 -25.248 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -16.655 -18.381 -23.460 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -15.045 -20.494 -26.746 1.00 0.00 H new ATOM 0 HZ PHE A 18 -16.690 -18.941 -25.835 1.00 0.00 H new ATOM 269 N GLY A 19 -12.148 -20.303 -19.778 1.00 0.00 N ATOM 270 CA GLY A 19 -12.490 -19.821 -18.450 1.00 0.00 C ATOM 271 C GLY A 19 -11.239 -19.383 -17.687 1.00 0.00 C ATOM 272 O GLY A 19 -10.838 -18.222 -17.760 1.00 0.00 O ATOM 0 H GLY A 19 -11.811 -21.265 -19.809 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -13.183 -18.984 -18.530 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -13.002 -20.607 -17.895 1.00 0.00 H new ATOM 276 N TYR A 20 -10.657 -20.334 -16.972 1.00 0.00 N ATOM 277 CA TYR A 20 -9.460 -20.060 -16.195 1.00 0.00 C ATOM 278 C TYR A 20 -8.434 -19.286 -17.025 1.00 0.00 C ATOM 279 O TYR A 20 -7.843 -19.834 -17.955 1.00 0.00 O ATOM 280 CB TYR A 20 -8.876 -21.425 -15.826 1.00 0.00 C ATOM 281 CG TYR A 20 -7.373 -21.401 -15.538 1.00 0.00 C ATOM 282 CD1 TYR A 20 -6.905 -20.857 -14.359 1.00 0.00 C ATOM 283 CD2 TYR A 20 -6.486 -21.923 -16.457 1.00 0.00 C ATOM 284 CE1 TYR A 20 -5.491 -20.834 -14.088 1.00 0.00 C ATOM 285 CE2 TYR A 20 -5.072 -21.901 -16.185 1.00 0.00 C ATOM 286 CZ TYR A 20 -4.644 -21.358 -15.014 1.00 0.00 C ATOM 287 OH TYR A 20 -3.309 -21.336 -14.758 1.00 0.00 O ATOM 0 H TYR A 20 -10.992 -21.296 -16.914 1.00 0.00 H new ATOM 0 HA TYR A 20 -9.700 -19.457 -15.319 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -9.398 -21.807 -14.948 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -9.069 -22.123 -16.640 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -7.599 -20.449 -13.640 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -6.852 -22.348 -17.380 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -5.112 -20.410 -13.170 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -4.367 -22.307 -16.895 1.00 0.00 H new ATOM 0 HH TYR A 20 -3.020 -22.220 -14.449 1.00 0.00 H new ATOM 297 N LYS A 21 -8.253 -18.026 -16.660 1.00 0.00 N ATOM 298 CA LYS A 21 -7.308 -17.172 -17.359 1.00 0.00 C ATOM 299 C LYS A 21 -5.911 -17.789 -17.275 1.00 0.00 C ATOM 300 O LYS A 21 -5.437 -18.396 -18.234 1.00 0.00 O ATOM 301 CB LYS A 21 -7.382 -15.741 -16.823 1.00 0.00 C ATOM 302 CG LYS A 21 -7.315 -14.724 -17.965 1.00 0.00 C ATOM 303 CD LYS A 21 -7.815 -13.352 -17.507 1.00 0.00 C ATOM 304 CE LYS A 21 -7.676 -12.317 -18.625 1.00 0.00 C ATOM 305 NZ LYS A 21 -9.007 -11.814 -19.033 1.00 0.00 N ATOM 0 H LYS A 21 -8.745 -17.575 -15.889 1.00 0.00 H new ATOM 0 HA LYS A 21 -7.564 -17.105 -18.416 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.308 -15.605 -16.264 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -6.561 -15.567 -16.127 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -6.289 -14.640 -18.323 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.917 -15.073 -18.804 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -8.859 -13.425 -17.201 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -7.249 -13.028 -16.634 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -7.055 -11.488 -18.286 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -7.171 -12.764 -19.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.895 -11.112 -19.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.587 -12.606 -19.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.475 -11.370 -18.218 1.00 0.00 H new ATOM 319 N ARG A 22 -5.289 -17.612 -16.118 1.00 0.00 N ATOM 320 CA ARG A 22 -3.955 -18.144 -15.896 1.00 0.00 C ATOM 321 C ARG A 22 -3.580 -18.035 -14.417 1.00 0.00 C ATOM 322 O ARG A 22 -4.009 -17.110 -13.730 1.00 0.00 O ATOM 323 CB ARG A 22 -2.917 -17.395 -16.735 1.00 0.00 C ATOM 324 CG ARG A 22 -2.277 -18.323 -17.770 1.00 0.00 C ATOM 325 CD ARG A 22 -2.142 -17.623 -19.124 1.00 0.00 C ATOM 326 NE ARG A 22 -1.277 -18.421 -20.022 1.00 0.00 N ATOM 327 CZ ARG A 22 -0.786 -17.972 -21.185 1.00 0.00 C ATOM 328 NH1 ARG A 22 -1.071 -16.730 -21.599 1.00 0.00 N ATOM 329 NH2 ARG A 22 -0.010 -18.766 -21.935 1.00 0.00 N ATOM 0 H ARG A 22 -5.684 -17.108 -15.325 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.961 -19.192 -16.197 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -3.391 -16.553 -17.240 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -2.146 -16.983 -16.084 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -1.294 -18.640 -17.421 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -2.882 -19.223 -17.880 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -3.126 -17.492 -19.575 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -1.719 -16.628 -18.988 1.00 0.00 H new ATOM 0 HE ARG A 22 -1.040 -19.372 -19.738 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -1.662 -16.125 -21.029 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -0.697 -16.389 -22.484 1.00 0.00 H new ATOM 0 HH21 ARG A 22 0.207 -19.712 -21.621 1.00 0.00 H new ATOM 0 HH22 ARG A 22 0.364 -18.425 -22.820 1.00 0.00 H new ATOM 343 N ARG A 23 -2.781 -18.994 -13.970 1.00 0.00 N ATOM 344 CA ARG A 23 -2.343 -19.018 -12.585 1.00 0.00 C ATOM 345 C ARG A 23 -1.276 -17.947 -12.348 1.00 0.00 C ATOM 346 O ARG A 23 -1.243 -16.933 -13.043 1.00 0.00 O ATOM 347 CB ARG A 23 -1.773 -20.388 -12.211 1.00 0.00 C ATOM 348 CG ARG A 23 -2.299 -20.847 -10.850 1.00 0.00 C ATOM 349 CD ARG A 23 -1.150 -21.265 -9.931 1.00 0.00 C ATOM 350 NE ARG A 23 -1.121 -22.738 -9.794 1.00 0.00 N ATOM 351 CZ ARG A 23 -0.345 -23.397 -8.923 1.00 0.00 C ATOM 352 NH1 ARG A 23 0.471 -22.717 -8.106 1.00 0.00 N ATOM 353 NH2 ARG A 23 -0.384 -24.735 -8.869 1.00 0.00 N ATOM 0 H ARG A 23 -2.426 -19.760 -14.543 1.00 0.00 H new ATOM 0 HA ARG A 23 -3.212 -18.816 -11.959 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -2.042 -21.118 -12.974 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -0.684 -20.339 -12.186 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -2.867 -20.041 -10.385 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -2.985 -21.684 -10.984 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -0.202 -20.911 -10.336 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -1.271 -20.803 -8.951 1.00 0.00 H new ATOM 0 HE ARG A 23 -1.730 -23.286 -10.401 1.00 0.00 H new ATOM 0 HH11 ARG A 23 0.501 -21.698 -8.147 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.062 -23.218 -7.443 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -1.005 -25.253 -9.491 1.00 0.00 H new ATOM 0 HH22 ARG A 23 0.207 -25.236 -8.206 1.00 0.00 H new ATOM 367 N GLY A 24 -0.430 -18.209 -11.363 1.00 0.00 N ATOM 368 CA GLY A 24 0.636 -17.280 -11.025 1.00 0.00 C ATOM 369 C GLY A 24 0.088 -16.072 -10.262 1.00 0.00 C ATOM 370 O GLY A 24 0.284 -14.931 -10.678 1.00 0.00 O ATOM 0 H GLY A 24 -0.461 -19.051 -10.788 1.00 0.00 H new ATOM 0 HA2 GLY A 24 1.387 -17.787 -10.419 1.00 0.00 H new ATOM 0 HA3 GLY A 24 1.134 -16.945 -11.935 1.00 0.00 H new ATOM 374 N GLY A 25 -0.586 -16.364 -9.160 1.00 0.00 N ATOM 375 CA GLY A 25 -1.163 -15.315 -8.336 1.00 0.00 C ATOM 376 C GLY A 25 -2.387 -14.696 -9.014 1.00 0.00 C ATOM 377 O GLY A 25 -2.266 -13.714 -9.745 1.00 0.00 O ATOM 0 H GLY A 25 -0.746 -17.312 -8.818 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.448 -15.724 -7.367 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.417 -14.543 -8.149 1.00 0.00 H new ATOM 381 N VAL A 26 -3.538 -15.296 -8.747 1.00 0.00 N ATOM 382 CA VAL A 26 -4.783 -14.816 -9.322 1.00 0.00 C ATOM 383 C VAL A 26 -5.164 -13.488 -8.665 1.00 0.00 C ATOM 384 O VAL A 26 -5.433 -12.505 -9.354 1.00 0.00 O ATOM 385 CB VAL A 26 -5.869 -15.884 -9.185 1.00 0.00 C ATOM 386 CG1 VAL A 26 -7.193 -15.265 -8.731 1.00 0.00 C ATOM 387 CG2 VAL A 26 -6.045 -16.659 -10.492 1.00 0.00 C ATOM 0 H VAL A 26 -3.634 -16.110 -8.140 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.664 -14.629 -10.389 1.00 0.00 H new ATOM 0 HB VAL A 26 -5.549 -16.590 -8.418 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -7.948 -16.046 -8.642 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.056 -14.781 -7.764 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.520 -14.527 -9.463 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.823 -17.412 -10.367 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.331 -15.971 -11.287 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -5.107 -17.147 -10.755 1.00 0.00 H new ATOM 397 N PRO A 27 -5.176 -13.502 -7.305 1.00 0.00 N ATOM 398 CA PRO A 27 -5.520 -12.310 -6.547 1.00 0.00 C ATOM 399 C PRO A 27 -4.370 -11.301 -6.562 1.00 0.00 C ATOM 400 O PRO A 27 -3.829 -10.956 -5.512 1.00 0.00 O ATOM 401 CB PRO A 27 -5.851 -12.814 -5.152 1.00 0.00 C ATOM 402 CG PRO A 27 -5.234 -14.200 -5.052 1.00 0.00 C ATOM 403 CD PRO A 27 -4.863 -14.647 -6.456 1.00 0.00 C ATOM 0 HA PRO A 27 -6.366 -11.770 -6.972 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -5.444 -12.149 -4.390 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -6.929 -12.854 -4.997 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -4.352 -14.180 -4.412 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -5.938 -14.900 -4.602 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -3.808 -14.911 -6.521 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -5.431 -15.528 -6.754 1.00 0.00 H new ATOM 411 N SER A 28 -4.032 -10.854 -7.763 1.00 0.00 N ATOM 412 CA SER A 28 -2.957 -9.891 -7.927 1.00 0.00 C ATOM 413 C SER A 28 -3.506 -8.590 -8.517 1.00 0.00 C ATOM 414 O SER A 28 -3.264 -7.510 -7.980 1.00 0.00 O ATOM 415 CB SER A 28 -1.847 -10.451 -8.819 1.00 0.00 C ATOM 416 OG SER A 28 -1.532 -11.802 -8.495 1.00 0.00 O ATOM 0 H SER A 28 -4.484 -11.141 -8.631 1.00 0.00 H new ATOM 0 HA SER A 28 -2.529 -9.686 -6.946 1.00 0.00 H new ATOM 0 HB2 SER A 28 -2.156 -10.391 -9.863 1.00 0.00 H new ATOM 0 HB3 SER A 28 -0.953 -9.836 -8.715 1.00 0.00 H new ATOM 0 HG SER A 28 -1.734 -12.378 -9.262 1.00 0.00 H new ATOM 422 N LEU A 29 -4.234 -8.736 -9.614 1.00 0.00 N ATOM 423 CA LEU A 29 -4.819 -7.586 -10.282 1.00 0.00 C ATOM 424 C LEU A 29 -5.519 -6.702 -9.248 1.00 0.00 C ATOM 425 O LEU A 29 -5.338 -5.486 -9.241 1.00 0.00 O ATOM 426 CB LEU A 29 -5.732 -8.037 -11.424 1.00 0.00 C ATOM 427 CG LEU A 29 -6.773 -9.102 -11.070 1.00 0.00 C ATOM 428 CD1 LEU A 29 -8.191 -8.534 -11.161 1.00 0.00 C ATOM 429 CD2 LEU A 29 -6.599 -10.349 -11.939 1.00 0.00 C ATOM 0 H LEU A 29 -4.432 -9.633 -10.057 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.042 -6.979 -10.746 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -6.254 -7.162 -11.813 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.108 -8.421 -12.231 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.613 -9.405 -10.035 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -8.911 -9.311 -10.905 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.294 -7.700 -10.467 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -8.379 -8.186 -12.177 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -7.351 -11.090 -11.667 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -6.717 -10.080 -12.989 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -5.605 -10.767 -11.781 1.00 0.00 H new ATOM 441 N ILE A 30 -6.305 -7.348 -8.399 1.00 0.00 N ATOM 442 CA ILE A 30 -7.032 -6.636 -7.362 1.00 0.00 C ATOM 443 C ILE A 30 -6.036 -5.989 -6.398 1.00 0.00 C ATOM 444 O ILE A 30 -6.336 -4.967 -5.783 1.00 0.00 O ATOM 445 CB ILE A 30 -8.036 -7.566 -6.677 1.00 0.00 C ATOM 446 CG1 ILE A 30 -8.853 -6.812 -5.627 1.00 0.00 C ATOM 447 CG2 ILE A 30 -7.334 -8.790 -6.086 1.00 0.00 C ATOM 448 CD1 ILE A 30 -9.593 -5.628 -6.254 1.00 0.00 C ATOM 0 H ILE A 30 -6.454 -8.357 -8.408 1.00 0.00 H new ATOM 0 HA ILE A 30 -7.624 -5.830 -7.797 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.736 -7.928 -7.430 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -9.570 -7.490 -5.164 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -8.194 -6.456 -4.835 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -8.070 -9.435 -5.605 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.833 -9.342 -6.882 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.598 -8.467 -5.350 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -10.166 -5.109 -5.486 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -8.871 -4.940 -6.695 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -10.269 -5.990 -7.028 1.00 0.00 H new ATOM 460 N ALA A 31 -4.871 -6.611 -6.297 1.00 0.00 N ATOM 461 CA ALA A 31 -3.828 -6.108 -5.418 1.00 0.00 C ATOM 462 C ALA A 31 -3.318 -4.768 -5.953 1.00 0.00 C ATOM 463 O ALA A 31 -3.117 -3.826 -5.188 1.00 0.00 O ATOM 464 CB ALA A 31 -2.714 -7.150 -5.298 1.00 0.00 C ATOM 0 H ALA A 31 -4.626 -7.458 -6.809 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.221 -5.935 -4.416 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -1.932 -6.773 -4.639 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.122 -8.073 -4.886 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.293 -7.348 -6.284 1.00 0.00 H new ATOM 470 N GLY A 32 -3.124 -4.726 -7.263 1.00 0.00 N ATOM 471 CA GLY A 32 -2.641 -3.518 -7.909 1.00 0.00 C ATOM 472 C GLY A 32 -3.670 -2.390 -7.801 1.00 0.00 C ATOM 473 O GLY A 32 -3.355 -1.302 -7.321 1.00 0.00 O ATOM 0 H GLY A 32 -3.293 -5.509 -7.894 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.704 -3.205 -7.449 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.429 -3.722 -8.958 1.00 0.00 H new ATOM 477 N LEU A 33 -4.878 -2.688 -8.255 1.00 0.00 N ATOM 478 CA LEU A 33 -5.954 -1.713 -8.215 1.00 0.00 C ATOM 479 C LEU A 33 -6.077 -1.153 -6.796 1.00 0.00 C ATOM 480 O LEU A 33 -6.244 0.052 -6.613 1.00 0.00 O ATOM 481 CB LEU A 33 -7.251 -2.324 -8.749 1.00 0.00 C ATOM 482 CG LEU A 33 -8.496 -1.439 -8.660 1.00 0.00 C ATOM 483 CD1 LEU A 33 -8.962 -1.008 -10.052 1.00 0.00 C ATOM 484 CD2 LEU A 33 -9.609 -2.135 -7.874 1.00 0.00 C ATOM 0 H LEU A 33 -5.136 -3.591 -8.653 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.730 -0.872 -8.872 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.098 -2.597 -9.793 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.446 -3.247 -8.203 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.233 -0.534 -8.113 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -9.848 -0.380 -9.961 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -8.168 -0.446 -10.544 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.202 -1.891 -10.645 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -10.482 -1.484 -7.826 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.878 -3.067 -8.372 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -9.261 -2.351 -6.864 1.00 0.00 H new ATOM 496 N PHE A 34 -5.990 -2.055 -5.829 1.00 0.00 N ATOM 497 CA PHE A 34 -6.089 -1.666 -4.433 1.00 0.00 C ATOM 498 C PHE A 34 -4.992 -0.665 -4.063 1.00 0.00 C ATOM 499 O PHE A 34 -5.273 0.387 -3.491 1.00 0.00 O ATOM 500 CB PHE A 34 -5.905 -2.936 -3.600 1.00 0.00 C ATOM 501 CG PHE A 34 -6.056 -2.720 -2.093 1.00 0.00 C ATOM 502 CD1 PHE A 34 -7.183 -2.141 -1.599 1.00 0.00 C ATOM 503 CD2 PHE A 34 -5.063 -3.108 -1.248 1.00 0.00 C ATOM 504 CE1 PHE A 34 -7.323 -1.940 -0.200 1.00 0.00 C ATOM 505 CE2 PHE A 34 -5.203 -2.907 0.151 1.00 0.00 C ATOM 506 CZ PHE A 34 -6.330 -2.328 0.645 1.00 0.00 C ATOM 0 H PHE A 34 -5.852 -3.054 -5.985 1.00 0.00 H new ATOM 0 HA PHE A 34 -7.053 -1.193 -4.247 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -6.633 -3.680 -3.925 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -4.916 -3.349 -3.800 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -7.971 -1.834 -2.270 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -4.169 -3.569 -1.641 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -8.217 -1.479 0.193 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -4.415 -3.214 0.822 1.00 0.00 H new ATOM 0 HZ PHE A 34 -6.437 -2.176 1.709 1.00 0.00 H new ATOM 516 N VAL A 35 -3.764 -1.028 -4.405 1.00 0.00 N ATOM 517 CA VAL A 35 -2.624 -0.175 -4.116 1.00 0.00 C ATOM 518 C VAL A 35 -2.834 1.190 -4.774 1.00 0.00 C ATOM 519 O VAL A 35 -2.453 2.217 -4.215 1.00 0.00 O ATOM 520 CB VAL A 35 -1.331 -0.862 -4.562 1.00 0.00 C ATOM 521 CG1 VAL A 35 -0.190 0.149 -4.691 1.00 0.00 C ATOM 522 CG2 VAL A 35 -0.954 -1.996 -3.606 1.00 0.00 C ATOM 0 H VAL A 35 -3.534 -1.901 -4.879 1.00 0.00 H new ATOM 0 HA VAL A 35 -2.534 -0.007 -3.043 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.505 -1.298 -5.546 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.717 -0.365 -5.009 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.456 0.906 -5.429 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.017 0.627 -3.727 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -0.032 -2.467 -3.946 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -0.808 -1.593 -2.604 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.754 -2.736 -3.586 1.00 0.00 H new ATOM 532 N GLY A 36 -3.439 1.156 -5.952 1.00 0.00 N ATOM 533 CA GLY A 36 -3.704 2.379 -6.692 1.00 0.00 C ATOM 534 C GLY A 36 -4.787 3.212 -6.004 1.00 0.00 C ATOM 535 O GLY A 36 -4.698 4.438 -5.961 1.00 0.00 O ATOM 0 H GLY A 36 -3.753 0.302 -6.412 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.788 2.964 -6.775 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.018 2.134 -7.706 1.00 0.00 H new ATOM 539 N CYS A 37 -5.785 2.513 -5.483 1.00 0.00 N ATOM 540 CA CYS A 37 -6.884 3.174 -4.800 1.00 0.00 C ATOM 541 C CYS A 37 -6.334 3.834 -3.534 1.00 0.00 C ATOM 542 O CYS A 37 -6.485 5.040 -3.343 1.00 0.00 O ATOM 543 CB CYS A 37 -8.022 2.200 -4.487 1.00 0.00 C ATOM 544 SG CYS A 37 -9.636 3.040 -4.687 1.00 0.00 S ATOM 0 H CYS A 37 -5.855 1.496 -5.520 1.00 0.00 H new ATOM 0 HA CYS A 37 -7.314 3.937 -5.449 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -7.967 1.337 -5.151 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -7.921 1.825 -3.468 1.00 0.00 H new ATOM 0 HG CYS A 37 -10.596 2.205 -4.421 1.00 0.00 H new ATOM 550 N LEU A 38 -5.709 3.015 -2.701 1.00 0.00 N ATOM 551 CA LEU A 38 -5.137 3.505 -1.458 1.00 0.00 C ATOM 552 C LEU A 38 -4.080 4.566 -1.772 1.00 0.00 C ATOM 553 O LEU A 38 -3.852 5.475 -0.975 1.00 0.00 O ATOM 554 CB LEU A 38 -4.608 2.342 -0.617 1.00 0.00 C ATOM 555 CG LEU A 38 -3.328 1.675 -1.123 1.00 0.00 C ATOM 556 CD1 LEU A 38 -2.088 2.415 -0.619 1.00 0.00 C ATOM 557 CD2 LEU A 38 -3.299 0.190 -0.753 1.00 0.00 C ATOM 0 H LEU A 38 -5.586 2.015 -2.862 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.903 3.986 -0.850 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.429 2.704 0.396 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.388 1.583 -0.551 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.319 1.736 -2.211 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -1.192 1.920 -0.993 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.109 3.445 -0.975 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.078 2.408 0.471 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.378 -0.260 -1.125 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.343 0.084 0.331 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.155 -0.313 -1.201 1.00 0.00 H new ATOM 569 N ALA A 39 -3.464 4.416 -2.935 1.00 0.00 N ATOM 570 CA ALA A 39 -2.437 5.351 -3.364 1.00 0.00 C ATOM 571 C ALA A 39 -3.064 6.731 -3.570 1.00 0.00 C ATOM 572 O ALA A 39 -2.674 7.697 -2.917 1.00 0.00 O ATOM 573 CB ALA A 39 -1.763 4.822 -4.632 1.00 0.00 C ATOM 0 H ALA A 39 -3.656 3.661 -3.594 1.00 0.00 H new ATOM 0 HA ALA A 39 -1.665 5.450 -2.601 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -0.993 5.523 -4.954 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.308 3.853 -4.425 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -2.507 4.713 -5.421 1.00 0.00 H new ATOM 579 N GLY A 40 -4.025 6.780 -4.481 1.00 0.00 N ATOM 580 CA GLY A 40 -4.709 8.026 -4.781 1.00 0.00 C ATOM 581 C GLY A 40 -5.478 8.536 -3.561 1.00 0.00 C ATOM 582 O GLY A 40 -5.161 9.595 -3.021 1.00 0.00 O ATOM 0 H GLY A 40 -4.346 5.977 -5.021 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.984 8.776 -5.098 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -5.397 7.876 -5.613 1.00 0.00 H new ATOM 586 N TYR A 41 -6.475 7.760 -3.162 1.00 0.00 N ATOM 587 CA TYR A 41 -7.292 8.120 -2.016 1.00 0.00 C ATOM 588 C TYR A 41 -6.419 8.455 -0.804 1.00 0.00 C ATOM 589 O TYR A 41 -6.767 9.322 -0.005 1.00 0.00 O ATOM 590 CB TYR A 41 -8.137 6.886 -1.695 1.00 0.00 C ATOM 591 CG TYR A 41 -9.145 7.098 -0.564 1.00 0.00 C ATOM 592 CD1 TYR A 41 -10.362 7.693 -0.828 1.00 0.00 C ATOM 593 CD2 TYR A 41 -8.837 6.695 0.719 1.00 0.00 C ATOM 594 CE1 TYR A 41 -11.311 7.893 0.237 1.00 0.00 C ATOM 595 CE2 TYR A 41 -9.786 6.895 1.784 1.00 0.00 C ATOM 596 CZ TYR A 41 -10.976 7.484 1.490 1.00 0.00 C ATOM 597 OH TYR A 41 -11.873 7.673 2.495 1.00 0.00 O ATOM 0 H TYR A 41 -6.736 6.883 -3.612 1.00 0.00 H new ATOM 0 HA TYR A 41 -7.901 8.996 -2.239 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -8.674 6.582 -2.594 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -7.473 6.064 -1.427 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -10.603 8.008 -1.832 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -7.884 6.230 0.925 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -12.267 8.357 0.045 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -9.558 6.584 2.793 1.00 0.00 H new ATOM 0 HH TYR A 41 -11.500 7.332 3.335 1.00 0.00 H new ATOM 607 N GLY A 42 -5.302 7.749 -0.707 1.00 0.00 N ATOM 608 CA GLY A 42 -4.377 7.960 0.394 1.00 0.00 C ATOM 609 C GLY A 42 -3.732 9.345 0.310 1.00 0.00 C ATOM 610 O GLY A 42 -4.109 10.255 1.046 1.00 0.00 O ATOM 0 H GLY A 42 -5.017 7.031 -1.372 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.905 7.858 1.342 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.603 7.193 0.376 1.00 0.00 H new ATOM 614 N ALA A 43 -2.770 9.460 -0.594 1.00 0.00 N ATOM 615 CA ALA A 43 -2.069 10.719 -0.784 1.00 0.00 C ATOM 616 C ALA A 43 -3.082 11.866 -0.790 1.00 0.00 C ATOM 617 O ALA A 43 -3.046 12.734 0.080 1.00 0.00 O ATOM 618 CB ALA A 43 -1.250 10.657 -2.075 1.00 0.00 C ATOM 0 H ALA A 43 -2.460 8.703 -1.203 1.00 0.00 H new ATOM 0 HA ALA A 43 -1.373 10.899 0.035 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -0.724 11.601 -2.218 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.526 9.845 -2.008 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -1.916 10.481 -2.920 1.00 0.00 H new ATOM 624 N TYR A 44 -3.960 11.832 -1.781 1.00 0.00 N ATOM 625 CA TYR A 44 -4.980 12.858 -1.912 1.00 0.00 C ATOM 626 C TYR A 44 -4.358 14.207 -2.279 1.00 0.00 C ATOM 627 O TYR A 44 -4.639 14.756 -3.343 1.00 0.00 O ATOM 628 CB TYR A 44 -5.642 12.973 -0.537 1.00 0.00 C ATOM 629 CG TYR A 44 -7.101 13.430 -0.585 1.00 0.00 C ATOM 630 CD1 TYR A 44 -8.113 12.500 -0.709 1.00 0.00 C ATOM 631 CD2 TYR A 44 -7.406 14.774 -0.504 1.00 0.00 C ATOM 632 CE1 TYR A 44 -9.486 12.931 -0.754 1.00 0.00 C ATOM 633 CE2 TYR A 44 -8.779 15.205 -0.549 1.00 0.00 C ATOM 634 CZ TYR A 44 -9.751 14.262 -0.672 1.00 0.00 C ATOM 635 OH TYR A 44 -11.049 14.669 -0.715 1.00 0.00 O ATOM 0 H TYR A 44 -3.986 11.110 -2.501 1.00 0.00 H new ATOM 0 HA TYR A 44 -5.689 12.595 -2.697 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -5.591 12.005 -0.039 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -5.072 13.675 0.072 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -7.875 11.448 -0.772 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -6.614 15.502 -0.407 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -10.287 12.213 -0.851 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -9.031 16.253 -0.486 1.00 0.00 H new ATOM 0 HH TYR A 44 -11.088 15.646 -0.645 1.00 0.00 H new ATOM 645 N ARG A 45 -3.524 14.703 -1.376 1.00 0.00 N ATOM 646 CA ARG A 45 -2.860 15.977 -1.592 1.00 0.00 C ATOM 647 C ARG A 45 -1.343 15.809 -1.484 1.00 0.00 C ATOM 648 O ARG A 45 -0.599 16.786 -1.566 1.00 0.00 O ATOM 649 CB ARG A 45 -3.324 17.019 -0.573 1.00 0.00 C ATOM 650 CG ARG A 45 -4.079 18.159 -1.260 1.00 0.00 C ATOM 651 CD ARG A 45 -4.219 19.364 -0.328 1.00 0.00 C ATOM 652 NE ARG A 45 -5.517 19.308 0.382 1.00 0.00 N ATOM 653 CZ ARG A 45 -5.730 18.606 1.503 1.00 0.00 C ATOM 654 NH1 ARG A 45 -4.732 17.897 2.049 1.00 0.00 N ATOM 655 NH2 ARG A 45 -6.940 18.613 2.078 1.00 0.00 N ATOM 0 H ARG A 45 -3.293 14.246 -0.494 1.00 0.00 H new ATOM 0 HA ARG A 45 -3.121 16.322 -2.592 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.968 16.546 0.168 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.462 17.419 -0.038 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.551 18.455 -2.166 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.067 17.814 -1.565 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -3.401 19.374 0.393 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -4.149 20.288 -0.902 1.00 0.00 H new ATOM 0 HE ARG A 45 -6.298 19.837 -0.007 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -3.811 17.892 1.611 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -4.894 17.362 2.902 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -7.699 19.153 1.662 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -7.102 18.079 2.931 1.00 0.00 H new ATOM 669 N VAL A 46 -0.928 14.564 -1.303 1.00 0.00 N ATOM 670 CA VAL A 46 0.486 14.256 -1.183 1.00 0.00 C ATOM 671 C VAL A 46 1.104 14.165 -2.580 1.00 0.00 C ATOM 672 O VAL A 46 2.313 13.984 -2.717 1.00 0.00 O ATOM 673 CB VAL A 46 0.676 12.979 -0.361 1.00 0.00 C ATOM 674 CG1 VAL A 46 2.112 12.463 -0.474 1.00 0.00 C ATOM 675 CG2 VAL A 46 0.289 13.206 1.102 1.00 0.00 C ATOM 0 H VAL A 46 -1.547 13.756 -1.237 1.00 0.00 H new ATOM 0 HA VAL A 46 1.006 15.051 -0.648 1.00 0.00 H new ATOM 0 HB VAL A 46 0.013 12.216 -0.769 1.00 0.00 H new ATOM 0 HG11 VAL A 46 2.220 11.555 0.119 1.00 0.00 H new ATOM 0 HG12 VAL A 46 2.339 12.244 -1.517 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.802 13.222 -0.105 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.433 12.283 1.664 1.00 0.00 H new ATOM 0 HG22 VAL A 46 0.915 13.991 1.526 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.757 13.506 1.159 1.00 0.00 H new ATOM 685 N SER A 47 0.246 14.293 -3.581 1.00 0.00 N ATOM 686 CA SER A 47 0.692 14.228 -4.962 1.00 0.00 C ATOM 687 C SER A 47 1.245 15.586 -5.399 1.00 0.00 C ATOM 688 O SER A 47 0.690 16.627 -5.051 1.00 0.00 O ATOM 689 CB SER A 47 -0.447 13.796 -5.889 1.00 0.00 C ATOM 690 OG SER A 47 -0.057 13.816 -7.259 1.00 0.00 O ATOM 0 H SER A 47 -0.756 14.441 -3.463 1.00 0.00 H new ATOM 0 HA SER A 47 1.484 13.482 -5.030 1.00 0.00 H new ATOM 0 HB2 SER A 47 -0.773 12.791 -5.619 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.302 14.457 -5.746 1.00 0.00 H new ATOM 0 HG SER A 47 -0.794 14.164 -7.804 1.00 0.00 H new ATOM 696 N ASN A 48 2.333 15.531 -6.153 1.00 0.00 N ATOM 697 CA ASN A 48 2.967 16.744 -6.640 1.00 0.00 C ATOM 698 C ASN A 48 3.724 17.415 -5.492 1.00 0.00 C ATOM 699 O ASN A 48 4.937 17.605 -5.571 1.00 0.00 O ATOM 700 CB ASN A 48 1.928 17.736 -7.165 1.00 0.00 C ATOM 701 CG ASN A 48 2.573 18.762 -8.099 1.00 0.00 C ATOM 702 OD1 ASN A 48 3.574 18.507 -8.749 1.00 0.00 O ATOM 703 ND2 ASN A 48 1.946 19.935 -8.131 1.00 0.00 N ATOM 0 H ASN A 48 2.791 14.666 -6.438 1.00 0.00 H new ATOM 0 HA ASN A 48 3.644 16.469 -7.449 1.00 0.00 H new ATOM 0 HB2 ASN A 48 1.143 17.198 -7.696 1.00 0.00 H new ATOM 0 HB3 ASN A 48 1.454 18.248 -6.328 1.00 0.00 H new ATOM 0 HD21 ASN A 48 2.299 20.686 -8.724 1.00 0.00 H new ATOM 0 HD22 ASN A 48 1.112 20.083 -7.562 1.00 0.00 H new ATOM 710 N ASP A 49 2.978 17.755 -4.452 1.00 0.00 N ATOM 711 CA ASP A 49 3.563 18.400 -3.290 1.00 0.00 C ATOM 712 C ASP A 49 4.486 17.412 -2.574 1.00 0.00 C ATOM 713 O ASP A 49 5.234 17.795 -1.676 1.00 0.00 O ATOM 714 CB ASP A 49 2.482 18.839 -2.300 1.00 0.00 C ATOM 715 CG ASP A 49 2.920 19.904 -1.293 1.00 0.00 C ATOM 716 OD1 ASP A 49 4.009 19.818 -0.707 1.00 0.00 O ATOM 717 OD2 ASP A 49 2.079 20.866 -1.116 1.00 0.00 O ATOM 0 H ASP A 49 1.972 17.596 -4.390 1.00 0.00 H new ATOM 0 HA ASP A 49 4.115 19.275 -3.633 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.630 19.221 -2.862 1.00 0.00 H new ATOM 0 HB3 ASP A 49 2.136 17.963 -1.752 1.00 0.00 H new ATOM 722 N LYS A 50 4.404 16.160 -2.999 1.00 0.00 N ATOM 723 CA LYS A 50 5.223 15.114 -2.410 1.00 0.00 C ATOM 724 C LYS A 50 5.389 13.975 -3.417 1.00 0.00 C ATOM 725 O LYS A 50 5.105 14.142 -4.602 1.00 0.00 O ATOM 726 CB LYS A 50 4.639 14.669 -1.068 1.00 0.00 C ATOM 727 CG LYS A 50 5.479 15.195 0.098 1.00 0.00 C ATOM 728 CD LYS A 50 4.589 15.628 1.264 1.00 0.00 C ATOM 729 CE LYS A 50 5.431 16.022 2.479 1.00 0.00 C ATOM 730 NZ LYS A 50 4.836 15.478 3.721 1.00 0.00 N ATOM 0 H LYS A 50 3.783 15.846 -3.745 1.00 0.00 H new ATOM 0 HA LYS A 50 6.221 15.491 -2.188 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.615 15.031 -0.975 1.00 0.00 H new ATOM 0 HB3 LYS A 50 4.597 13.581 -1.029 1.00 0.00 H new ATOM 0 HG2 LYS A 50 6.170 14.421 0.431 1.00 0.00 H new ATOM 0 HG3 LYS A 50 6.083 16.039 -0.236 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.968 16.470 0.959 1.00 0.00 H new ATOM 0 HD3 LYS A 50 3.914 14.815 1.533 1.00 0.00 H new ATOM 0 HE2 LYS A 50 6.448 15.647 2.361 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.498 17.108 2.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.420 15.755 4.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.874 15.856 3.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.795 14.441 3.661 1.00 0.00 H new ATOM 744 N ARG A 51 5.848 12.841 -2.908 1.00 0.00 N ATOM 745 CA ARG A 51 6.056 11.673 -3.749 1.00 0.00 C ATOM 746 C ARG A 51 4.800 11.384 -4.574 1.00 0.00 C ATOM 747 O ARG A 51 3.683 11.495 -4.072 1.00 0.00 O ATOM 748 CB ARG A 51 6.399 10.443 -2.907 1.00 0.00 C ATOM 749 CG ARG A 51 5.502 10.356 -1.671 1.00 0.00 C ATOM 750 CD ARG A 51 6.337 10.280 -0.391 1.00 0.00 C ATOM 751 NE ARG A 51 7.237 9.106 -0.443 1.00 0.00 N ATOM 752 CZ ARG A 51 7.797 8.540 0.635 1.00 0.00 C ATOM 753 NH1 ARG A 51 7.554 9.038 1.855 1.00 0.00 N ATOM 754 NH2 ARG A 51 8.600 7.477 0.492 1.00 0.00 N ATOM 0 H ARG A 51 6.082 12.706 -1.924 1.00 0.00 H new ATOM 0 HA ARG A 51 6.892 11.887 -4.415 1.00 0.00 H new ATOM 0 HB2 ARG A 51 6.283 9.542 -3.509 1.00 0.00 H new ATOM 0 HB3 ARG A 51 7.444 10.488 -2.600 1.00 0.00 H new ATOM 0 HG2 ARG A 51 4.847 11.226 -1.631 1.00 0.00 H new ATOM 0 HG3 ARG A 51 4.861 9.478 -1.744 1.00 0.00 H new ATOM 0 HD2 ARG A 51 6.922 11.192 -0.274 1.00 0.00 H new ATOM 0 HD3 ARG A 51 5.682 10.208 0.477 1.00 0.00 H new ATOM 0 HE ARG A 51 7.444 8.702 -1.357 1.00 0.00 H new ATOM 0 HH11 ARG A 51 6.943 9.848 1.963 1.00 0.00 H new ATOM 0 HH12 ARG A 51 7.980 8.607 2.676 1.00 0.00 H new ATOM 0 HH21 ARG A 51 8.785 7.099 -0.437 1.00 0.00 H new ATOM 0 HH22 ARG A 51 9.026 7.046 1.312 1.00 0.00 H new ATOM 768 N ASP A 52 5.027 11.019 -5.828 1.00 0.00 N ATOM 769 CA ASP A 52 3.928 10.712 -6.728 1.00 0.00 C ATOM 770 C ASP A 52 4.034 9.254 -7.178 1.00 0.00 C ATOM 771 O ASP A 52 3.119 8.463 -6.955 1.00 0.00 O ATOM 772 CB ASP A 52 3.975 11.597 -7.975 1.00 0.00 C ATOM 773 CG ASP A 52 2.642 11.748 -8.712 1.00 0.00 C ATOM 774 OD1 ASP A 52 1.578 11.386 -8.187 1.00 0.00 O ATOM 775 OD2 ASP A 52 2.726 12.268 -9.889 1.00 0.00 O ATOM 0 H ASP A 52 5.955 10.929 -6.241 1.00 0.00 H new ATOM 0 HA ASP A 52 2.995 10.890 -6.194 1.00 0.00 H new ATOM 0 HB2 ASP A 52 4.327 12.587 -7.686 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.711 11.186 -8.666 1.00 0.00 H new ATOM 780 N VAL A 53 5.160 8.942 -7.803 1.00 0.00 N ATOM 781 CA VAL A 53 5.398 7.592 -8.287 1.00 0.00 C ATOM 782 C VAL A 53 6.230 6.826 -7.257 1.00 0.00 C ATOM 783 O VAL A 53 6.354 5.605 -7.339 1.00 0.00 O ATOM 784 CB VAL A 53 6.052 7.640 -9.669 1.00 0.00 C ATOM 785 CG1 VAL A 53 6.378 6.231 -10.170 1.00 0.00 C ATOM 786 CG2 VAL A 53 5.167 8.386 -10.669 1.00 0.00 C ATOM 0 H VAL A 53 5.917 9.600 -7.985 1.00 0.00 H new ATOM 0 HA VAL A 53 4.456 7.057 -8.407 1.00 0.00 H new ATOM 0 HB VAL A 53 6.989 8.189 -9.577 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.842 6.293 -11.154 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.065 5.748 -9.475 1.00 0.00 H new ATOM 0 HG13 VAL A 53 5.460 5.647 -10.238 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.655 8.406 -11.643 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.207 7.878 -10.755 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.007 9.407 -10.323 1.00 0.00 H new ATOM 796 N LYS A 54 6.780 7.574 -6.312 1.00 0.00 N ATOM 797 CA LYS A 54 7.597 6.981 -5.267 1.00 0.00 C ATOM 798 C LYS A 54 6.741 6.018 -4.441 1.00 0.00 C ATOM 799 O LYS A 54 7.171 4.908 -4.132 1.00 0.00 O ATOM 800 CB LYS A 54 8.276 8.069 -4.434 1.00 0.00 C ATOM 801 CG LYS A 54 9.741 7.721 -4.166 1.00 0.00 C ATOM 802 CD LYS A 54 10.628 8.963 -4.270 1.00 0.00 C ATOM 803 CE LYS A 54 11.723 8.946 -3.201 1.00 0.00 C ATOM 804 NZ LYS A 54 13.062 8.969 -3.831 1.00 0.00 N ATOM 0 H LYS A 54 6.676 8.587 -6.248 1.00 0.00 H new ATOM 0 HA LYS A 54 8.406 6.395 -5.703 1.00 0.00 H new ATOM 0 HB2 LYS A 54 8.215 9.023 -4.957 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.748 8.190 -3.488 1.00 0.00 H new ATOM 0 HG2 LYS A 54 9.838 7.282 -3.173 1.00 0.00 H new ATOM 0 HG3 LYS A 54 10.076 6.969 -4.881 1.00 0.00 H new ATOM 0 HD2 LYS A 54 11.082 9.008 -5.260 1.00 0.00 H new ATOM 0 HD3 LYS A 54 10.019 9.860 -4.157 1.00 0.00 H new ATOM 0 HE2 LYS A 54 11.610 9.807 -2.542 1.00 0.00 H new ATOM 0 HE3 LYS A 54 11.621 8.055 -2.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.794 8.957 -3.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 13.173 8.134 -4.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.162 9.832 -4.403 1.00 0.00 H new ATOM 818 N VAL A 55 5.544 6.479 -4.108 1.00 0.00 N ATOM 819 CA VAL A 55 4.624 5.672 -3.324 1.00 0.00 C ATOM 820 C VAL A 55 4.125 4.503 -4.174 1.00 0.00 C ATOM 821 O VAL A 55 3.966 3.390 -3.674 1.00 0.00 O ATOM 822 CB VAL A 55 3.490 6.547 -2.786 1.00 0.00 C ATOM 823 CG1 VAL A 55 2.640 7.106 -3.928 1.00 0.00 C ATOM 824 CG2 VAL A 55 2.626 5.773 -1.788 1.00 0.00 C ATOM 0 H VAL A 55 5.190 7.400 -4.366 1.00 0.00 H new ATOM 0 HA VAL A 55 5.131 5.249 -2.457 1.00 0.00 H new ATOM 0 HB VAL A 55 3.938 7.389 -2.259 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.841 7.724 -3.518 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.266 7.710 -4.585 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.207 6.283 -4.496 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.828 6.418 -1.421 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.192 4.903 -2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 55 3.242 5.446 -0.950 1.00 0.00 H new ATOM 834 N SER A 56 3.892 4.794 -5.446 1.00 0.00 N ATOM 835 CA SER A 56 3.415 3.781 -6.371 1.00 0.00 C ATOM 836 C SER A 56 4.328 2.554 -6.321 1.00 0.00 C ATOM 837 O SER A 56 3.874 1.449 -6.029 1.00 0.00 O ATOM 838 CB SER A 56 3.340 4.329 -7.797 1.00 0.00 C ATOM 839 OG SER A 56 2.372 3.639 -8.584 1.00 0.00 O ATOM 0 H SER A 56 4.025 5.718 -5.857 1.00 0.00 H new ATOM 0 HA SER A 56 2.409 3.489 -6.069 1.00 0.00 H new ATOM 0 HB2 SER A 56 3.092 5.390 -7.765 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.319 4.245 -8.270 1.00 0.00 H new ATOM 0 HG SER A 56 2.713 3.524 -9.495 1.00 0.00 H new ATOM 845 N LEU A 57 5.600 2.791 -6.609 1.00 0.00 N ATOM 846 CA LEU A 57 6.581 1.719 -6.600 1.00 0.00 C ATOM 847 C LEU A 57 6.813 1.258 -5.160 1.00 0.00 C ATOM 848 O LEU A 57 6.514 0.115 -4.815 1.00 0.00 O ATOM 849 CB LEU A 57 7.859 2.157 -7.319 1.00 0.00 C ATOM 850 CG LEU A 57 8.658 1.046 -8.002 1.00 0.00 C ATOM 851 CD1 LEU A 57 8.961 1.405 -9.458 1.00 0.00 C ATOM 852 CD2 LEU A 57 9.930 0.722 -7.215 1.00 0.00 C ATOM 0 H LEU A 57 5.973 3.709 -6.850 1.00 0.00 H new ATOM 0 HA LEU A 57 6.209 0.858 -7.155 1.00 0.00 H new ATOM 0 HB2 LEU A 57 7.593 2.901 -8.070 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.507 2.652 -6.596 1.00 0.00 H new ATOM 0 HG LEU A 57 8.047 0.143 -8.013 1.00 0.00 H new ATOM 0 HD11 LEU A 57 9.530 0.599 -9.921 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.026 1.547 -10.000 1.00 0.00 H new ATOM 0 HD13 LEU A 57 9.543 2.326 -9.492 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.480 -0.071 -7.722 1.00 0.00 H new ATOM 0 HD22 LEU A 57 10.555 1.613 -7.151 1.00 0.00 H new ATOM 0 HD23 LEU A 57 9.663 0.393 -6.211 1.00 0.00 H new ATOM 864 N PHE A 58 7.343 2.169 -4.358 1.00 0.00 N ATOM 865 CA PHE A 58 7.618 1.870 -2.963 1.00 0.00 C ATOM 866 C PHE A 58 6.530 0.972 -2.370 1.00 0.00 C ATOM 867 O PHE A 58 6.820 0.086 -1.568 1.00 0.00 O ATOM 868 CB PHE A 58 7.627 3.203 -2.213 1.00 0.00 C ATOM 869 CG PHE A 58 7.882 3.070 -0.710 1.00 0.00 C ATOM 870 CD1 PHE A 58 6.887 2.645 0.114 1.00 0.00 C ATOM 871 CD2 PHE A 58 9.105 3.376 -0.198 1.00 0.00 C ATOM 872 CE1 PHE A 58 7.124 2.521 1.508 1.00 0.00 C ATOM 873 CE2 PHE A 58 9.342 3.253 1.197 1.00 0.00 C ATOM 874 CZ PHE A 58 8.346 2.828 2.020 1.00 0.00 C ATOM 0 H PHE A 58 7.590 3.115 -4.648 1.00 0.00 H new ATOM 0 HA PHE A 58 8.571 1.348 -2.875 1.00 0.00 H new ATOM 0 HB2 PHE A 58 8.393 3.846 -2.646 1.00 0.00 H new ATOM 0 HB3 PHE A 58 6.669 3.701 -2.366 1.00 0.00 H new ATOM 0 HD1 PHE A 58 5.916 2.402 -0.292 1.00 0.00 H new ATOM 0 HD2 PHE A 58 9.896 3.712 -0.852 1.00 0.00 H new ATOM 0 HE1 PHE A 58 6.334 2.183 2.162 1.00 0.00 H new ATOM 0 HE2 PHE A 58 10.312 3.497 1.604 1.00 0.00 H new ATOM 0 HZ PHE A 58 8.526 2.734 3.081 1.00 0.00 H new ATOM 884 N THR A 59 5.300 1.233 -2.788 1.00 0.00 N ATOM 885 CA THR A 59 4.167 0.460 -2.308 1.00 0.00 C ATOM 886 C THR A 59 4.162 -0.931 -2.945 1.00 0.00 C ATOM 887 O THR A 59 4.250 -1.939 -2.245 1.00 0.00 O ATOM 888 CB THR A 59 2.894 1.261 -2.589 1.00 0.00 C ATOM 889 OG1 THR A 59 2.998 2.391 -1.727 1.00 0.00 O ATOM 890 CG2 THR A 59 1.632 0.541 -2.111 1.00 0.00 C ATOM 0 H THR A 59 5.063 1.969 -3.454 1.00 0.00 H new ATOM 0 HA THR A 59 4.231 0.291 -1.233 1.00 0.00 H new ATOM 0 HB THR A 59 2.816 1.457 -3.659 1.00 0.00 H new ATOM 0 HG1 THR A 59 3.481 3.110 -2.186 1.00 0.00 H new ATOM 0 HG21 THR A 59 0.758 1.152 -2.334 1.00 0.00 H new ATOM 0 HG22 THR A 59 1.545 -0.418 -2.622 1.00 0.00 H new ATOM 0 HG23 THR A 59 1.693 0.375 -1.035 1.00 0.00 H new ATOM 898 N ALA A 60 4.060 -0.942 -4.266 1.00 0.00 N ATOM 899 CA ALA A 60 4.043 -2.192 -5.005 1.00 0.00 C ATOM 900 C ALA A 60 5.077 -3.148 -4.407 1.00 0.00 C ATOM 901 O ALA A 60 4.792 -4.326 -4.198 1.00 0.00 O ATOM 902 CB ALA A 60 4.297 -1.912 -6.488 1.00 0.00 C ATOM 0 H ALA A 60 3.988 -0.104 -4.844 1.00 0.00 H new ATOM 0 HA ALA A 60 3.067 -2.671 -4.926 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.284 -2.850 -7.043 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.519 -1.253 -6.872 1.00 0.00 H new ATOM 0 HB3 ALA A 60 5.269 -1.434 -6.607 1.00 0.00 H new ATOM 908 N PHE A 61 6.258 -2.604 -4.148 1.00 0.00 N ATOM 909 CA PHE A 61 7.336 -3.394 -3.578 1.00 0.00 C ATOM 910 C PHE A 61 7.021 -3.791 -2.134 1.00 0.00 C ATOM 911 O PHE A 61 7.217 -4.942 -1.746 1.00 0.00 O ATOM 912 CB PHE A 61 8.589 -2.516 -3.591 1.00 0.00 C ATOM 913 CG PHE A 61 9.862 -3.254 -4.008 1.00 0.00 C ATOM 914 CD1 PHE A 61 10.437 -4.149 -3.161 1.00 0.00 C ATOM 915 CD2 PHE A 61 10.419 -3.015 -5.225 1.00 0.00 C ATOM 916 CE1 PHE A 61 11.619 -4.834 -3.548 1.00 0.00 C ATOM 917 CE2 PHE A 61 11.601 -3.700 -5.612 1.00 0.00 C ATOM 918 CZ PHE A 61 12.176 -4.595 -4.765 1.00 0.00 C ATOM 0 H PHE A 61 6.491 -1.626 -4.322 1.00 0.00 H new ATOM 0 HA PHE A 61 7.473 -4.308 -4.156 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.427 -1.680 -4.271 1.00 0.00 H new ATOM 0 HB3 PHE A 61 8.735 -2.094 -2.596 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.995 -4.339 -2.194 1.00 0.00 H new ATOM 0 HD2 PHE A 61 9.962 -2.304 -5.898 1.00 0.00 H new ATOM 0 HE1 PHE A 61 12.076 -5.545 -2.875 1.00 0.00 H new ATOM 0 HE2 PHE A 61 12.043 -3.510 -6.579 1.00 0.00 H new ATOM 0 HZ PHE A 61 13.075 -5.116 -5.059 1.00 0.00 H new ATOM 928 N PHE A 62 6.537 -2.816 -1.378 1.00 0.00 N ATOM 929 CA PHE A 62 6.193 -3.050 0.014 1.00 0.00 C ATOM 930 C PHE A 62 5.113 -4.126 0.138 1.00 0.00 C ATOM 931 O PHE A 62 5.362 -5.200 0.684 1.00 0.00 O ATOM 932 CB PHE A 62 5.648 -1.731 0.567 1.00 0.00 C ATOM 933 CG PHE A 62 5.360 -1.758 2.069 1.00 0.00 C ATOM 934 CD1 PHE A 62 6.389 -1.787 2.959 1.00 0.00 C ATOM 935 CD2 PHE A 62 4.075 -1.754 2.515 1.00 0.00 C ATOM 936 CE1 PHE A 62 6.121 -1.812 4.353 1.00 0.00 C ATOM 937 CE2 PHE A 62 3.808 -1.780 3.910 1.00 0.00 C ATOM 938 CZ PHE A 62 4.836 -1.808 4.799 1.00 0.00 C ATOM 0 H PHE A 62 6.375 -1.863 -1.703 1.00 0.00 H new ATOM 0 HA PHE A 62 7.071 -3.390 0.563 1.00 0.00 H new ATOM 0 HB2 PHE A 62 6.366 -0.938 0.359 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.730 -1.478 0.036 1.00 0.00 H new ATOM 0 HD1 PHE A 62 7.409 -1.791 2.605 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.258 -1.731 1.809 1.00 0.00 H new ATOM 0 HE1 PHE A 62 6.938 -1.834 5.059 1.00 0.00 H new ATOM 0 HE2 PHE A 62 2.788 -1.778 4.264 1.00 0.00 H new ATOM 0 HZ PHE A 62 4.632 -1.827 5.859 1.00 0.00 H new ATOM 948 N LEU A 63 3.936 -3.801 -0.376 1.00 0.00 N ATOM 949 CA LEU A 63 2.817 -4.727 -0.330 1.00 0.00 C ATOM 950 C LEU A 63 3.267 -6.091 -0.856 1.00 0.00 C ATOM 951 O LEU A 63 2.972 -7.122 -0.253 1.00 0.00 O ATOM 952 CB LEU A 63 1.612 -4.148 -1.073 1.00 0.00 C ATOM 953 CG LEU A 63 0.379 -3.844 -0.218 1.00 0.00 C ATOM 954 CD1 LEU A 63 0.253 -2.343 0.047 1.00 0.00 C ATOM 955 CD2 LEU A 63 -0.886 -4.423 -0.854 1.00 0.00 C ATOM 0 H LEU A 63 3.733 -2.909 -0.827 1.00 0.00 H new ATOM 0 HA LEU A 63 2.487 -4.875 0.698 1.00 0.00 H new ATOM 0 HB2 LEU A 63 1.923 -3.227 -1.567 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.323 -4.848 -1.857 1.00 0.00 H new ATOM 0 HG LEU A 63 0.504 -4.332 0.749 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.631 -2.154 0.656 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.140 -1.991 0.575 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.160 -1.813 -0.901 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -1.747 -4.193 -0.226 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.030 -3.985 -1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.784 -5.504 -0.948 1.00 0.00 H new ATOM 967 N ALA A 64 3.975 -6.053 -1.976 1.00 0.00 N ATOM 968 CA ALA A 64 4.469 -7.274 -2.590 1.00 0.00 C ATOM 969 C ALA A 64 5.152 -8.136 -1.526 1.00 0.00 C ATOM 970 O ALA A 64 4.823 -9.310 -1.369 1.00 0.00 O ATOM 971 CB ALA A 64 5.408 -6.921 -3.745 1.00 0.00 C ATOM 0 H ALA A 64 4.218 -5.196 -2.474 1.00 0.00 H new ATOM 0 HA ALA A 64 3.645 -7.855 -3.005 1.00 0.00 H new ATOM 0 HB1 ALA A 64 5.779 -7.837 -4.206 1.00 0.00 H new ATOM 0 HB2 ALA A 64 4.867 -6.335 -4.488 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.249 -6.340 -3.366 1.00 0.00 H new ATOM 977 N THR A 65 6.090 -7.518 -0.824 1.00 0.00 N ATOM 978 CA THR A 65 6.823 -8.214 0.221 1.00 0.00 C ATOM 979 C THR A 65 5.856 -8.789 1.257 1.00 0.00 C ATOM 980 O THR A 65 5.891 -9.984 1.549 1.00 0.00 O ATOM 981 CB THR A 65 7.840 -7.238 0.815 1.00 0.00 C ATOM 982 OG1 THR A 65 8.926 -7.264 -0.109 1.00 0.00 O ATOM 983 CG2 THR A 65 8.450 -7.752 2.121 1.00 0.00 C ATOM 0 H THR A 65 6.360 -6.543 -0.958 1.00 0.00 H new ATOM 0 HA THR A 65 7.367 -9.069 -0.180 1.00 0.00 H new ATOM 0 HB THR A 65 7.360 -6.276 0.992 1.00 0.00 H new ATOM 0 HG1 THR A 65 9.631 -6.657 0.198 1.00 0.00 H new ATOM 0 HG21 THR A 65 9.165 -7.022 2.501 1.00 0.00 H new ATOM 0 HG22 THR A 65 7.660 -7.903 2.857 1.00 0.00 H new ATOM 0 HG23 THR A 65 8.960 -8.698 1.937 1.00 0.00 H new ATOM 991 N ILE A 66 5.014 -7.912 1.785 1.00 0.00 N ATOM 992 CA ILE A 66 4.039 -8.318 2.783 1.00 0.00 C ATOM 993 C ILE A 66 3.308 -9.570 2.295 1.00 0.00 C ATOM 994 O ILE A 66 3.405 -10.630 2.912 1.00 0.00 O ATOM 995 CB ILE A 66 3.106 -7.155 3.124 1.00 0.00 C ATOM 996 CG1 ILE A 66 3.888 -5.977 3.710 1.00 0.00 C ATOM 997 CG2 ILE A 66 1.977 -7.611 4.051 1.00 0.00 C ATOM 998 CD1 ILE A 66 4.183 -6.199 5.194 1.00 0.00 C ATOM 0 H ILE A 66 4.987 -6.922 1.540 1.00 0.00 H new ATOM 0 HA ILE A 66 4.536 -8.582 3.716 1.00 0.00 H new ATOM 0 HB ILE A 66 2.644 -6.807 2.200 1.00 0.00 H new ATOM 0 HG12 ILE A 66 4.823 -5.849 3.165 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.317 -5.057 3.583 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.328 -6.765 4.278 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.396 -8.392 3.560 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.401 -8.001 4.976 1.00 0.00 H new ATOM 0 HD11 ILE A 66 4.739 -5.348 5.586 1.00 0.00 H new ATOM 0 HD12 ILE A 66 3.245 -6.302 5.740 1.00 0.00 H new ATOM 0 HD13 ILE A 66 4.775 -7.106 5.316 1.00 0.00 H new ATOM 1010 N MET A 67 2.591 -9.407 1.193 1.00 0.00 N ATOM 1011 CA MET A 67 1.843 -10.511 0.616 1.00 0.00 C ATOM 1012 C MET A 67 2.666 -11.801 0.637 1.00 0.00 C ATOM 1013 O MET A 67 2.329 -12.744 1.351 1.00 0.00 O ATOM 1014 CB MET A 67 1.463 -10.172 -0.827 1.00 0.00 C ATOM 1015 CG MET A 67 0.342 -9.131 -0.868 1.00 0.00 C ATOM 1016 SD MET A 67 -1.173 -9.889 -1.433 1.00 0.00 S ATOM 1017 CE MET A 67 -1.980 -10.172 0.134 1.00 0.00 C ATOM 0 H MET A 67 2.512 -8.527 0.684 1.00 0.00 H new ATOM 0 HA MET A 67 0.943 -10.666 1.211 1.00 0.00 H new ATOM 0 HB2 MET A 67 2.336 -9.792 -1.357 1.00 0.00 H new ATOM 0 HB3 MET A 67 1.144 -11.076 -1.345 1.00 0.00 H new ATOM 0 HG2 MET A 67 0.196 -8.702 0.123 1.00 0.00 H new ATOM 0 HG3 MET A 67 0.619 -8.312 -1.532 1.00 0.00 H new ATOM 0 HE1 MET A 67 -2.948 -10.644 -0.035 1.00 0.00 H new ATOM 0 HE2 MET A 67 -1.361 -10.825 0.750 1.00 0.00 H new ATOM 0 HE3 MET A 67 -2.125 -9.221 0.646 1.00 0.00 H new ATOM 1027 N GLY A 68 3.729 -11.800 -0.154 1.00 0.00 N ATOM 1028 CA GLY A 68 4.602 -12.958 -0.235 1.00 0.00 C ATOM 1029 C GLY A 68 3.799 -14.234 -0.495 1.00 0.00 C ATOM 1030 O GLY A 68 4.095 -15.285 0.072 1.00 0.00 O ATOM 0 H GLY A 68 4.005 -11.015 -0.744 1.00 0.00 H new ATOM 0 HA2 GLY A 68 5.330 -12.814 -1.033 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.163 -13.060 0.694 1.00 0.00 H new ATOM 1034 N VAL A 69 2.797 -14.100 -1.352 1.00 0.00 N ATOM 1035 CA VAL A 69 1.949 -15.229 -1.694 1.00 0.00 C ATOM 1036 C VAL A 69 2.810 -16.486 -1.829 1.00 0.00 C ATOM 1037 O VAL A 69 2.620 -17.455 -1.095 1.00 0.00 O ATOM 1038 CB VAL A 69 1.146 -14.916 -2.958 1.00 0.00 C ATOM 1039 CG1 VAL A 69 0.408 -16.158 -3.460 1.00 0.00 C ATOM 1040 CG2 VAL A 69 0.172 -13.760 -2.716 1.00 0.00 C ATOM 0 H VAL A 69 2.554 -13.227 -1.819 1.00 0.00 H new ATOM 0 HA VAL A 69 1.224 -15.416 -0.902 1.00 0.00 H new ATOM 0 HB VAL A 69 1.847 -14.607 -3.733 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -0.155 -15.908 -4.359 1.00 0.00 H new ATOM 0 HG12 VAL A 69 1.130 -16.942 -3.690 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -0.277 -16.510 -2.689 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -0.387 -13.557 -3.630 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -0.521 -14.029 -1.919 1.00 0.00 H new ATOM 0 HG23 VAL A 69 0.729 -12.869 -2.426 1.00 0.00 H new ATOM 1050 N ARG A 70 3.738 -16.430 -2.773 1.00 0.00 N ATOM 1051 CA ARG A 70 4.629 -17.552 -3.014 1.00 0.00 C ATOM 1052 C ARG A 70 6.037 -17.052 -3.342 1.00 0.00 C ATOM 1053 O ARG A 70 6.376 -16.862 -4.509 1.00 0.00 O ATOM 1054 CB ARG A 70 4.122 -18.421 -4.167 1.00 0.00 C ATOM 1055 CG ARG A 70 4.237 -19.908 -3.826 1.00 0.00 C ATOM 1056 CD ARG A 70 3.211 -20.307 -2.763 1.00 0.00 C ATOM 1057 NE ARG A 70 3.699 -21.480 -2.004 1.00 0.00 N ATOM 1058 CZ ARG A 70 2.910 -22.292 -1.288 1.00 0.00 C ATOM 1059 NH1 ARG A 70 1.591 -22.065 -1.229 1.00 0.00 N ATOM 1060 NH2 ARG A 70 3.440 -23.333 -0.630 1.00 0.00 N ATOM 0 H ARG A 70 3.892 -15.625 -3.380 1.00 0.00 H new ATOM 0 HA ARG A 70 4.656 -18.154 -2.106 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.083 -18.173 -4.384 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.696 -18.206 -5.069 1.00 0.00 H new ATOM 0 HG2 ARG A 70 4.085 -20.504 -4.726 1.00 0.00 H new ATOM 0 HG3 ARG A 70 5.243 -20.126 -3.466 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.035 -19.472 -2.085 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.257 -20.541 -3.236 1.00 0.00 H new ATOM 0 HE ARG A 70 4.698 -21.683 -2.028 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.187 -21.273 -1.729 1.00 0.00 H new ATOM 0 HH12 ARG A 70 0.991 -22.684 -0.684 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.444 -23.507 -0.675 1.00 0.00 H new ATOM 0 HH22 ARG A 70 2.839 -23.951 -0.085 1.00 0.00 H new ATOM 1074 N PHE A 71 6.820 -16.852 -2.291 1.00 0.00 N ATOM 1075 CA PHE A 71 8.183 -16.376 -2.454 1.00 0.00 C ATOM 1076 C PHE A 71 9.155 -17.546 -2.623 1.00 0.00 C ATOM 1077 O PHE A 71 9.635 -18.106 -1.638 1.00 0.00 O ATOM 1078 CB PHE A 71 8.544 -15.609 -1.180 1.00 0.00 C ATOM 1079 CG PHE A 71 9.108 -14.210 -1.435 1.00 0.00 C ATOM 1080 CD1 PHE A 71 8.285 -13.210 -1.849 1.00 0.00 C ATOM 1081 CD2 PHE A 71 10.433 -13.967 -1.248 1.00 0.00 C ATOM 1082 CE1 PHE A 71 8.810 -11.911 -2.086 1.00 0.00 C ATOM 1083 CE2 PHE A 71 10.957 -12.669 -1.485 1.00 0.00 C ATOM 1084 CZ PHE A 71 10.134 -11.668 -1.899 1.00 0.00 C ATOM 0 H PHE A 71 6.536 -17.011 -1.324 1.00 0.00 H new ATOM 0 HA PHE A 71 8.254 -15.747 -3.342 1.00 0.00 H new ATOM 0 HB2 PHE A 71 7.655 -15.523 -0.556 1.00 0.00 H new ATOM 0 HB3 PHE A 71 9.275 -16.187 -0.615 1.00 0.00 H new ATOM 0 HD1 PHE A 71 7.233 -13.403 -1.998 1.00 0.00 H new ATOM 0 HD2 PHE A 71 11.087 -14.761 -0.919 1.00 0.00 H new ATOM 0 HE1 PHE A 71 8.157 -11.116 -2.415 1.00 0.00 H new ATOM 0 HE2 PHE A 71 12.009 -12.476 -1.337 1.00 0.00 H new ATOM 0 HZ PHE A 71 10.533 -10.681 -2.079 1.00 0.00 H new ATOM 1094 N LYS A 72 9.417 -17.880 -3.878 1.00 0.00 N ATOM 1095 CA LYS A 72 10.323 -18.972 -4.188 1.00 0.00 C ATOM 1096 C LYS A 72 11.544 -18.422 -4.927 1.00 0.00 C ATOM 1097 O LYS A 72 12.663 -18.494 -4.423 1.00 0.00 O ATOM 1098 CB LYS A 72 9.588 -20.077 -4.951 1.00 0.00 C ATOM 1099 CG LYS A 72 9.862 -21.448 -4.330 1.00 0.00 C ATOM 1100 CD LYS A 72 8.768 -21.826 -3.331 1.00 0.00 C ATOM 1101 CE LYS A 72 7.818 -22.868 -3.925 1.00 0.00 C ATOM 1102 NZ LYS A 72 7.884 -24.129 -3.154 1.00 0.00 N ATOM 0 H LYS A 72 9.017 -17.413 -4.692 1.00 0.00 H new ATOM 0 HA LYS A 72 10.688 -19.437 -3.272 1.00 0.00 H new ATOM 0 HB2 LYS A 72 8.516 -19.878 -4.943 1.00 0.00 H new ATOM 0 HB3 LYS A 72 9.905 -20.076 -5.994 1.00 0.00 H new ATOM 0 HG2 LYS A 72 9.919 -22.202 -5.115 1.00 0.00 H new ATOM 0 HG3 LYS A 72 10.830 -21.437 -3.828 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.222 -22.219 -2.421 1.00 0.00 H new ATOM 0 HD3 LYS A 72 8.206 -20.936 -3.048 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.798 -22.484 -3.919 1.00 0.00 H new ATOM 0 HE3 LYS A 72 8.081 -23.057 -4.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 7.233 -24.825 -3.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 8.854 -24.502 -3.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 7.611 -23.947 -2.167 1.00 0.00 H new ATOM 1116 N ARG A 73 11.287 -17.885 -6.111 1.00 0.00 N ATOM 1117 CA ARG A 73 12.352 -17.322 -6.924 1.00 0.00 C ATOM 1118 C ARG A 73 11.774 -16.363 -7.966 1.00 0.00 C ATOM 1119 O ARG A 73 11.496 -16.761 -9.096 1.00 0.00 O ATOM 1120 CB ARG A 73 13.141 -18.423 -7.637 1.00 0.00 C ATOM 1121 CG ARG A 73 14.601 -18.012 -7.834 1.00 0.00 C ATOM 1122 CD ARG A 73 15.207 -18.707 -9.054 1.00 0.00 C ATOM 1123 NE ARG A 73 15.695 -20.053 -8.679 1.00 0.00 N ATOM 1124 CZ ARG A 73 16.831 -20.280 -8.007 1.00 0.00 C ATOM 1125 NH1 ARG A 73 17.604 -19.252 -7.631 1.00 0.00 N ATOM 1126 NH2 ARG A 73 17.195 -21.535 -7.710 1.00 0.00 N ATOM 0 H ARG A 73 10.357 -17.828 -6.527 1.00 0.00 H new ATOM 0 HA ARG A 73 13.025 -16.780 -6.260 1.00 0.00 H new ATOM 0 HB2 ARG A 73 13.094 -19.344 -7.055 1.00 0.00 H new ATOM 0 HB3 ARG A 73 12.685 -18.634 -8.604 1.00 0.00 H new ATOM 0 HG2 ARG A 73 14.664 -16.931 -7.958 1.00 0.00 H new ATOM 0 HG3 ARG A 73 15.177 -18.265 -6.944 1.00 0.00 H new ATOM 0 HD2 ARG A 73 14.461 -18.789 -9.844 1.00 0.00 H new ATOM 0 HD3 ARG A 73 16.028 -18.111 -9.452 1.00 0.00 H new ATOM 0 HE ARG A 73 15.131 -20.858 -8.949 1.00 0.00 H new ATOM 0 HH11 ARG A 73 17.327 -18.297 -7.857 1.00 0.00 H new ATOM 0 HH12 ARG A 73 18.469 -19.425 -7.119 1.00 0.00 H new ATOM 0 HH21 ARG A 73 16.607 -22.318 -7.996 1.00 0.00 H new ATOM 0 HH22 ARG A 73 18.060 -21.707 -7.198 1.00 0.00 H new ATOM 1140 N SER A 74 11.609 -15.116 -7.548 1.00 0.00 N ATOM 1141 CA SER A 74 11.069 -14.096 -8.431 1.00 0.00 C ATOM 1142 C SER A 74 11.184 -12.720 -7.773 1.00 0.00 C ATOM 1143 O SER A 74 11.171 -12.610 -6.548 1.00 0.00 O ATOM 1144 CB SER A 74 9.611 -14.393 -8.789 1.00 0.00 C ATOM 1145 OG SER A 74 8.816 -14.632 -7.631 1.00 0.00 O ATOM 0 H SER A 74 11.840 -14.789 -6.610 1.00 0.00 H new ATOM 0 HA SER A 74 11.650 -14.100 -9.354 1.00 0.00 H new ATOM 0 HB2 SER A 74 9.196 -13.553 -9.347 1.00 0.00 H new ATOM 0 HB3 SER A 74 9.568 -15.263 -9.444 1.00 0.00 H new ATOM 0 HG SER A 74 7.892 -14.816 -7.901 1.00 0.00 H new ATOM 1151 N LYS A 75 11.294 -11.703 -8.616 1.00 0.00 N ATOM 1152 CA LYS A 75 11.412 -10.339 -8.132 1.00 0.00 C ATOM 1153 C LYS A 75 10.047 -9.653 -8.215 1.00 0.00 C ATOM 1154 O LYS A 75 9.329 -9.568 -7.220 1.00 0.00 O ATOM 1155 CB LYS A 75 12.519 -9.597 -8.882 1.00 0.00 C ATOM 1156 CG LYS A 75 13.764 -9.438 -8.007 1.00 0.00 C ATOM 1157 CD LYS A 75 15.041 -9.602 -8.834 1.00 0.00 C ATOM 1158 CE LYS A 75 16.167 -10.203 -7.991 1.00 0.00 C ATOM 1159 NZ LYS A 75 17.263 -10.688 -8.860 1.00 0.00 N ATOM 0 H LYS A 75 11.304 -11.797 -9.632 1.00 0.00 H new ATOM 0 HA LYS A 75 11.710 -10.332 -7.084 1.00 0.00 H new ATOM 0 HB2 LYS A 75 12.776 -10.142 -9.790 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.159 -8.615 -9.190 1.00 0.00 H new ATOM 0 HG2 LYS A 75 13.757 -8.456 -7.533 1.00 0.00 H new ATOM 0 HG3 LYS A 75 13.747 -10.178 -7.207 1.00 0.00 H new ATOM 0 HD2 LYS A 75 14.843 -10.244 -9.693 1.00 0.00 H new ATOM 0 HD3 LYS A 75 15.352 -8.633 -9.225 1.00 0.00 H new ATOM 0 HE2 LYS A 75 16.549 -9.454 -7.297 1.00 0.00 H new ATOM 0 HE3 LYS A 75 15.780 -11.026 -7.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 18.019 -11.093 -8.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 16.898 -11.418 -9.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 17.643 -9.895 -9.415 1.00 0.00 H new ATOM 1173 N LYS A 76 9.729 -9.182 -9.412 1.00 0.00 N ATOM 1174 CA LYS A 76 8.462 -8.507 -9.639 1.00 0.00 C ATOM 1175 C LYS A 76 7.667 -9.267 -10.702 1.00 0.00 C ATOM 1176 O LYS A 76 7.184 -8.672 -11.664 1.00 0.00 O ATOM 1177 CB LYS A 76 8.694 -7.034 -9.981 1.00 0.00 C ATOM 1178 CG LYS A 76 8.792 -6.185 -8.711 1.00 0.00 C ATOM 1179 CD LYS A 76 9.734 -4.997 -8.917 1.00 0.00 C ATOM 1180 CE LYS A 76 9.277 -3.787 -8.099 1.00 0.00 C ATOM 1181 NZ LYS A 76 8.608 -2.796 -8.971 1.00 0.00 N ATOM 0 H LYS A 76 10.327 -9.254 -10.235 1.00 0.00 H new ATOM 0 HA LYS A 76 7.861 -8.509 -8.730 1.00 0.00 H new ATOM 0 HB2 LYS A 76 9.610 -6.932 -10.563 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.878 -6.669 -10.605 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.802 -5.824 -8.433 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.151 -6.799 -7.885 1.00 0.00 H new ATOM 0 HD2 LYS A 76 10.746 -5.276 -8.625 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.768 -4.734 -9.974 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.594 -4.109 -7.313 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.135 -3.328 -7.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.114 -2.094 -8.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.318 -2.316 -9.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.921 -3.280 -9.583 1.00 0.00 H new ATOM 1195 N ILE A 77 7.556 -10.571 -10.493 1.00 0.00 N ATOM 1196 CA ILE A 77 6.828 -11.418 -11.422 1.00 0.00 C ATOM 1197 C ILE A 77 5.497 -11.833 -10.791 1.00 0.00 C ATOM 1198 O ILE A 77 4.438 -11.642 -11.387 1.00 0.00 O ATOM 1199 CB ILE A 77 7.694 -12.600 -11.861 1.00 0.00 C ATOM 1200 CG1 ILE A 77 8.808 -12.142 -12.805 1.00 0.00 C ATOM 1201 CG2 ILE A 77 6.839 -13.708 -12.479 1.00 0.00 C ATOM 1202 CD1 ILE A 77 10.086 -11.819 -12.029 1.00 0.00 C ATOM 0 H ILE A 77 7.958 -11.061 -9.694 1.00 0.00 H new ATOM 0 HA ILE A 77 6.593 -10.869 -12.334 1.00 0.00 H new ATOM 0 HB ILE A 77 8.173 -13.019 -10.976 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.011 -12.922 -13.539 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.482 -11.261 -13.358 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.480 -14.536 -12.782 1.00 0.00 H new ATOM 0 HG22 ILE A 77 6.114 -14.060 -11.745 1.00 0.00 H new ATOM 0 HG23 ILE A 77 6.313 -13.318 -13.351 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.862 -11.496 -12.723 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.885 -11.022 -11.313 1.00 0.00 H new ATOM 0 HD13 ILE A 77 10.423 -12.708 -11.497 1.00 0.00 H new ATOM 1214 N MET A 78 5.595 -12.392 -9.594 1.00 0.00 N ATOM 1215 CA MET A 78 4.412 -12.835 -8.876 1.00 0.00 C ATOM 1216 C MET A 78 3.371 -11.717 -8.791 1.00 0.00 C ATOM 1217 O MET A 78 2.211 -11.914 -9.150 1.00 0.00 O ATOM 1218 CB MET A 78 4.806 -13.274 -7.464 1.00 0.00 C ATOM 1219 CG MET A 78 4.535 -14.766 -7.259 1.00 0.00 C ATOM 1220 SD MET A 78 3.523 -15.009 -5.809 1.00 0.00 S ATOM 1221 CE MET A 78 1.918 -14.604 -6.479 1.00 0.00 C ATOM 0 H MET A 78 6.475 -12.548 -9.103 1.00 0.00 H new ATOM 0 HA MET A 78 3.974 -13.673 -9.418 1.00 0.00 H new ATOM 0 HB2 MET A 78 5.863 -13.066 -7.296 1.00 0.00 H new ATOM 0 HB3 MET A 78 4.246 -12.695 -6.730 1.00 0.00 H new ATOM 0 HG2 MET A 78 4.034 -15.177 -8.135 1.00 0.00 H new ATOM 0 HG3 MET A 78 5.477 -15.303 -7.149 1.00 0.00 H new ATOM 0 HE1 MET A 78 1.467 -13.808 -5.886 1.00 0.00 H new ATOM 0 HE2 MET A 78 2.028 -14.270 -7.511 1.00 0.00 H new ATOM 0 HE3 MET A 78 1.278 -15.486 -6.449 1.00 0.00 H new ATOM 1231 N PRO A 79 3.835 -10.536 -8.302 1.00 0.00 N ATOM 1232 CA PRO A 79 2.958 -9.386 -8.165 1.00 0.00 C ATOM 1233 C PRO A 79 2.672 -8.749 -9.527 1.00 0.00 C ATOM 1234 O PRO A 79 3.016 -7.591 -9.758 1.00 0.00 O ATOM 1235 CB PRO A 79 3.682 -8.449 -7.211 1.00 0.00 C ATOM 1236 CG PRO A 79 5.136 -8.894 -7.215 1.00 0.00 C ATOM 1237 CD PRO A 79 5.202 -10.265 -7.867 1.00 0.00 C ATOM 0 HA PRO A 79 1.976 -9.651 -7.773 1.00 0.00 H new ATOM 0 HB2 PRO A 79 3.590 -7.413 -7.536 1.00 0.00 H new ATOM 0 HB3 PRO A 79 3.258 -8.508 -6.209 1.00 0.00 H new ATOM 0 HG2 PRO A 79 5.752 -8.181 -7.763 1.00 0.00 H new ATOM 0 HG3 PRO A 79 5.525 -8.936 -6.198 1.00 0.00 H new ATOM 0 HD2 PRO A 79 5.894 -10.270 -8.709 1.00 0.00 H new ATOM 0 HD3 PRO A 79 5.551 -11.021 -7.164 1.00 0.00 H new ATOM 1245 N ALA A 80 2.047 -9.534 -10.392 1.00 0.00 N ATOM 1246 CA ALA A 80 1.712 -9.061 -11.724 1.00 0.00 C ATOM 1247 C ALA A 80 0.761 -7.867 -11.613 1.00 0.00 C ATOM 1248 O ALA A 80 1.002 -6.820 -12.211 1.00 0.00 O ATOM 1249 CB ALA A 80 1.113 -10.210 -12.538 1.00 0.00 C ATOM 0 H ALA A 80 1.764 -10.494 -10.196 1.00 0.00 H new ATOM 0 HA ALA A 80 2.606 -8.722 -12.247 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.862 -9.855 -13.538 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.838 -11.020 -12.612 1.00 0.00 H new ATOM 0 HB3 ALA A 80 0.212 -10.574 -12.045 1.00 0.00 H new ATOM 1255 N GLY A 81 -0.299 -8.066 -10.843 1.00 0.00 N ATOM 1256 CA GLY A 81 -1.287 -7.019 -10.646 1.00 0.00 C ATOM 1257 C GLY A 81 -0.698 -5.851 -9.851 1.00 0.00 C ATOM 1258 O GLY A 81 -0.909 -4.690 -10.197 1.00 0.00 O ATOM 0 H GLY A 81 -0.495 -8.936 -10.348 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -1.642 -6.663 -11.613 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -2.151 -7.424 -10.118 1.00 0.00 H new ATOM 1262 N LEU A 82 0.030 -6.200 -8.800 1.00 0.00 N ATOM 1263 CA LEU A 82 0.651 -5.196 -7.953 1.00 0.00 C ATOM 1264 C LEU A 82 1.362 -4.165 -8.830 1.00 0.00 C ATOM 1265 O LEU A 82 0.942 -3.011 -8.902 1.00 0.00 O ATOM 1266 CB LEU A 82 1.563 -5.858 -6.918 1.00 0.00 C ATOM 1267 CG LEU A 82 1.092 -5.787 -5.464 1.00 0.00 C ATOM 1268 CD1 LEU A 82 1.550 -7.017 -4.678 1.00 0.00 C ATOM 1269 CD2 LEU A 82 1.545 -4.483 -4.804 1.00 0.00 C ATOM 0 H LEU A 82 0.204 -7.164 -8.516 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.105 -4.660 -7.380 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.685 -6.907 -7.189 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.548 -5.396 -6.983 1.00 0.00 H new ATOM 0 HG LEU A 82 0.002 -5.789 -5.458 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.202 -6.941 -3.648 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.136 -7.916 -5.135 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.639 -7.072 -4.690 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.197 -4.458 -3.771 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.633 -4.425 -4.822 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.128 -3.636 -5.348 1.00 0.00 H new ATOM 1281 N VAL A 83 2.428 -4.618 -9.475 1.00 0.00 N ATOM 1282 CA VAL A 83 3.202 -3.748 -10.345 1.00 0.00 C ATOM 1283 C VAL A 83 2.272 -3.111 -11.380 1.00 0.00 C ATOM 1284 O VAL A 83 2.378 -1.919 -11.664 1.00 0.00 O ATOM 1285 CB VAL A 83 4.354 -4.532 -10.977 1.00 0.00 C ATOM 1286 CG1 VAL A 83 5.446 -4.827 -9.947 1.00 0.00 C ATOM 1287 CG2 VAL A 83 3.848 -5.822 -11.625 1.00 0.00 C ATOM 0 H VAL A 83 2.774 -5.576 -9.412 1.00 0.00 H new ATOM 0 HA VAL A 83 3.654 -2.938 -9.773 1.00 0.00 H new ATOM 0 HB VAL A 83 4.791 -3.913 -11.760 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.253 -5.385 -10.422 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.837 -3.889 -9.552 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.027 -5.417 -9.132 1.00 0.00 H new ATOM 0 HG21 VAL A 83 4.686 -6.360 -12.067 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.373 -6.447 -10.869 1.00 0.00 H new ATOM 0 HG23 VAL A 83 3.123 -5.579 -12.402 1.00 0.00 H new ATOM 1297 N ALA A 84 1.383 -3.935 -11.916 1.00 0.00 N ATOM 1298 CA ALA A 84 0.436 -3.467 -12.913 1.00 0.00 C ATOM 1299 C ALA A 84 -0.289 -2.230 -12.381 1.00 0.00 C ATOM 1300 O ALA A 84 -0.648 -1.338 -13.149 1.00 0.00 O ATOM 1301 CB ALA A 84 -0.529 -4.599 -13.272 1.00 0.00 C ATOM 0 H ALA A 84 1.299 -4.923 -11.678 1.00 0.00 H new ATOM 0 HA ALA A 84 0.954 -3.178 -13.827 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.240 -4.248 -14.020 1.00 0.00 H new ATOM 0 HB2 ALA A 84 0.033 -5.443 -13.673 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -1.069 -4.914 -12.379 1.00 0.00 H new ATOM 1307 N GLY A 85 -0.484 -2.215 -11.071 1.00 0.00 N ATOM 1308 CA GLY A 85 -1.160 -1.101 -10.427 1.00 0.00 C ATOM 1309 C GLY A 85 -0.220 0.096 -10.273 1.00 0.00 C ATOM 1310 O GLY A 85 -0.603 1.231 -10.554 1.00 0.00 O ATOM 0 H GLY A 85 -0.186 -2.957 -10.437 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.031 -0.811 -11.015 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.525 -1.410 -9.447 1.00 0.00 H new ATOM 1314 N LEU A 86 0.993 -0.198 -9.827 1.00 0.00 N ATOM 1315 CA LEU A 86 1.990 0.840 -9.633 1.00 0.00 C ATOM 1316 C LEU A 86 2.109 1.673 -10.911 1.00 0.00 C ATOM 1317 O LEU A 86 2.187 2.899 -10.852 1.00 0.00 O ATOM 1318 CB LEU A 86 3.315 0.231 -9.171 1.00 0.00 C ATOM 1319 CG LEU A 86 4.475 0.314 -10.165 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.091 1.715 -10.173 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.518 -0.769 -9.883 1.00 0.00 C ATOM 0 H LEU A 86 1.307 -1.140 -9.595 1.00 0.00 H new ATOM 0 HA LEU A 86 1.683 1.518 -8.837 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.617 0.726 -8.248 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.145 -0.818 -8.929 1.00 0.00 H new ATOM 0 HG LEU A 86 4.082 0.129 -11.165 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.913 1.747 -10.888 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.333 2.444 -10.459 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.466 1.953 -9.178 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.331 -0.687 -10.604 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.912 -0.641 -8.875 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.054 -1.752 -9.969 1.00 0.00 H new ATOM 1333 N SER A 87 2.120 0.974 -12.036 1.00 0.00 N ATOM 1334 CA SER A 87 2.228 1.633 -13.326 1.00 0.00 C ATOM 1335 C SER A 87 0.916 2.344 -13.662 1.00 0.00 C ATOM 1336 O SER A 87 0.904 3.548 -13.912 1.00 0.00 O ATOM 1337 CB SER A 87 2.588 0.634 -14.427 1.00 0.00 C ATOM 1338 OG SER A 87 3.684 1.083 -15.219 1.00 0.00 O ATOM 0 H SER A 87 2.056 -0.043 -12.081 1.00 0.00 H new ATOM 0 HA SER A 87 3.028 2.371 -13.267 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.836 -0.327 -13.977 1.00 0.00 H new ATOM 0 HB3 SER A 87 1.721 0.472 -15.067 1.00 0.00 H new ATOM 0 HG SER A 87 3.884 0.417 -15.909 1.00 0.00 H new ATOM 1344 N LEU A 88 -0.158 1.568 -13.658 1.00 0.00 N ATOM 1345 CA LEU A 88 -1.473 2.108 -13.959 1.00 0.00 C ATOM 1346 C LEU A 88 -1.683 3.400 -13.167 1.00 0.00 C ATOM 1347 O LEU A 88 -2.383 4.304 -13.621 1.00 0.00 O ATOM 1348 CB LEU A 88 -2.555 1.054 -13.714 1.00 0.00 C ATOM 1349 CG LEU A 88 -3.136 0.387 -14.962 1.00 0.00 C ATOM 1350 CD1 LEU A 88 -3.588 -1.043 -14.659 1.00 0.00 C ATOM 1351 CD2 LEU A 88 -4.265 1.230 -15.559 1.00 0.00 C ATOM 0 H LEU A 88 -0.144 0.569 -13.451 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.545 2.366 -15.016 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.139 0.278 -13.072 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.371 1.521 -13.163 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.349 0.324 -15.713 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.997 -1.495 -15.563 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.736 -1.629 -14.315 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.354 -1.026 -13.883 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -4.660 0.733 -16.445 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.060 1.347 -14.823 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.879 2.211 -15.835 1.00 0.00 H new ATOM 1363 N MET A 89 -1.063 3.446 -11.997 1.00 0.00 N ATOM 1364 CA MET A 89 -1.173 4.613 -11.137 1.00 0.00 C ATOM 1365 C MET A 89 -0.306 5.761 -11.657 1.00 0.00 C ATOM 1366 O MET A 89 -0.823 6.802 -12.058 1.00 0.00 O ATOM 1367 CB MET A 89 -0.735 4.244 -9.718 1.00 0.00 C ATOM 1368 CG MET A 89 -1.312 5.224 -8.695 1.00 0.00 C ATOM 1369 SD MET A 89 0.005 5.941 -7.727 1.00 0.00 S ATOM 1370 CE MET A 89 0.701 7.061 -8.931 1.00 0.00 C ATOM 0 H MET A 89 -0.483 2.694 -11.624 1.00 0.00 H new ATOM 0 HA MET A 89 -2.212 4.941 -11.132 1.00 0.00 H new ATOM 0 HB2 MET A 89 -1.064 3.232 -9.483 1.00 0.00 H new ATOM 0 HB3 MET A 89 0.353 4.247 -9.657 1.00 0.00 H new ATOM 0 HG2 MET A 89 -1.869 6.010 -9.206 1.00 0.00 H new ATOM 0 HG3 MET A 89 -2.016 4.708 -8.042 1.00 0.00 H new ATOM 0 HE1 MET A 89 0.969 7.999 -8.444 1.00 0.00 H new ATOM 0 HE2 MET A 89 1.592 6.614 -9.372 1.00 0.00 H new ATOM 0 HE3 MET A 89 -0.032 7.255 -9.714 1.00 0.00 H new ATOM 1380 N MET A 90 0.999 5.532 -11.634 1.00 0.00 N ATOM 1381 CA MET A 90 1.943 6.534 -12.098 1.00 0.00 C ATOM 1382 C MET A 90 1.426 7.233 -13.357 1.00 0.00 C ATOM 1383 O MET A 90 1.687 8.416 -13.567 1.00 0.00 O ATOM 1384 CB MET A 90 3.288 5.868 -12.400 1.00 0.00 C ATOM 1385 CG MET A 90 4.225 6.832 -13.131 1.00 0.00 C ATOM 1386 SD MET A 90 4.442 6.306 -14.822 1.00 0.00 S ATOM 1387 CE MET A 90 5.599 4.967 -14.584 1.00 0.00 C ATOM 0 H MET A 90 1.425 4.667 -11.301 1.00 0.00 H new ATOM 0 HA MET A 90 2.065 7.281 -11.314 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.752 5.539 -11.470 1.00 0.00 H new ATOM 0 HB3 MET A 90 3.129 4.978 -13.009 1.00 0.00 H new ATOM 0 HG2 MET A 90 3.814 7.841 -13.105 1.00 0.00 H new ATOM 0 HG3 MET A 90 5.190 6.868 -12.626 1.00 0.00 H new ATOM 0 HE1 MET A 90 5.844 4.522 -15.548 1.00 0.00 H new ATOM 0 HE2 MET A 90 6.508 5.350 -14.119 1.00 0.00 H new ATOM 0 HE3 MET A 90 5.152 4.210 -13.939 1.00 0.00 H new ATOM 1397 N ILE A 91 0.701 6.471 -14.163 1.00 0.00 N ATOM 1398 CA ILE A 91 0.145 7.002 -15.396 1.00 0.00 C ATOM 1399 C ILE A 91 -1.194 7.679 -15.096 1.00 0.00 C ATOM 1400 O ILE A 91 -1.456 8.782 -15.573 1.00 0.00 O ATOM 1401 CB ILE A 91 0.055 5.906 -16.459 1.00 0.00 C ATOM 1402 CG1 ILE A 91 1.444 5.375 -16.819 1.00 0.00 C ATOM 1403 CG2 ILE A 91 -0.707 6.398 -17.692 1.00 0.00 C ATOM 1404 CD1 ILE A 91 1.347 4.027 -17.537 1.00 0.00 C ATOM 0 H ILE A 91 0.486 5.490 -13.986 1.00 0.00 H new ATOM 0 HA ILE A 91 0.803 7.765 -15.813 1.00 0.00 H new ATOM 0 HB ILE A 91 -0.510 5.073 -16.042 1.00 0.00 H new ATOM 0 HG12 ILE A 91 1.958 6.094 -17.456 1.00 0.00 H new ATOM 0 HG13 ILE A 91 2.042 5.267 -15.914 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -0.756 5.599 -18.432 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -1.717 6.688 -17.404 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -0.191 7.257 -18.120 1.00 0.00 H new ATOM 0 HD11 ILE A 91 2.348 3.672 -17.782 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.854 3.304 -16.888 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.769 4.144 -18.454 1.00 0.00 H new ATOM 1416 N LEU A 92 -2.005 6.991 -14.307 1.00 0.00 N ATOM 1417 CA LEU A 92 -3.310 7.512 -13.938 1.00 0.00 C ATOM 1418 C LEU A 92 -3.144 8.902 -13.321 1.00 0.00 C ATOM 1419 O LEU A 92 -4.094 9.681 -13.271 1.00 0.00 O ATOM 1420 CB LEU A 92 -4.047 6.522 -13.033 1.00 0.00 C ATOM 1421 CG LEU A 92 -5.028 7.132 -12.030 1.00 0.00 C ATOM 1422 CD1 LEU A 92 -6.094 6.115 -11.619 1.00 0.00 C ATOM 1423 CD2 LEU A 92 -4.289 7.708 -10.821 1.00 0.00 C ATOM 0 H LEU A 92 -1.784 6.077 -13.913 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.937 7.628 -14.822 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.593 5.820 -13.664 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -3.306 5.944 -12.481 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.543 7.960 -12.516 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -6.779 6.574 -10.906 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -6.650 5.794 -12.500 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -5.615 5.252 -11.158 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -5.010 8.135 -10.124 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.730 6.915 -10.324 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.600 8.485 -11.152 1.00 0.00 H new ATOM 1435 N ARG A 93 -1.928 9.171 -12.865 1.00 0.00 N ATOM 1436 CA ARG A 93 -1.625 10.453 -12.253 1.00 0.00 C ATOM 1437 C ARG A 93 -0.916 11.365 -13.256 1.00 0.00 C ATOM 1438 O ARG A 93 -1.240 12.547 -13.364 1.00 0.00 O ATOM 1439 CB ARG A 93 -0.739 10.278 -11.018 1.00 0.00 C ATOM 1440 CG ARG A 93 -1.560 10.396 -9.733 1.00 0.00 C ATOM 1441 CD ARG A 93 -1.158 11.638 -8.937 1.00 0.00 C ATOM 1442 NE ARG A 93 -1.046 11.304 -7.499 1.00 0.00 N ATOM 1443 CZ ARG A 93 -2.095 11.093 -6.693 1.00 0.00 C ATOM 1444 NH1 ARG A 93 -3.341 11.180 -7.178 1.00 0.00 N ATOM 1445 NH2 ARG A 93 -1.898 10.795 -5.402 1.00 0.00 N ATOM 0 H ARG A 93 -1.142 8.522 -12.908 1.00 0.00 H new ATOM 0 HA ARG A 93 -2.568 10.906 -11.948 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.249 9.305 -11.053 1.00 0.00 H new ATOM 0 HB3 ARG A 93 0.048 11.032 -11.021 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -2.621 10.445 -9.978 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -1.415 9.505 -9.122 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -0.207 12.023 -9.304 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -1.897 12.426 -9.079 1.00 0.00 H new ATOM 0 HE ARG A 93 -0.112 11.230 -7.097 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -3.491 11.407 -8.161 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.140 11.019 -6.564 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -0.949 10.729 -5.033 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -2.697 10.634 -4.788 1.00 0.00 H new ATOM 1459 N LEU A 94 0.040 10.782 -13.965 1.00 0.00 N ATOM 1460 CA LEU A 94 0.798 11.527 -14.956 1.00 0.00 C ATOM 1461 C LEU A 94 -0.163 12.109 -15.995 1.00 0.00 C ATOM 1462 O LEU A 94 0.191 13.036 -16.723 1.00 0.00 O ATOM 1463 CB LEU A 94 1.899 10.652 -15.558 1.00 0.00 C ATOM 1464 CG LEU A 94 2.880 11.359 -16.495 1.00 0.00 C ATOM 1465 CD1 LEU A 94 4.261 10.703 -16.439 1.00 0.00 C ATOM 1466 CD2 LEU A 94 2.331 11.418 -17.922 1.00 0.00 C ATOM 0 H LEU A 94 0.307 9.802 -13.873 1.00 0.00 H new ATOM 0 HA LEU A 94 1.311 12.368 -14.490 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.466 10.203 -14.742 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.428 9.836 -16.106 1.00 0.00 H new ATOM 0 HG LEU A 94 2.998 12.387 -16.153 1.00 0.00 H new ATOM 0 HD11 LEU A 94 4.939 11.225 -17.114 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.649 10.757 -15.422 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.180 9.659 -16.741 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.048 11.926 -18.567 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.165 10.406 -18.290 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.388 11.965 -17.927 1.00 0.00 H new ATOM 1478 N VAL A 95 -1.360 11.542 -16.031 1.00 0.00 N ATOM 1479 CA VAL A 95 -2.374 11.992 -16.969 1.00 0.00 C ATOM 1480 C VAL A 95 -2.806 13.413 -16.602 1.00 0.00 C ATOM 1481 O VAL A 95 -2.662 14.336 -17.403 1.00 0.00 O ATOM 1482 CB VAL A 95 -3.539 11.001 -16.995 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -4.838 11.694 -17.412 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -3.230 9.816 -17.913 1.00 0.00 C ATOM 0 H VAL A 95 -1.650 10.774 -15.425 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.971 12.026 -17.981 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.674 10.615 -15.985 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -5.651 10.968 -17.423 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.070 12.488 -16.703 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.719 12.120 -18.408 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.074 9.126 -17.914 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.055 10.177 -18.927 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.340 9.300 -17.553 1.00 0.00 H new ATOM 1494 N LEU A 96 -3.326 13.545 -15.391 1.00 0.00 N ATOM 1495 CA LEU A 96 -3.780 14.839 -14.908 1.00 0.00 C ATOM 1496 C LEU A 96 -2.568 15.689 -14.524 1.00 0.00 C ATOM 1497 O LEU A 96 -2.533 16.887 -14.799 1.00 0.00 O ATOM 1498 CB LEU A 96 -4.792 14.662 -13.774 1.00 0.00 C ATOM 1499 CG LEU A 96 -4.243 14.082 -12.469 1.00 0.00 C ATOM 1500 CD1 LEU A 96 -4.781 14.849 -11.259 1.00 0.00 C ATOM 1501 CD2 LEU A 96 -4.530 12.583 -12.372 1.00 0.00 C ATOM 0 H LEU A 96 -3.443 12.778 -14.729 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.309 15.376 -15.695 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.238 15.633 -13.558 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -5.594 14.014 -14.127 1.00 0.00 H new ATOM 0 HG LEU A 96 -3.160 14.202 -12.470 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -4.375 14.417 -10.344 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.483 15.895 -11.329 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -5.869 14.783 -11.240 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -4.129 12.196 -11.435 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -5.607 12.416 -12.403 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -4.059 12.067 -13.209 1.00 0.00 H new ATOM 1513 N LEU A 97 -1.603 15.036 -13.893 1.00 0.00 N ATOM 1514 CA LEU A 97 -0.392 15.717 -13.468 1.00 0.00 C ATOM 1515 C LEU A 97 -0.730 17.160 -13.089 1.00 0.00 C ATOM 1516 O LEU A 97 0.028 18.080 -13.395 1.00 0.00 O ATOM 1517 CB LEU A 97 0.693 15.601 -14.541 1.00 0.00 C ATOM 1518 CG LEU A 97 0.813 16.784 -15.504 1.00 0.00 C ATOM 1519 CD1 LEU A 97 1.950 17.718 -15.085 1.00 0.00 C ATOM 1520 CD2 LEU A 97 0.970 16.303 -16.948 1.00 0.00 C ATOM 0 H LEU A 97 -1.635 14.042 -13.666 1.00 0.00 H new ATOM 0 HA LEU A 97 0.020 15.241 -12.578 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.654 15.463 -14.045 1.00 0.00 H new ATOM 0 HB3 LEU A 97 0.504 14.700 -15.125 1.00 0.00 H new ATOM 0 HG LEU A 97 -0.112 17.359 -15.455 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.014 18.550 -15.786 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.756 18.101 -14.083 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.892 17.169 -15.087 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.053 17.164 -17.611 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.869 15.692 -17.032 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.100 15.710 -17.231 1.00 0.00 H new ATOM 1532 N LEU A 98 -1.868 17.313 -12.429 1.00 0.00 N ATOM 1533 CA LEU A 98 -2.316 18.629 -12.004 1.00 0.00 C ATOM 1534 C LEU A 98 -2.558 18.618 -10.494 1.00 0.00 C ATOM 1535 O LEU A 98 -1.943 19.388 -9.757 1.00 0.00 O ATOM 1536 CB LEU A 98 -3.533 19.069 -12.819 1.00 0.00 C ATOM 1537 CG LEU A 98 -4.678 18.058 -12.915 1.00 0.00 C ATOM 1538 CD1 LEU A 98 -5.802 18.409 -11.939 1.00 0.00 C ATOM 1539 CD2 LEU A 98 -5.184 17.937 -14.353 1.00 0.00 C ATOM 0 H LEU A 98 -2.494 16.548 -12.178 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.545 19.375 -12.198 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.923 19.989 -12.384 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.201 19.309 -13.829 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.295 17.079 -12.626 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.603 17.675 -12.027 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.415 18.402 -10.920 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.191 19.400 -12.173 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -5.997 17.212 -14.393 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.545 18.907 -14.694 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.371 17.605 -14.998 1.00 0.00 H new ATOM 1551 N LEU A 99 -3.455 17.737 -10.077 1.00 0.00 N ATOM 1552 CA LEU A 99 -3.786 17.615 -8.667 1.00 0.00 C ATOM 1553 C LEU A 99 -2.516 17.295 -7.875 1.00 0.00 C ATOM 1554 O LEU A 99 -2.311 17.825 -6.785 1.00 0.00 O ATOM 1555 CB LEU A 99 -4.909 16.596 -8.467 1.00 0.00 C ATOM 1556 CG LEU A 99 -4.526 15.312 -7.727 1.00 0.00 C ATOM 1557 CD1 LEU A 99 -4.627 15.501 -6.213 1.00 0.00 C ATOM 1558 CD2 LEU A 99 -5.364 14.128 -8.214 1.00 0.00 C ATOM 0 H LEU A 99 -3.963 17.100 -10.691 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.172 18.559 -8.283 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.718 17.080 -7.920 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.304 16.324 -9.446 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.484 15.085 -7.954 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.350 14.574 -5.711 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.953 16.299 -5.900 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.650 15.765 -5.947 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -5.072 13.228 -7.672 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -6.420 14.332 -8.036 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -5.198 13.979 -9.281 1.00 0.00 H new TER 1570 LEU A 99