USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=15 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 -170:sc=-0.00124 (180deg=-0.0641) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 95:sc= 0.261 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 58:sc= 1.2 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 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.0678 K(o=-0.068,f=-0.68) 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 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 75:sc= 0.0159 USER MOD Single : A 65 THR OG1 : rot 90:sc= 0.131 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.979 -13.467 -21.911 1.00 0.00 N ATOM 2 CA MET A 1 -10.151 -12.652 -21.635 1.00 0.00 C ATOM 3 C MET A 1 -11.209 -12.825 -22.727 1.00 0.00 C ATOM 4 O MET A 1 -10.919 -12.655 -23.910 1.00 0.00 O ATOM 5 CB MET A 1 -9.740 -11.181 -21.551 1.00 0.00 C ATOM 6 CG MET A 1 -10.731 -10.384 -20.699 1.00 0.00 C ATOM 7 SD MET A 1 -10.197 -10.367 -18.996 1.00 0.00 S ATOM 8 CE MET A 1 -10.587 -8.680 -18.565 1.00 0.00 C ATOM 0 H1 MET A 1 -8.277 -13.332 -21.156 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.255 -14.469 -21.952 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.566 -13.184 -22.823 1.00 0.00 H new ATOM 0 HA MET A 1 -10.580 -12.974 -20.686 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.741 -11.102 -21.123 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.691 -10.755 -22.553 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.808 -9.364 -21.075 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.724 -10.826 -20.773 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.157 -8.444 -17.592 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.174 -8.008 -19.317 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.669 -8.556 -18.523 1.00 0.00 H new ATOM 18 N ASP A 2 -12.413 -13.162 -22.290 1.00 0.00 N ATOM 19 CA ASP A 2 -13.516 -13.361 -23.216 1.00 0.00 C ATOM 20 C ASP A 2 -13.806 -12.048 -23.946 1.00 0.00 C ATOM 21 O ASP A 2 -13.554 -10.968 -23.413 1.00 0.00 O ATOM 22 CB ASP A 2 -14.788 -13.780 -22.475 1.00 0.00 C ATOM 23 CG ASP A 2 -15.068 -15.284 -22.474 1.00 0.00 C ATOM 24 OD1 ASP A 2 -14.402 -16.059 -23.176 1.00 0.00 O ATOM 25 OD2 ASP A 2 -16.031 -15.658 -21.701 1.00 0.00 O ATOM 0 H ASP A 2 -12.650 -13.302 -21.308 1.00 0.00 H new ATOM 0 HA ASP A 2 -13.231 -14.146 -23.917 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -14.719 -13.438 -21.443 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -15.638 -13.267 -22.925 1.00 0.00 H new ATOM 30 N LEU A 3 -14.331 -12.183 -25.155 1.00 0.00 N ATOM 31 CA LEU A 3 -14.658 -11.021 -25.964 1.00 0.00 C ATOM 32 C LEU A 3 -15.981 -11.267 -26.691 1.00 0.00 C ATOM 33 O LEU A 3 -16.033 -12.033 -27.651 1.00 0.00 O ATOM 34 CB LEU A 3 -13.497 -10.676 -26.899 1.00 0.00 C ATOM 35 CG LEU A 3 -13.251 -11.653 -28.050 1.00 0.00 C ATOM 36 CD1 LEU A 3 -13.732 -11.067 -29.379 1.00 0.00 C ATOM 37 CD2 LEU A 3 -11.780 -12.072 -28.108 1.00 0.00 C ATOM 0 H LEU A 3 -14.538 -13.080 -25.594 1.00 0.00 H new ATOM 0 HA LEU A 3 -14.800 -10.144 -25.332 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -13.677 -9.687 -27.320 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -12.586 -10.608 -26.305 1.00 0.00 H new ATOM 0 HG LEU A 3 -13.836 -12.554 -27.864 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -13.545 -11.782 -30.181 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -14.800 -10.859 -29.320 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -13.193 -10.142 -29.585 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -11.632 -12.767 -28.935 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -11.156 -11.191 -28.258 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -11.503 -12.557 -27.172 1.00 0.00 H new ATOM 49 N ILE A 4 -17.019 -10.603 -26.204 1.00 0.00 N ATOM 50 CA ILE A 4 -18.339 -10.739 -26.796 1.00 0.00 C ATOM 51 C ILE A 4 -19.303 -9.767 -26.112 1.00 0.00 C ATOM 52 O ILE A 4 -20.043 -9.048 -26.781 1.00 0.00 O ATOM 53 CB ILE A 4 -18.800 -12.198 -26.747 1.00 0.00 C ATOM 54 CG1 ILE A 4 -20.123 -12.380 -27.493 1.00 0.00 C ATOM 55 CG2 ILE A 4 -18.881 -12.700 -25.304 1.00 0.00 C ATOM 56 CD1 ILE A 4 -20.376 -13.855 -27.808 1.00 0.00 C ATOM 0 H ILE A 4 -16.973 -9.969 -25.406 1.00 0.00 H new ATOM 0 HA ILE A 4 -18.312 -10.472 -27.852 1.00 0.00 H new ATOM 0 HB ILE A 4 -18.056 -12.809 -27.258 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -20.942 -11.988 -26.890 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -20.105 -11.805 -28.419 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -19.211 -13.739 -25.298 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -17.898 -12.629 -24.838 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -19.592 -12.090 -24.746 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -21.323 -13.957 -28.338 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -19.568 -14.238 -28.431 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -20.418 -14.423 -26.879 1.00 0.00 H new ATOM 68 N GLY A 5 -19.263 -9.778 -24.788 1.00 0.00 N ATOM 69 CA GLY A 5 -20.123 -8.906 -24.006 1.00 0.00 C ATOM 70 C GLY A 5 -19.380 -8.349 -22.790 1.00 0.00 C ATOM 71 O GLY A 5 -19.770 -8.601 -21.651 1.00 0.00 O ATOM 0 H GLY A 5 -18.648 -10.377 -24.237 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -20.476 -8.084 -24.629 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -21.004 -9.458 -23.677 1.00 0.00 H new ATOM 75 N PHE A 6 -18.324 -7.602 -23.073 1.00 0.00 N ATOM 76 CA PHE A 6 -17.523 -7.007 -22.017 1.00 0.00 C ATOM 77 C PHE A 6 -18.246 -5.817 -21.384 1.00 0.00 C ATOM 78 O PHE A 6 -18.438 -5.777 -20.169 1.00 0.00 O ATOM 79 CB PHE A 6 -16.225 -6.516 -22.662 1.00 0.00 C ATOM 80 CG PHE A 6 -15.186 -6.008 -21.661 1.00 0.00 C ATOM 81 CD1 PHE A 6 -14.557 -6.883 -20.831 1.00 0.00 C ATOM 82 CD2 PHE A 6 -14.891 -4.682 -21.600 1.00 0.00 C ATOM 83 CE1 PHE A 6 -13.592 -6.412 -19.902 1.00 0.00 C ATOM 84 CE2 PHE A 6 -13.926 -4.211 -20.671 1.00 0.00 C ATOM 85 CZ PHE A 6 -13.297 -5.086 -19.841 1.00 0.00 C ATOM 0 H PHE A 6 -18.004 -7.395 -24.019 1.00 0.00 H new ATOM 0 HA PHE A 6 -17.336 -7.742 -21.234 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -15.789 -7.330 -23.241 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -16.460 -5.716 -23.364 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -14.792 -7.936 -20.879 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -15.391 -3.987 -22.258 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -13.092 -7.107 -19.244 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -13.691 -3.158 -20.623 1.00 0.00 H new ATOM 0 HZ PHE A 6 -12.564 -4.728 -19.134 1.00 0.00 H new ATOM 95 N GLY A 7 -18.629 -4.877 -22.235 1.00 0.00 N ATOM 96 CA GLY A 7 -19.327 -3.689 -21.774 1.00 0.00 C ATOM 97 C GLY A 7 -20.293 -4.028 -20.637 1.00 0.00 C ATOM 98 O GLY A 7 -20.208 -3.450 -19.554 1.00 0.00 O ATOM 0 H GLY A 7 -18.469 -4.914 -23.242 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -18.604 -2.947 -21.433 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -19.877 -3.241 -22.602 1.00 0.00 H new ATOM 102 N TYR A 8 -21.187 -4.962 -20.921 1.00 0.00 N ATOM 103 CA TYR A 8 -22.168 -5.385 -19.935 1.00 0.00 C ATOM 104 C TYR A 8 -21.498 -5.693 -18.594 1.00 0.00 C ATOM 105 O TYR A 8 -21.941 -5.214 -17.550 1.00 0.00 O ATOM 106 CB TYR A 8 -22.794 -6.667 -20.485 1.00 0.00 C ATOM 107 CG TYR A 8 -24.225 -6.917 -20.004 1.00 0.00 C ATOM 108 CD1 TYR A 8 -24.459 -7.280 -18.693 1.00 0.00 C ATOM 109 CD2 TYR A 8 -25.282 -6.779 -20.881 1.00 0.00 C ATOM 110 CE1 TYR A 8 -25.805 -7.515 -18.240 1.00 0.00 C ATOM 111 CE2 TYR A 8 -26.628 -7.014 -20.428 1.00 0.00 C ATOM 112 CZ TYR A 8 -26.824 -7.370 -19.130 1.00 0.00 C ATOM 113 OH TYR A 8 -28.095 -7.592 -18.702 1.00 0.00 O ATOM 0 H TYR A 8 -21.254 -5.439 -21.820 1.00 0.00 H new ATOM 0 HA TYR A 8 -22.905 -4.600 -19.766 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -22.790 -6.623 -21.574 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -22.172 -7.515 -20.198 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -23.632 -7.388 -18.007 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -25.099 -6.495 -21.907 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -26.002 -7.800 -17.217 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -27.464 -6.910 -21.104 1.00 0.00 H new ATOM 0 HH TYR A 8 -28.719 -7.451 -19.444 1.00 0.00 H new ATOM 123 N ALA A 9 -20.443 -6.491 -18.665 1.00 0.00 N ATOM 124 CA ALA A 9 -19.708 -6.869 -17.470 1.00 0.00 C ATOM 125 C ALA A 9 -19.231 -5.607 -16.749 1.00 0.00 C ATOM 126 O ALA A 9 -19.188 -5.567 -15.521 1.00 0.00 O ATOM 127 CB ALA A 9 -18.552 -7.795 -17.852 1.00 0.00 C ATOM 0 H ALA A 9 -20.079 -6.887 -19.532 1.00 0.00 H new ATOM 0 HA ALA A 9 -20.351 -7.418 -16.782 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -18.001 -8.078 -16.955 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -18.946 -8.690 -18.333 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -17.884 -7.278 -18.540 1.00 0.00 H new ATOM 133 N ALA A 10 -18.883 -4.606 -17.545 1.00 0.00 N ATOM 134 CA ALA A 10 -18.409 -3.345 -16.999 1.00 0.00 C ATOM 135 C ALA A 10 -19.581 -2.603 -16.352 1.00 0.00 C ATOM 136 O ALA A 10 -19.392 -1.846 -15.401 1.00 0.00 O ATOM 137 CB ALA A 10 -17.740 -2.528 -18.106 1.00 0.00 C ATOM 0 H ALA A 10 -18.920 -4.643 -18.564 1.00 0.00 H new ATOM 0 HA ALA A 10 -17.661 -3.518 -16.226 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -17.385 -1.582 -17.696 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -16.897 -3.087 -18.512 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.461 -2.331 -18.899 1.00 0.00 H new ATOM 143 N LEU A 11 -20.765 -2.844 -16.895 1.00 0.00 N ATOM 144 CA LEU A 11 -21.967 -2.208 -16.384 1.00 0.00 C ATOM 145 C LEU A 11 -22.253 -2.728 -14.974 1.00 0.00 C ATOM 146 O LEU A 11 -22.379 -1.946 -14.033 1.00 0.00 O ATOM 147 CB LEU A 11 -23.131 -2.399 -17.358 1.00 0.00 C ATOM 148 CG LEU A 11 -24.369 -1.539 -17.101 1.00 0.00 C ATOM 149 CD1 LEU A 11 -24.786 -1.603 -15.630 1.00 0.00 C ATOM 150 CD2 LEU A 11 -24.144 -0.100 -17.570 1.00 0.00 C ATOM 0 H LEU A 11 -20.918 -3.472 -17.684 1.00 0.00 H new ATOM 0 HA LEU A 11 -21.823 -1.130 -16.304 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -22.772 -2.192 -18.366 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -23.430 -3.447 -17.335 1.00 0.00 H new ATOM 0 HG LEU A 11 -25.194 -1.944 -17.688 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -25.669 -0.983 -15.475 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -25.015 -2.634 -15.361 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -23.971 -1.238 -15.005 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -25.040 0.490 -17.376 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -23.301 0.331 -17.030 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -23.931 -0.095 -18.639 1.00 0.00 H new ATOM 162 N VAL A 12 -22.348 -4.046 -14.872 1.00 0.00 N ATOM 163 CA VAL A 12 -22.618 -4.680 -13.592 1.00 0.00 C ATOM 164 C VAL A 12 -21.529 -4.284 -12.592 1.00 0.00 C ATOM 165 O VAL A 12 -21.821 -3.692 -11.554 1.00 0.00 O ATOM 166 CB VAL A 12 -22.740 -6.194 -13.774 1.00 0.00 C ATOM 167 CG1 VAL A 12 -22.760 -6.909 -12.421 1.00 0.00 C ATOM 168 CG2 VAL A 12 -23.979 -6.549 -14.600 1.00 0.00 C ATOM 0 H VAL A 12 -22.243 -4.692 -15.654 1.00 0.00 H new ATOM 0 HA VAL A 12 -23.571 -4.336 -13.189 1.00 0.00 H new ATOM 0 HB VAL A 12 -21.862 -6.537 -14.322 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -22.847 -7.984 -12.579 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -21.837 -6.695 -11.883 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -23.610 -6.558 -11.836 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -24.042 -7.631 -14.715 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -24.872 -6.185 -14.091 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -23.906 -6.084 -15.583 1.00 0.00 H new ATOM 178 N THR A 13 -20.298 -4.627 -12.941 1.00 0.00 N ATOM 179 CA THR A 13 -19.164 -4.314 -12.087 1.00 0.00 C ATOM 180 C THR A 13 -19.289 -2.894 -11.533 1.00 0.00 C ATOM 181 O THR A 13 -19.191 -2.684 -10.325 1.00 0.00 O ATOM 182 CB THR A 13 -17.886 -4.541 -12.896 1.00 0.00 C ATOM 183 OG1 THR A 13 -17.767 -5.959 -12.969 1.00 0.00 O ATOM 184 CG2 THR A 13 -16.630 -4.100 -12.143 1.00 0.00 C ATOM 0 H THR A 13 -20.061 -5.118 -13.803 1.00 0.00 H new ATOM 0 HA THR A 13 -19.134 -4.967 -11.215 1.00 0.00 H new ATOM 0 HB THR A 13 -17.953 -3.998 -13.839 1.00 0.00 H new ATOM 0 HG1 THR A 13 -18.166 -6.278 -13.805 1.00 0.00 H new ATOM 0 HG21 THR A 13 -15.752 -4.283 -12.762 1.00 0.00 H new ATOM 0 HG22 THR A 13 -16.698 -3.036 -11.914 1.00 0.00 H new ATOM 0 HG23 THR A 13 -16.544 -4.666 -11.215 1.00 0.00 H new ATOM 192 N PHE A 14 -19.504 -1.955 -12.443 1.00 0.00 N ATOM 193 CA PHE A 14 -19.643 -0.560 -12.061 1.00 0.00 C ATOM 194 C PHE A 14 -20.726 -0.389 -10.993 1.00 0.00 C ATOM 195 O PHE A 14 -20.481 0.205 -9.945 1.00 0.00 O ATOM 196 CB PHE A 14 -20.057 0.209 -13.317 1.00 0.00 C ATOM 197 CG PHE A 14 -20.060 1.729 -13.143 1.00 0.00 C ATOM 198 CD1 PHE A 14 -18.945 2.365 -12.695 1.00 0.00 C ATOM 199 CD2 PHE A 14 -21.179 2.444 -13.437 1.00 0.00 C ATOM 200 CE1 PHE A 14 -18.948 3.776 -12.534 1.00 0.00 C ATOM 201 CE2 PHE A 14 -21.183 3.855 -13.276 1.00 0.00 C ATOM 202 CZ PHE A 14 -20.067 4.491 -12.827 1.00 0.00 C ATOM 0 H PHE A 14 -19.585 -2.133 -13.444 1.00 0.00 H new ATOM 0 HA PHE A 14 -18.703 -0.192 -11.650 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -19.380 -0.052 -14.130 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -21.054 -0.114 -13.616 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -18.057 1.797 -12.461 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -22.065 1.939 -13.793 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -18.062 4.281 -12.179 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -22.071 4.423 -13.510 1.00 0.00 H new ATOM 0 HZ PHE A 14 -20.070 5.564 -12.703 1.00 0.00 H new ATOM 212 N GLY A 15 -21.900 -0.922 -11.297 1.00 0.00 N ATOM 213 CA GLY A 15 -23.022 -0.836 -10.377 1.00 0.00 C ATOM 214 C GLY A 15 -22.699 -1.532 -9.053 1.00 0.00 C ATOM 215 O GLY A 15 -22.537 -0.876 -8.026 1.00 0.00 O ATOM 0 H GLY A 15 -22.099 -1.415 -12.167 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -23.266 0.210 -10.192 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -23.903 -1.294 -10.828 1.00 0.00 H new ATOM 219 N SER A 16 -22.615 -2.853 -9.121 1.00 0.00 N ATOM 220 CA SER A 16 -22.315 -3.645 -7.941 1.00 0.00 C ATOM 221 C SER A 16 -21.231 -2.956 -7.110 1.00 0.00 C ATOM 222 O SER A 16 -21.431 -2.684 -5.927 1.00 0.00 O ATOM 223 CB SER A 16 -21.870 -5.058 -8.325 1.00 0.00 C ATOM 224 OG SER A 16 -21.654 -5.879 -7.180 1.00 0.00 O ATOM 0 H SER A 16 -22.750 -3.394 -9.975 1.00 0.00 H new ATOM 0 HA SER A 16 -23.224 -3.728 -7.345 1.00 0.00 H new ATOM 0 HB2 SER A 16 -22.627 -5.516 -8.962 1.00 0.00 H new ATOM 0 HB3 SER A 16 -20.952 -5.003 -8.910 1.00 0.00 H new ATOM 0 HG SER A 16 -21.373 -6.773 -7.467 1.00 0.00 H new ATOM 230 N ILE A 17 -20.108 -2.693 -7.761 1.00 0.00 N ATOM 231 CA ILE A 17 -18.993 -2.040 -7.096 1.00 0.00 C ATOM 232 C ILE A 17 -19.504 -0.815 -6.336 1.00 0.00 C ATOM 233 O ILE A 17 -19.174 -0.623 -5.167 1.00 0.00 O ATOM 234 CB ILE A 17 -17.883 -1.722 -8.100 1.00 0.00 C ATOM 235 CG1 ILE A 17 -17.244 -3.005 -8.636 1.00 0.00 C ATOM 236 CG2 ILE A 17 -16.846 -0.777 -7.489 1.00 0.00 C ATOM 237 CD1 ILE A 17 -16.196 -3.544 -7.661 1.00 0.00 C ATOM 0 H ILE A 17 -19.946 -2.920 -8.742 1.00 0.00 H new ATOM 0 HA ILE A 17 -18.545 -2.707 -6.360 1.00 0.00 H new ATOM 0 HB ILE A 17 -18.329 -1.205 -8.950 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -18.015 -3.758 -8.800 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -16.780 -2.808 -9.602 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -16.068 -0.567 -8.223 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -17.330 0.155 -7.197 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -16.400 -1.245 -6.611 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -15.757 -4.456 -8.066 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -15.414 -2.798 -7.518 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -16.668 -3.763 -6.703 1.00 0.00 H new ATOM 249 N PHE A 18 -20.302 -0.017 -7.031 1.00 0.00 N ATOM 250 CA PHE A 18 -20.862 1.184 -6.436 1.00 0.00 C ATOM 251 C PHE A 18 -21.644 0.853 -5.164 1.00 0.00 C ATOM 252 O PHE A 18 -21.607 1.608 -4.194 1.00 0.00 O ATOM 253 CB PHE A 18 -21.819 1.789 -7.466 1.00 0.00 C ATOM 254 CG PHE A 18 -21.738 3.313 -7.571 1.00 0.00 C ATOM 255 CD1 PHE A 18 -20.674 3.896 -8.186 1.00 0.00 C ATOM 256 CD2 PHE A 18 -22.730 4.084 -7.050 1.00 0.00 C ATOM 257 CE1 PHE A 18 -20.599 5.311 -8.284 1.00 0.00 C ATOM 258 CE2 PHE A 18 -22.654 5.499 -7.148 1.00 0.00 C ATOM 259 CZ PHE A 18 -21.591 6.083 -7.763 1.00 0.00 C ATOM 0 H PHE A 18 -20.574 -0.179 -8.001 1.00 0.00 H new ATOM 0 HA PHE A 18 -20.062 1.874 -6.169 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -21.606 1.356 -8.443 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -22.840 1.507 -7.208 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -19.887 3.283 -8.600 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -23.575 3.621 -6.562 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -19.754 5.774 -8.772 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -23.441 6.112 -6.734 1.00 0.00 H new ATOM 0 HZ PHE A 18 -21.534 7.159 -7.838 1.00 0.00 H new ATOM 269 N GLY A 19 -22.334 -0.278 -5.209 1.00 0.00 N ATOM 270 CA GLY A 19 -23.123 -0.718 -4.072 1.00 0.00 C ATOM 271 C GLY A 19 -22.233 -1.343 -2.995 1.00 0.00 C ATOM 272 O GLY A 19 -22.633 -1.444 -1.836 1.00 0.00 O ATOM 0 H GLY A 19 -22.362 -0.902 -6.015 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -23.667 0.129 -3.653 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -23.867 -1.444 -4.400 1.00 0.00 H new ATOM 276 N TYR A 20 -21.043 -1.744 -3.416 1.00 0.00 N ATOM 277 CA TYR A 20 -20.093 -2.355 -2.502 1.00 0.00 C ATOM 278 C TYR A 20 -20.766 -3.434 -1.652 1.00 0.00 C ATOM 279 O TYR A 20 -21.406 -3.127 -0.647 1.00 0.00 O ATOM 280 CB TYR A 20 -19.605 -1.231 -1.587 1.00 0.00 C ATOM 281 CG TYR A 20 -18.445 -1.631 -0.673 1.00 0.00 C ATOM 282 CD1 TYR A 20 -18.691 -2.340 0.484 1.00 0.00 C ATOM 283 CD2 TYR A 20 -17.152 -1.282 -1.008 1.00 0.00 C ATOM 284 CE1 TYR A 20 -17.598 -2.717 1.344 1.00 0.00 C ATOM 285 CE2 TYR A 20 -16.059 -1.658 -0.148 1.00 0.00 C ATOM 286 CZ TYR A 20 -16.337 -2.357 0.985 1.00 0.00 C ATOM 287 OH TYR A 20 -15.305 -2.713 1.797 1.00 0.00 O ATOM 0 H TYR A 20 -20.715 -1.658 -4.378 1.00 0.00 H new ATOM 0 HA TYR A 20 -19.280 -2.827 -3.053 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -19.295 -0.385 -2.201 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -20.438 -0.890 -0.972 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -19.703 -2.613 0.745 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -16.960 -0.727 -1.915 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -17.776 -3.273 2.253 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -15.043 -1.391 -0.397 1.00 0.00 H new ATOM 0 HH TYR A 20 -14.462 -2.390 1.415 1.00 0.00 H new ATOM 297 N LYS A 21 -20.599 -4.674 -2.086 1.00 0.00 N ATOM 298 CA LYS A 21 -21.183 -5.800 -1.376 1.00 0.00 C ATOM 299 C LYS A 21 -20.626 -7.104 -1.951 1.00 0.00 C ATOM 300 O LYS A 21 -21.382 -7.955 -2.417 1.00 0.00 O ATOM 301 CB LYS A 21 -22.711 -5.719 -1.407 1.00 0.00 C ATOM 302 CG LYS A 21 -23.284 -5.640 0.010 1.00 0.00 C ATOM 303 CD LYS A 21 -23.665 -7.029 0.525 1.00 0.00 C ATOM 304 CE LYS A 21 -24.585 -6.928 1.744 1.00 0.00 C ATOM 305 NZ LYS A 21 -23.980 -7.613 2.908 1.00 0.00 N ATOM 0 H LYS A 21 -20.068 -4.924 -2.920 1.00 0.00 H new ATOM 0 HA LYS A 21 -20.906 -5.771 -0.322 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -23.021 -4.844 -1.978 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -23.115 -6.593 -1.918 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -22.550 -5.189 0.678 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -24.161 -4.993 0.016 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -24.163 -7.590 -0.266 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -22.764 -7.583 0.790 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -24.766 -5.880 1.985 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -25.553 -7.374 1.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -24.617 -7.535 3.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -23.830 -8.617 2.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -23.067 -7.169 3.136 1.00 0.00 H new ATOM 319 N ARG A 22 -19.307 -7.220 -1.899 1.00 0.00 N ATOM 320 CA ARG A 22 -18.639 -8.406 -2.409 1.00 0.00 C ATOM 321 C ARG A 22 -17.124 -8.274 -2.242 1.00 0.00 C ATOM 322 O ARG A 22 -16.484 -9.140 -1.646 1.00 0.00 O ATOM 323 CB ARG A 22 -18.965 -8.629 -3.887 1.00 0.00 C ATOM 324 CG ARG A 22 -18.321 -9.918 -4.401 1.00 0.00 C ATOM 325 CD ARG A 22 -19.340 -10.779 -5.150 1.00 0.00 C ATOM 326 NE ARG A 22 -19.197 -12.196 -4.750 1.00 0.00 N ATOM 327 CZ ARG A 22 -19.604 -13.233 -5.496 1.00 0.00 C ATOM 328 NH1 ARG A 22 -20.182 -13.016 -6.685 1.00 0.00 N ATOM 329 NH2 ARG A 22 -19.432 -14.485 -5.053 1.00 0.00 N ATOM 0 H ARG A 22 -18.683 -6.512 -1.512 1.00 0.00 H new ATOM 0 HA ARG A 22 -18.998 -9.261 -1.837 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -20.046 -8.679 -4.021 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -18.610 -7.782 -4.473 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -17.489 -9.675 -5.062 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -17.909 -10.482 -3.564 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -20.350 -10.432 -4.934 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -19.192 -10.679 -6.225 1.00 0.00 H new ATOM 0 HE ARG A 22 -18.761 -12.397 -3.850 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -20.312 -12.062 -7.022 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -20.492 -13.805 -7.253 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -18.991 -14.650 -4.148 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -19.742 -15.274 -5.621 1.00 0.00 H new ATOM 343 N ARG A 23 -16.593 -7.186 -2.779 1.00 0.00 N ATOM 344 CA ARG A 23 -15.165 -6.930 -2.697 1.00 0.00 C ATOM 345 C ARG A 23 -14.644 -7.274 -1.301 1.00 0.00 C ATOM 346 O ARG A 23 -15.281 -6.952 -0.299 1.00 0.00 O ATOM 347 CB ARG A 23 -14.849 -5.465 -3.006 1.00 0.00 C ATOM 348 CG ARG A 23 -13.339 -5.221 -3.016 1.00 0.00 C ATOM 349 CD ARG A 23 -12.900 -4.447 -1.771 1.00 0.00 C ATOM 350 NE ARG A 23 -12.504 -3.071 -2.145 1.00 0.00 N ATOM 351 CZ ARG A 23 -11.492 -2.778 -2.973 1.00 0.00 C ATOM 352 NH1 ARG A 23 -10.767 -3.764 -3.519 1.00 0.00 N ATOM 353 NH2 ARG A 23 -11.204 -1.500 -3.254 1.00 0.00 N ATOM 0 H ARG A 23 -17.126 -6.471 -3.273 1.00 0.00 H new ATOM 0 HA ARG A 23 -14.672 -7.560 -3.438 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -15.271 -5.194 -3.974 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -15.320 -4.823 -2.262 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -12.813 -6.175 -3.060 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -13.063 -4.664 -3.911 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -13.713 -4.416 -1.046 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -12.065 -4.957 -1.291 1.00 0.00 H new ATOM 0 HE ARG A 23 -13.035 -2.296 -1.747 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -10.986 -4.737 -3.304 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -9.997 -3.542 -4.149 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -11.755 -0.750 -2.838 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -10.434 -1.278 -3.884 1.00 0.00 H new ATOM 367 N GLY A 24 -13.489 -7.925 -1.279 1.00 0.00 N ATOM 368 CA GLY A 24 -12.875 -8.316 -0.021 1.00 0.00 C ATOM 369 C GLY A 24 -12.482 -9.794 -0.040 1.00 0.00 C ATOM 370 O GLY A 24 -13.337 -10.669 0.090 1.00 0.00 O ATOM 0 H GLY A 24 -12.963 -8.191 -2.112 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.992 -7.703 0.163 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.568 -8.131 0.799 1.00 0.00 H new ATOM 374 N GLY A 25 -11.188 -10.028 -0.203 1.00 0.00 N ATOM 375 CA GLY A 25 -10.672 -11.386 -0.240 1.00 0.00 C ATOM 376 C GLY A 25 -9.183 -11.416 0.115 1.00 0.00 C ATOM 377 O GLY A 25 -8.822 -11.561 1.281 1.00 0.00 O ATOM 0 H GLY A 25 -10.482 -9.300 -0.311 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -11.229 -12.010 0.459 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.821 -11.809 -1.233 1.00 0.00 H new ATOM 381 N VAL A 26 -8.360 -11.277 -0.914 1.00 0.00 N ATOM 382 CA VAL A 26 -6.919 -11.287 -0.726 1.00 0.00 C ATOM 383 C VAL A 26 -6.571 -10.522 0.553 1.00 0.00 C ATOM 384 O VAL A 26 -6.526 -9.293 0.553 1.00 0.00 O ATOM 385 CB VAL A 26 -6.226 -10.722 -1.968 1.00 0.00 C ATOM 386 CG1 VAL A 26 -6.508 -9.226 -2.121 1.00 0.00 C ATOM 387 CG2 VAL A 26 -4.721 -10.995 -1.927 1.00 0.00 C ATOM 0 H VAL A 26 -8.663 -11.157 -1.880 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.556 -12.308 -0.603 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.636 -11.230 -2.841 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.004 -8.850 -3.011 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.582 -9.066 -2.217 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.139 -8.695 -1.244 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -4.252 -10.583 -2.821 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -4.290 -10.526 -1.042 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.547 -12.070 -1.889 1.00 0.00 H new ATOM 397 N PRO A 27 -6.328 -11.302 1.640 1.00 0.00 N ATOM 398 CA PRO A 27 -5.985 -10.712 2.923 1.00 0.00 C ATOM 399 C PRO A 27 -4.543 -10.201 2.924 1.00 0.00 C ATOM 400 O PRO A 27 -3.649 -10.857 3.456 1.00 0.00 O ATOM 401 CB PRO A 27 -6.225 -11.815 3.940 1.00 0.00 C ATOM 402 CG PRO A 27 -6.245 -13.114 3.150 1.00 0.00 C ATOM 403 CD PRO A 27 -6.373 -12.761 1.677 1.00 0.00 C ATOM 0 HA PRO A 27 -6.588 -9.835 3.157 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -5.438 -11.829 4.694 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -7.168 -11.663 4.466 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -5.333 -13.683 3.328 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -7.079 -13.741 3.466 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -5.562 -13.197 1.093 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -7.306 -13.139 1.259 1.00 0.00 H new ATOM 411 N SER A 28 -4.362 -9.035 2.321 1.00 0.00 N ATOM 412 CA SER A 28 -3.043 -8.429 2.245 1.00 0.00 C ATOM 413 C SER A 28 -3.138 -7.051 1.587 1.00 0.00 C ATOM 414 O SER A 28 -3.005 -6.028 2.257 1.00 0.00 O ATOM 415 CB SER A 28 -2.070 -9.321 1.472 1.00 0.00 C ATOM 416 OG SER A 28 -1.342 -10.190 2.335 1.00 0.00 O ATOM 0 H SER A 28 -5.106 -8.494 1.881 1.00 0.00 H new ATOM 0 HA SER A 28 -2.660 -8.315 3.259 1.00 0.00 H new ATOM 0 HB2 SER A 28 -2.623 -9.914 0.743 1.00 0.00 H new ATOM 0 HB3 SER A 28 -1.372 -8.697 0.913 1.00 0.00 H new ATOM 0 HG SER A 28 -1.969 -10.745 2.845 1.00 0.00 H new ATOM 422 N LEU A 29 -3.367 -7.068 0.282 1.00 0.00 N ATOM 423 CA LEU A 29 -3.481 -5.833 -0.474 1.00 0.00 C ATOM 424 C LEU A 29 -4.299 -4.821 0.330 1.00 0.00 C ATOM 425 O LEU A 29 -3.833 -3.716 0.601 1.00 0.00 O ATOM 426 CB LEU A 29 -4.046 -6.109 -1.870 1.00 0.00 C ATOM 427 CG LEU A 29 -3.374 -5.363 -3.024 1.00 0.00 C ATOM 428 CD1 LEU A 29 -1.994 -5.950 -3.327 1.00 0.00 C ATOM 429 CD2 LEU A 29 -4.273 -5.346 -4.262 1.00 0.00 C ATOM 0 H LEU A 29 -3.477 -7.918 -0.271 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.497 -5.393 -0.634 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -3.974 -7.179 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.106 -5.856 -1.868 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.224 -4.327 -2.720 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.538 -5.401 -4.151 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.362 -5.868 -2.443 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.098 -6.999 -3.603 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.772 -4.810 -5.068 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.476 -6.369 -4.578 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -5.212 -4.847 -4.023 1.00 0.00 H new ATOM 441 N ILE A 30 -5.506 -5.235 0.689 1.00 0.00 N ATOM 442 CA ILE A 30 -6.393 -4.378 1.458 1.00 0.00 C ATOM 443 C ILE A 30 -5.623 -3.782 2.638 1.00 0.00 C ATOM 444 O ILE A 30 -5.687 -2.577 2.880 1.00 0.00 O ATOM 445 CB ILE A 30 -7.653 -5.143 1.869 1.00 0.00 C ATOM 446 CG1 ILE A 30 -8.400 -4.409 2.984 1.00 0.00 C ATOM 447 CG2 ILE A 30 -7.317 -6.585 2.256 1.00 0.00 C ATOM 448 CD1 ILE A 30 -9.896 -4.319 2.675 1.00 0.00 C ATOM 0 H ILE A 30 -5.890 -6.152 0.462 1.00 0.00 H new ATOM 0 HA ILE A 30 -6.739 -3.543 0.849 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.322 -5.188 1.009 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -8.251 -4.929 3.930 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.989 -3.407 3.103 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -8.230 -7.107 2.544 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.861 -7.093 1.406 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.620 -6.584 3.094 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -10.403 -3.793 3.483 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -10.043 -3.777 1.741 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -10.309 -5.323 2.580 1.00 0.00 H new ATOM 460 N ALA A 31 -4.913 -4.652 3.341 1.00 0.00 N ATOM 461 CA ALA A 31 -4.132 -4.226 4.489 1.00 0.00 C ATOM 462 C ALA A 31 -3.218 -3.070 4.079 1.00 0.00 C ATOM 463 O ALA A 31 -3.071 -2.098 4.818 1.00 0.00 O ATOM 464 CB ALA A 31 -3.350 -5.418 5.046 1.00 0.00 C ATOM 0 H ALA A 31 -4.862 -5.650 3.137 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.785 -3.864 5.283 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.764 -5.098 5.908 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -4.046 -6.200 5.351 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.682 -5.806 4.277 1.00 0.00 H new ATOM 470 N GLY A 32 -2.627 -3.214 2.902 1.00 0.00 N ATOM 471 CA GLY A 32 -1.731 -2.194 2.384 1.00 0.00 C ATOM 472 C GLY A 32 -2.498 -0.916 2.036 1.00 0.00 C ATOM 473 O GLY A 32 -1.948 0.182 2.109 1.00 0.00 O ATOM 0 H GLY A 32 -2.751 -4.022 2.292 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.962 -1.971 3.123 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.221 -2.569 1.497 1.00 0.00 H new ATOM 477 N LEU A 33 -3.756 -1.102 1.666 1.00 0.00 N ATOM 478 CA LEU A 33 -4.604 0.023 1.307 1.00 0.00 C ATOM 479 C LEU A 33 -4.903 0.851 2.558 1.00 0.00 C ATOM 480 O LEU A 33 -4.796 2.076 2.535 1.00 0.00 O ATOM 481 CB LEU A 33 -5.858 -0.464 0.577 1.00 0.00 C ATOM 482 CG LEU A 33 -6.019 0.009 -0.869 1.00 0.00 C ATOM 483 CD1 LEU A 33 -6.106 1.535 -0.941 1.00 0.00 C ATOM 484 CD2 LEU A 33 -4.899 -0.544 -1.754 1.00 0.00 C ATOM 0 H LEU A 33 -4.209 -2.014 1.607 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.089 0.680 0.606 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -5.858 -1.554 0.584 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.732 -0.142 1.143 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.959 -0.385 -1.255 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.220 1.844 -1.980 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.965 1.878 -0.364 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.195 1.971 -0.531 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.037 -0.193 -2.777 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.935 -0.200 -1.379 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.927 -1.634 -1.737 1.00 0.00 H new ATOM 496 N PHE A 34 -5.270 0.149 3.619 1.00 0.00 N ATOM 497 CA PHE A 34 -5.585 0.804 4.878 1.00 0.00 C ATOM 498 C PHE A 34 -4.338 1.449 5.487 1.00 0.00 C ATOM 499 O PHE A 34 -4.419 2.518 6.089 1.00 0.00 O ATOM 500 CB PHE A 34 -6.102 -0.278 5.828 1.00 0.00 C ATOM 501 CG PHE A 34 -7.627 -0.349 5.920 1.00 0.00 C ATOM 502 CD1 PHE A 34 -8.302 0.526 6.714 1.00 0.00 C ATOM 503 CD2 PHE A 34 -8.309 -1.286 5.209 1.00 0.00 C ATOM 504 CE1 PHE A 34 -9.718 0.461 6.799 1.00 0.00 C ATOM 505 CE2 PHE A 34 -9.725 -1.351 5.294 1.00 0.00 C ATOM 506 CZ PHE A 34 -10.399 -0.477 6.088 1.00 0.00 C ATOM 0 H PHE A 34 -5.357 -0.867 3.634 1.00 0.00 H new ATOM 0 HA PHE A 34 -6.324 1.589 4.715 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -5.723 -1.246 5.500 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -5.696 -0.097 6.823 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -7.761 1.270 7.280 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -7.774 -1.981 4.579 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -10.254 1.156 7.428 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -10.266 -2.095 4.728 1.00 0.00 H new ATOM 0 HZ PHE A 34 -11.476 -0.528 6.154 1.00 0.00 H new ATOM 516 N VAL A 35 -3.214 0.771 5.309 1.00 0.00 N ATOM 517 CA VAL A 35 -1.952 1.264 5.834 1.00 0.00 C ATOM 518 C VAL A 35 -1.613 2.598 5.166 1.00 0.00 C ATOM 519 O VAL A 35 -1.570 3.634 5.827 1.00 0.00 O ATOM 520 CB VAL A 35 -0.860 0.208 5.650 1.00 0.00 C ATOM 521 CG1 VAL A 35 0.516 0.773 6.010 1.00 0.00 C ATOM 522 CG2 VAL A 35 -1.168 -1.048 6.467 1.00 0.00 C ATOM 0 H VAL A 35 -3.151 -0.116 4.809 1.00 0.00 H new ATOM 0 HA VAL A 35 -2.030 1.448 6.906 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.841 -0.074 4.597 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.274 0.002 5.870 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.740 1.623 5.366 1.00 0.00 H new ATOM 0 HG13 VAL A 35 0.515 1.097 7.051 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -0.376 -1.782 6.318 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.228 -0.789 7.524 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.119 -1.469 6.142 1.00 0.00 H new ATOM 532 N GLY A 36 -1.381 2.528 3.863 1.00 0.00 N ATOM 533 CA GLY A 36 -1.048 3.717 3.098 1.00 0.00 C ATOM 534 C GLY A 36 -2.049 4.842 3.369 1.00 0.00 C ATOM 535 O GLY A 36 -1.660 5.998 3.534 1.00 0.00 O ATOM 0 H GLY A 36 -1.417 1.666 3.318 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -0.043 4.050 3.356 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.042 3.479 2.034 1.00 0.00 H new ATOM 539 N CYS A 37 -3.318 4.465 3.405 1.00 0.00 N ATOM 540 CA CYS A 37 -4.378 5.428 3.652 1.00 0.00 C ATOM 541 C CYS A 37 -4.107 6.106 4.997 1.00 0.00 C ATOM 542 O CYS A 37 -3.847 7.307 5.049 1.00 0.00 O ATOM 543 CB CYS A 37 -5.760 4.771 3.613 1.00 0.00 C ATOM 544 SG CYS A 37 -6.461 4.889 1.927 1.00 0.00 S ATOM 0 H CYS A 37 -3.637 3.506 3.267 1.00 0.00 H new ATOM 0 HA CYS A 37 -4.382 6.178 2.862 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -5.683 3.726 3.912 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -6.424 5.259 4.327 1.00 0.00 H new ATOM 0 HG CYS A 37 -7.633 4.327 1.904 1.00 0.00 H new ATOM 550 N LEU A 38 -4.176 5.307 6.051 1.00 0.00 N ATOM 551 CA LEU A 38 -3.941 5.815 7.392 1.00 0.00 C ATOM 552 C LEU A 38 -2.771 6.800 7.362 1.00 0.00 C ATOM 553 O LEU A 38 -2.801 7.826 8.040 1.00 0.00 O ATOM 554 CB LEU A 38 -3.747 4.659 8.376 1.00 0.00 C ATOM 555 CG LEU A 38 -4.742 4.593 9.537 1.00 0.00 C ATOM 556 CD1 LEU A 38 -4.607 5.817 10.445 1.00 0.00 C ATOM 557 CD2 LEU A 38 -6.172 4.414 9.024 1.00 0.00 C ATOM 0 H LEU A 38 -4.391 4.311 6.004 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.812 6.365 7.749 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.803 3.722 7.821 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -2.741 4.725 8.789 1.00 0.00 H new ATOM 0 HG LEU A 38 -4.505 3.717 10.141 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.325 5.745 11.262 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.597 5.858 10.853 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.803 6.721 9.868 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.859 4.370 9.869 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -6.437 5.256 8.384 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.240 3.488 8.452 1.00 0.00 H new ATOM 569 N ALA A 39 -1.767 6.453 6.569 1.00 0.00 N ATOM 570 CA ALA A 39 -0.589 7.294 6.442 1.00 0.00 C ATOM 571 C ALA A 39 -1.008 8.680 5.947 1.00 0.00 C ATOM 572 O ALA A 39 -0.924 9.659 6.687 1.00 0.00 O ATOM 573 CB ALA A 39 0.419 6.622 5.508 1.00 0.00 C ATOM 0 H ALA A 39 -1.745 5.601 6.008 1.00 0.00 H new ATOM 0 HA ALA A 39 -0.103 7.422 7.409 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.303 7.253 5.412 1.00 0.00 H new ATOM 0 HB2 ALA A 39 0.706 5.654 5.919 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.033 6.480 4.526 1.00 0.00 H new ATOM 579 N GLY A 40 -1.452 8.718 4.699 1.00 0.00 N ATOM 580 CA GLY A 40 -1.884 9.968 4.097 1.00 0.00 C ATOM 581 C GLY A 40 -3.036 10.589 4.890 1.00 0.00 C ATOM 582 O GLY A 40 -2.860 11.615 5.546 1.00 0.00 O ATOM 0 H GLY A 40 -1.522 7.904 4.089 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.047 10.665 4.058 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.199 9.791 3.069 1.00 0.00 H new ATOM 586 N TYR A 41 -4.188 9.942 4.804 1.00 0.00 N ATOM 587 CA TYR A 41 -5.369 10.417 5.505 1.00 0.00 C ATOM 588 C TYR A 41 -5.020 10.861 6.927 1.00 0.00 C ATOM 589 O TYR A 41 -5.273 12.004 7.304 1.00 0.00 O ATOM 590 CB TYR A 41 -6.326 9.226 5.576 1.00 0.00 C ATOM 591 CG TYR A 41 -7.805 9.617 5.610 1.00 0.00 C ATOM 592 CD1 TYR A 41 -8.355 10.327 4.562 1.00 0.00 C ATOM 593 CD2 TYR A 41 -8.589 9.260 6.688 1.00 0.00 C ATOM 594 CE1 TYR A 41 -9.746 10.696 4.593 1.00 0.00 C ATOM 595 CE2 TYR A 41 -9.980 9.629 6.720 1.00 0.00 C ATOM 596 CZ TYR A 41 -10.491 10.328 5.671 1.00 0.00 C ATOM 597 OH TYR A 41 -11.805 10.676 5.701 1.00 0.00 O ATOM 0 H TYR A 41 -4.329 9.092 4.259 1.00 0.00 H new ATOM 0 HA TYR A 41 -5.804 11.272 4.988 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -6.151 8.581 4.715 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -6.095 8.640 6.466 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -7.741 10.606 3.718 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -8.159 8.704 7.508 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -10.188 11.252 3.780 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -10.604 9.357 7.558 1.00 0.00 H new ATOM 0 HH TYR A 41 -12.212 10.346 6.529 1.00 0.00 H new ATOM 607 N GLY A 42 -4.443 9.934 7.678 1.00 0.00 N ATOM 608 CA GLY A 42 -4.057 10.215 9.050 1.00 0.00 C ATOM 609 C GLY A 42 -3.249 11.511 9.137 1.00 0.00 C ATOM 610 O GLY A 42 -3.585 12.406 9.912 1.00 0.00 O ATOM 0 H GLY A 42 -4.234 8.987 7.362 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.948 10.295 9.673 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.467 9.387 9.442 1.00 0.00 H new ATOM 614 N ALA A 43 -2.199 11.572 8.332 1.00 0.00 N ATOM 615 CA ALA A 43 -1.340 12.744 8.308 1.00 0.00 C ATOM 616 C ALA A 43 -2.192 13.990 8.065 1.00 0.00 C ATOM 617 O ALA A 43 -1.867 15.073 8.549 1.00 0.00 O ATOM 618 CB ALA A 43 -0.256 12.561 7.244 1.00 0.00 C ATOM 0 H ALA A 43 -1.923 10.828 7.691 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.837 12.871 9.267 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.388 13.440 7.226 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.340 11.679 7.480 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -0.723 12.433 6.267 1.00 0.00 H new ATOM 624 N TYR A 44 -3.267 13.796 7.314 1.00 0.00 N ATOM 625 CA TYR A 44 -4.169 14.891 7.001 1.00 0.00 C ATOM 626 C TYR A 44 -5.093 15.196 8.181 1.00 0.00 C ATOM 627 O TYR A 44 -5.514 16.336 8.367 1.00 0.00 O ATOM 628 CB TYR A 44 -5.013 14.417 5.816 1.00 0.00 C ATOM 629 CG TYR A 44 -5.574 15.552 4.958 1.00 0.00 C ATOM 630 CD1 TYR A 44 -4.720 16.347 4.221 1.00 0.00 C ATOM 631 CD2 TYR A 44 -6.935 15.781 4.921 1.00 0.00 C ATOM 632 CE1 TYR A 44 -5.249 17.415 3.413 1.00 0.00 C ATOM 633 CE2 TYR A 44 -7.463 16.850 4.113 1.00 0.00 C ATOM 634 CZ TYR A 44 -6.594 17.614 3.399 1.00 0.00 C ATOM 635 OH TYR A 44 -7.093 18.623 2.636 1.00 0.00 O ATOM 0 H TYR A 44 -3.533 12.897 6.913 1.00 0.00 H new ATOM 0 HA TYR A 44 -3.607 15.798 6.778 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -4.405 13.767 5.187 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -5.841 13.815 6.191 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -3.655 16.168 4.250 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -7.603 15.159 5.498 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -4.592 18.044 2.831 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -8.525 17.040 4.075 1.00 0.00 H new ATOM 0 HH TYR A 44 -8.069 18.646 2.722 1.00 0.00 H new ATOM 645 N ARG A 45 -5.383 14.155 8.948 1.00 0.00 N ATOM 646 CA ARG A 45 -6.250 14.296 10.105 1.00 0.00 C ATOM 647 C ARG A 45 -5.458 14.833 11.300 1.00 0.00 C ATOM 648 O ARG A 45 -5.838 15.837 11.900 1.00 0.00 O ATOM 649 CB ARG A 45 -6.886 12.957 10.484 1.00 0.00 C ATOM 650 CG ARG A 45 -8.413 13.051 10.467 1.00 0.00 C ATOM 651 CD ARG A 45 -9.017 12.391 11.709 1.00 0.00 C ATOM 652 NE ARG A 45 -10.477 12.224 11.534 1.00 0.00 N ATOM 653 CZ ARG A 45 -11.306 11.806 12.499 1.00 0.00 C ATOM 654 NH1 ARG A 45 -10.825 11.510 13.714 1.00 0.00 N ATOM 655 NH2 ARG A 45 -12.617 11.684 12.250 1.00 0.00 N ATOM 0 H ARG A 45 -5.033 13.210 8.790 1.00 0.00 H new ATOM 0 HA ARG A 45 -7.040 14.999 9.843 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -6.558 12.185 9.788 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -6.548 12.657 11.476 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -8.716 14.097 10.423 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -8.801 12.569 9.570 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -8.550 11.421 11.879 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -8.815 13.001 12.590 1.00 0.00 H new ATOM 0 HE ARG A 45 -10.877 12.441 10.621 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -9.827 11.603 13.904 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -11.457 11.192 14.449 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -12.984 11.910 11.325 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -13.248 11.366 12.985 1.00 0.00 H new ATOM 669 N VAL A 46 -4.372 14.140 11.608 1.00 0.00 N ATOM 670 CA VAL A 46 -3.523 14.535 12.720 1.00 0.00 C ATOM 671 C VAL A 46 -2.206 15.092 12.177 1.00 0.00 C ATOM 672 O VAL A 46 -1.137 14.551 12.458 1.00 0.00 O ATOM 673 CB VAL A 46 -3.326 13.353 13.672 1.00 0.00 C ATOM 674 CG1 VAL A 46 -2.486 13.761 14.885 1.00 0.00 C ATOM 675 CG2 VAL A 46 -4.672 12.770 14.108 1.00 0.00 C ATOM 0 H VAL A 46 -4.060 13.308 11.108 1.00 0.00 H new ATOM 0 HA VAL A 46 -3.996 15.327 13.300 1.00 0.00 H new ATOM 0 HB VAL A 46 -2.783 12.576 13.134 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.361 12.903 15.546 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -1.508 14.107 14.551 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -2.990 14.563 15.424 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -4.504 11.932 14.784 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.252 13.538 14.620 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.220 12.425 13.231 1.00 0.00 H new ATOM 685 N SER A 47 -2.325 16.165 11.410 1.00 0.00 N ATOM 686 CA SER A 47 -1.157 16.802 10.826 1.00 0.00 C ATOM 687 C SER A 47 -0.181 17.218 11.929 1.00 0.00 C ATOM 688 O SER A 47 -0.563 17.323 13.093 1.00 0.00 O ATOM 689 CB SER A 47 -1.554 18.015 9.983 1.00 0.00 C ATOM 690 OG SER A 47 -2.191 19.023 10.765 1.00 0.00 O ATOM 0 H SER A 47 -3.213 16.610 11.179 1.00 0.00 H new ATOM 0 HA SER A 47 -0.668 16.082 10.169 1.00 0.00 H new ATOM 0 HB2 SER A 47 -0.666 18.432 9.507 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.225 17.698 9.184 1.00 0.00 H new ATOM 0 HG SER A 47 -2.428 19.781 10.191 1.00 0.00 H new ATOM 696 N ASN A 48 1.060 17.442 11.523 1.00 0.00 N ATOM 697 CA ASN A 48 2.093 17.844 12.462 1.00 0.00 C ATOM 698 C ASN A 48 3.410 18.046 11.709 1.00 0.00 C ATOM 699 O ASN A 48 4.168 18.966 12.014 1.00 0.00 O ATOM 700 CB ASN A 48 2.318 16.769 13.527 1.00 0.00 C ATOM 701 CG ASN A 48 3.053 17.344 14.740 1.00 0.00 C ATOM 702 OD1 ASN A 48 4.135 17.897 14.637 1.00 0.00 O ATOM 703 ND2 ASN A 48 2.407 17.181 15.891 1.00 0.00 N ATOM 0 H ASN A 48 1.373 17.353 10.556 1.00 0.00 H new ATOM 0 HA ASN A 48 1.770 18.767 12.944 1.00 0.00 H new ATOM 0 HB2 ASN A 48 1.359 16.356 13.840 1.00 0.00 H new ATOM 0 HB3 ASN A 48 2.895 15.947 13.103 1.00 0.00 H new ATOM 0 HD21 ASN A 48 2.815 17.529 16.759 1.00 0.00 H new ATOM 0 HD22 ASN A 48 1.503 16.708 15.906 1.00 0.00 H new ATOM 710 N ASP A 49 3.641 17.172 10.741 1.00 0.00 N ATOM 711 CA ASP A 49 4.853 17.243 9.942 1.00 0.00 C ATOM 712 C ASP A 49 4.739 16.275 8.763 1.00 0.00 C ATOM 713 O ASP A 49 4.626 16.700 7.615 1.00 0.00 O ATOM 714 CB ASP A 49 6.079 16.844 10.765 1.00 0.00 C ATOM 715 CG ASP A 49 7.255 17.820 10.689 1.00 0.00 C ATOM 716 OD1 ASP A 49 7.241 18.776 9.900 1.00 0.00 O ATOM 717 OD2 ASP A 49 8.229 17.564 11.495 1.00 0.00 O ATOM 0 H ASP A 49 3.010 16.411 10.492 1.00 0.00 H new ATOM 0 HA ASP A 49 4.970 18.270 9.596 1.00 0.00 H new ATOM 0 HB2 ASP A 49 5.780 16.740 11.808 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.418 15.863 10.431 1.00 0.00 H new ATOM 722 N LYS A 50 4.772 14.991 9.088 1.00 0.00 N ATOM 723 CA LYS A 50 4.674 13.959 8.070 1.00 0.00 C ATOM 724 C LYS A 50 5.489 14.378 6.845 1.00 0.00 C ATOM 725 O LYS A 50 6.467 15.114 6.967 1.00 0.00 O ATOM 726 CB LYS A 50 3.208 13.651 7.758 1.00 0.00 C ATOM 727 CG LYS A 50 2.982 12.144 7.619 1.00 0.00 C ATOM 728 CD LYS A 50 2.640 11.514 8.970 1.00 0.00 C ATOM 729 CE LYS A 50 3.808 10.677 9.495 1.00 0.00 C ATOM 730 NZ LYS A 50 3.323 9.378 10.015 1.00 0.00 N ATOM 0 H LYS A 50 4.865 14.642 10.042 1.00 0.00 H new ATOM 0 HA LYS A 50 5.101 13.024 8.433 1.00 0.00 H new ATOM 0 HB2 LYS A 50 2.573 14.046 8.551 1.00 0.00 H new ATOM 0 HB3 LYS A 50 2.916 14.153 6.836 1.00 0.00 H new ATOM 0 HG2 LYS A 50 2.174 11.958 6.912 1.00 0.00 H new ATOM 0 HG3 LYS A 50 3.877 11.675 7.211 1.00 0.00 H new ATOM 0 HD2 LYS A 50 2.396 12.296 9.689 1.00 0.00 H new ATOM 0 HD3 LYS A 50 1.754 10.887 8.869 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.530 10.509 8.696 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.327 11.221 10.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.129 8.823 10.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.651 9.544 10.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.848 8.854 9.252 1.00 0.00 H new ATOM 744 N ARG A 51 5.055 13.892 5.691 1.00 0.00 N ATOM 745 CA ARG A 51 5.732 14.207 4.444 1.00 0.00 C ATOM 746 C ARG A 51 4.967 13.612 3.260 1.00 0.00 C ATOM 747 O ARG A 51 4.952 12.396 3.074 1.00 0.00 O ATOM 748 CB ARG A 51 7.163 13.665 4.442 1.00 0.00 C ATOM 749 CG ARG A 51 8.180 14.805 4.359 1.00 0.00 C ATOM 750 CD ARG A 51 9.065 14.843 5.607 1.00 0.00 C ATOM 751 NE ARG A 51 10.397 15.390 5.267 1.00 0.00 N ATOM 752 CZ ARG A 51 10.668 16.699 5.166 1.00 0.00 C ATOM 753 NH1 ARG A 51 9.700 17.602 5.379 1.00 0.00 N ATOM 754 NH2 ARG A 51 11.905 17.105 4.853 1.00 0.00 N ATOM 0 H ARG A 51 4.243 13.282 5.593 1.00 0.00 H new ATOM 0 HA ARG A 51 5.767 15.292 4.350 1.00 0.00 H new ATOM 0 HB2 ARG A 51 7.337 13.083 5.347 1.00 0.00 H new ATOM 0 HB3 ARG A 51 7.299 12.989 3.598 1.00 0.00 H new ATOM 0 HG2 ARG A 51 8.801 14.679 3.472 1.00 0.00 H new ATOM 0 HG3 ARG A 51 7.658 15.756 4.250 1.00 0.00 H new ATOM 0 HD2 ARG A 51 8.596 15.457 6.376 1.00 0.00 H new ATOM 0 HD3 ARG A 51 9.169 13.839 6.019 1.00 0.00 H new ATOM 0 HE ARG A 51 11.156 14.730 5.099 1.00 0.00 H new ATOM 0 HH11 ARG A 51 8.758 17.293 5.618 1.00 0.00 H new ATOM 0 HH12 ARG A 51 9.906 18.598 5.302 1.00 0.00 H new ATOM 0 HH21 ARG A 51 12.642 16.418 4.691 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.111 18.101 4.776 1.00 0.00 H new ATOM 768 N ASP A 52 4.351 14.496 2.490 1.00 0.00 N ATOM 769 CA ASP A 52 3.587 14.074 1.329 1.00 0.00 C ATOM 770 C ASP A 52 4.446 13.145 0.468 1.00 0.00 C ATOM 771 O ASP A 52 5.627 13.411 0.250 1.00 0.00 O ATOM 772 CB ASP A 52 3.181 15.273 0.470 1.00 0.00 C ATOM 773 CG ASP A 52 1.678 15.558 0.425 1.00 0.00 C ATOM 774 OD1 ASP A 52 1.166 15.959 1.539 1.00 0.00 O ATOM 775 OD2 ASP A 52 1.030 15.404 -0.621 1.00 0.00 O ATOM 0 H ASP A 52 4.365 15.504 2.648 1.00 0.00 H new ATOM 0 HA ASP A 52 2.691 13.564 1.683 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.692 16.159 0.845 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.535 15.108 -0.548 1.00 0.00 H new ATOM 780 N VAL A 53 3.819 12.075 0.002 1.00 0.00 N ATOM 781 CA VAL A 53 4.511 11.105 -0.829 1.00 0.00 C ATOM 782 C VAL A 53 5.556 10.370 0.013 1.00 0.00 C ATOM 783 O VAL A 53 5.409 9.181 0.290 1.00 0.00 O ATOM 784 CB VAL A 53 5.111 11.800 -2.054 1.00 0.00 C ATOM 785 CG1 VAL A 53 5.706 10.780 -3.026 1.00 0.00 C ATOM 786 CG2 VAL A 53 4.071 12.680 -2.750 1.00 0.00 C ATOM 0 H VAL A 53 2.839 11.859 0.184 1.00 0.00 H new ATOM 0 HA VAL A 53 3.813 10.357 -1.205 1.00 0.00 H new ATOM 0 HB VAL A 53 5.919 12.446 -1.710 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.125 11.300 -3.887 1.00 0.00 H new ATOM 0 HG12 VAL A 53 6.492 10.215 -2.525 1.00 0.00 H new ATOM 0 HG13 VAL A 53 4.925 10.097 -3.360 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.524 13.162 -3.617 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.232 12.064 -3.074 1.00 0.00 H new ATOM 0 HG23 VAL A 53 3.716 13.442 -2.056 1.00 0.00 H new ATOM 796 N LYS A 54 6.587 11.109 0.396 1.00 0.00 N ATOM 797 CA LYS A 54 7.655 10.542 1.201 1.00 0.00 C ATOM 798 C LYS A 54 7.054 9.613 2.257 1.00 0.00 C ATOM 799 O LYS A 54 7.540 8.501 2.460 1.00 0.00 O ATOM 800 CB LYS A 54 8.532 11.652 1.785 1.00 0.00 C ATOM 801 CG LYS A 54 9.842 11.784 1.005 1.00 0.00 C ATOM 802 CD LYS A 54 9.729 12.858 -0.078 1.00 0.00 C ATOM 803 CE LYS A 54 9.860 12.244 -1.474 1.00 0.00 C ATOM 804 NZ LYS A 54 10.121 13.297 -2.480 1.00 0.00 N ATOM 0 H LYS A 54 6.705 12.095 0.164 1.00 0.00 H new ATOM 0 HA LYS A 54 8.317 9.936 0.583 1.00 0.00 H new ATOM 0 HB2 LYS A 54 7.992 12.599 1.759 1.00 0.00 H new ATOM 0 HB3 LYS A 54 8.748 11.437 2.832 1.00 0.00 H new ATOM 0 HG2 LYS A 54 10.653 12.036 1.689 1.00 0.00 H new ATOM 0 HG3 LYS A 54 10.096 10.827 0.548 1.00 0.00 H new ATOM 0 HD2 LYS A 54 8.770 13.369 0.010 1.00 0.00 H new ATOM 0 HD3 LYS A 54 10.505 13.609 0.067 1.00 0.00 H new ATOM 0 HE2 LYS A 54 10.671 11.515 -1.483 1.00 0.00 H new ATOM 0 HE3 LYS A 54 8.946 11.707 -1.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 10.207 12.864 -3.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 9.334 13.977 -2.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 11.005 13.791 -2.244 1.00 0.00 H new ATOM 818 N VAL A 55 6.006 10.103 2.903 1.00 0.00 N ATOM 819 CA VAL A 55 5.333 9.330 3.933 1.00 0.00 C ATOM 820 C VAL A 55 5.196 7.879 3.469 1.00 0.00 C ATOM 821 O VAL A 55 5.659 6.961 4.144 1.00 0.00 O ATOM 822 CB VAL A 55 3.991 9.977 4.280 1.00 0.00 C ATOM 823 CG1 VAL A 55 3.150 10.203 3.021 1.00 0.00 C ATOM 824 CG2 VAL A 55 3.227 9.138 5.306 1.00 0.00 C ATOM 0 H VAL A 55 5.606 11.026 2.733 1.00 0.00 H new ATOM 0 HA VAL A 55 5.921 9.323 4.850 1.00 0.00 H new ATOM 0 HB VAL A 55 4.194 10.950 4.727 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.201 10.664 3.295 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.688 10.859 2.337 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.961 9.247 2.533 1.00 0.00 H new ATOM 0 HG21 VAL A 55 2.277 9.620 5.535 1.00 0.00 H new ATOM 0 HG22 VAL A 55 3.041 8.145 4.898 1.00 0.00 H new ATOM 0 HG23 VAL A 55 3.819 9.050 6.217 1.00 0.00 H new ATOM 834 N SER A 56 4.558 7.717 2.319 1.00 0.00 N ATOM 835 CA SER A 56 4.353 6.394 1.756 1.00 0.00 C ATOM 836 C SER A 56 5.669 5.612 1.765 1.00 0.00 C ATOM 837 O SER A 56 5.698 4.443 2.145 1.00 0.00 O ATOM 838 CB SER A 56 3.797 6.480 0.334 1.00 0.00 C ATOM 839 OG SER A 56 2.983 5.356 0.010 1.00 0.00 O ATOM 0 H SER A 56 4.176 8.481 1.762 1.00 0.00 H new ATOM 0 HA SER A 56 3.622 5.870 2.372 1.00 0.00 H new ATOM 0 HB2 SER A 56 3.212 7.394 0.228 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.623 6.546 -0.375 1.00 0.00 H new ATOM 0 HG SER A 56 2.646 5.449 -0.905 1.00 0.00 H new ATOM 845 N LEU A 57 6.726 6.291 1.342 1.00 0.00 N ATOM 846 CA LEU A 57 8.041 5.675 1.297 1.00 0.00 C ATOM 847 C LEU A 57 8.394 5.134 2.684 1.00 0.00 C ATOM 848 O LEU A 57 8.944 4.040 2.806 1.00 0.00 O ATOM 849 CB LEU A 57 9.073 6.656 0.738 1.00 0.00 C ATOM 850 CG LEU A 57 9.835 6.193 -0.505 1.00 0.00 C ATOM 851 CD1 LEU A 57 10.687 4.960 -0.198 1.00 0.00 C ATOM 852 CD2 LEU A 57 8.880 5.953 -1.676 1.00 0.00 C ATOM 0 H LEU A 57 6.698 7.261 1.028 1.00 0.00 H new ATOM 0 HA LEU A 57 8.041 4.825 0.614 1.00 0.00 H new ATOM 0 HB2 LEU A 57 8.565 7.591 0.501 1.00 0.00 H new ATOM 0 HB3 LEU A 57 9.797 6.877 1.522 1.00 0.00 H new ATOM 0 HG LEU A 57 10.517 6.989 -0.804 1.00 0.00 H new ATOM 0 HD11 LEU A 57 11.218 4.651 -1.098 1.00 0.00 H new ATOM 0 HD12 LEU A 57 11.407 5.201 0.584 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.043 4.148 0.140 1.00 0.00 H new ATOM 0 HD21 LEU A 57 9.447 5.625 -2.547 1.00 0.00 H new ATOM 0 HD22 LEU A 57 8.156 5.185 -1.404 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.355 6.878 -1.913 1.00 0.00 H new ATOM 864 N PHE A 58 8.065 5.926 3.694 1.00 0.00 N ATOM 865 CA PHE A 58 8.340 5.540 5.068 1.00 0.00 C ATOM 866 C PHE A 58 7.372 4.452 5.536 1.00 0.00 C ATOM 867 O PHE A 58 7.666 3.720 6.480 1.00 0.00 O ATOM 868 CB PHE A 58 8.143 6.788 5.931 1.00 0.00 C ATOM 869 CG PHE A 58 9.373 7.695 6.004 1.00 0.00 C ATOM 870 CD1 PHE A 58 9.924 8.186 4.861 1.00 0.00 C ATOM 871 CD2 PHE A 58 9.915 8.010 7.210 1.00 0.00 C ATOM 872 CE1 PHE A 58 11.066 9.028 4.929 1.00 0.00 C ATOM 873 CE2 PHE A 58 11.056 8.852 7.278 1.00 0.00 C ATOM 874 CZ PHE A 58 11.608 9.343 6.136 1.00 0.00 C ATOM 0 H PHE A 58 7.611 6.833 3.589 1.00 0.00 H new ATOM 0 HA PHE A 58 9.353 5.146 5.148 1.00 0.00 H new ATOM 0 HB2 PHE A 58 7.304 7.362 5.536 1.00 0.00 H new ATOM 0 HB3 PHE A 58 7.871 6.480 6.941 1.00 0.00 H new ATOM 0 HD1 PHE A 58 9.493 7.936 3.903 1.00 0.00 H new ATOM 0 HD2 PHE A 58 9.477 7.620 8.117 1.00 0.00 H new ATOM 0 HE1 PHE A 58 11.504 9.418 4.022 1.00 0.00 H new ATOM 0 HE2 PHE A 58 11.486 9.103 8.237 1.00 0.00 H new ATOM 0 HZ PHE A 58 12.477 9.983 6.188 1.00 0.00 H new ATOM 884 N THR A 59 6.238 4.380 4.855 1.00 0.00 N ATOM 885 CA THR A 59 5.226 3.393 5.190 1.00 0.00 C ATOM 886 C THR A 59 5.661 2.002 4.725 1.00 0.00 C ATOM 887 O THR A 59 5.673 1.056 5.510 1.00 0.00 O ATOM 888 CB THR A 59 3.900 3.851 4.579 1.00 0.00 C ATOM 889 OG1 THR A 59 3.481 4.922 5.420 1.00 0.00 O ATOM 890 CG2 THR A 59 2.793 2.804 4.730 1.00 0.00 C ATOM 0 H THR A 59 5.998 4.989 4.073 1.00 0.00 H new ATOM 0 HA THR A 59 5.094 3.313 6.269 1.00 0.00 H new ATOM 0 HB THR A 59 4.046 4.076 3.522 1.00 0.00 H new ATOM 0 HG1 THR A 59 4.018 5.719 5.227 1.00 0.00 H new ATOM 0 HG21 THR A 59 1.874 3.179 4.280 1.00 0.00 H new ATOM 0 HG22 THR A 59 3.093 1.883 4.230 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.623 2.604 5.788 1.00 0.00 H new ATOM 898 N ALA A 60 6.010 1.922 3.449 1.00 0.00 N ATOM 899 CA ALA A 60 6.445 0.663 2.869 1.00 0.00 C ATOM 900 C ALA A 60 7.823 0.300 3.426 1.00 0.00 C ATOM 901 O ALA A 60 8.145 -0.877 3.578 1.00 0.00 O ATOM 902 CB ALA A 60 6.444 0.776 1.344 1.00 0.00 C ATOM 0 H ALA A 60 6.000 2.709 2.801 1.00 0.00 H new ATOM 0 HA ALA A 60 5.759 -0.141 3.136 1.00 0.00 H new ATOM 0 HB1 ALA A 60 6.770 -0.169 0.909 1.00 0.00 H new ATOM 0 HB2 ALA A 60 5.437 1.007 0.997 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.124 1.571 1.038 1.00 0.00 H new ATOM 908 N PHE A 61 8.601 1.334 3.715 1.00 0.00 N ATOM 909 CA PHE A 61 9.937 1.138 4.251 1.00 0.00 C ATOM 910 C PHE A 61 9.882 0.488 5.635 1.00 0.00 C ATOM 911 O PHE A 61 10.529 -0.531 5.872 1.00 0.00 O ATOM 912 CB PHE A 61 10.575 2.523 4.376 1.00 0.00 C ATOM 913 CG PHE A 61 11.893 2.533 5.153 1.00 0.00 C ATOM 914 CD1 PHE A 61 13.065 2.282 4.509 1.00 0.00 C ATOM 915 CD2 PHE A 61 11.893 2.792 6.488 1.00 0.00 C ATOM 916 CE1 PHE A 61 14.287 2.291 5.231 1.00 0.00 C ATOM 917 CE2 PHE A 61 13.116 2.800 7.210 1.00 0.00 C ATOM 918 CZ PHE A 61 14.288 2.550 6.566 1.00 0.00 C ATOM 0 H PHE A 61 8.331 2.309 3.588 1.00 0.00 H new ATOM 0 HA PHE A 61 10.510 0.483 3.594 1.00 0.00 H new ATOM 0 HB2 PHE A 61 10.751 2.922 3.377 1.00 0.00 H new ATOM 0 HB3 PHE A 61 9.870 3.193 4.868 1.00 0.00 H new ATOM 0 HD1 PHE A 61 13.065 2.076 3.449 1.00 0.00 H new ATOM 0 HD2 PHE A 61 10.963 2.992 6.999 1.00 0.00 H new ATOM 0 HE1 PHE A 61 15.217 2.092 4.720 1.00 0.00 H new ATOM 0 HE2 PHE A 61 13.116 3.005 8.270 1.00 0.00 H new ATOM 0 HZ PHE A 61 15.218 2.557 7.114 1.00 0.00 H new ATOM 928 N PHE A 62 9.104 1.104 6.513 1.00 0.00 N ATOM 929 CA PHE A 62 8.957 0.598 7.867 1.00 0.00 C ATOM 930 C PHE A 62 8.316 -0.791 7.866 1.00 0.00 C ATOM 931 O PHE A 62 8.774 -1.691 8.569 1.00 0.00 O ATOM 932 CB PHE A 62 8.039 1.570 8.610 1.00 0.00 C ATOM 933 CG PHE A 62 8.182 1.521 10.133 1.00 0.00 C ATOM 934 CD1 PHE A 62 9.334 1.939 10.721 1.00 0.00 C ATOM 935 CD2 PHE A 62 7.156 1.059 10.898 1.00 0.00 C ATOM 936 CE1 PHE A 62 9.468 1.893 12.134 1.00 0.00 C ATOM 937 CE2 PHE A 62 7.289 1.013 12.311 1.00 0.00 C ATOM 938 CZ PHE A 62 8.442 1.431 12.899 1.00 0.00 C ATOM 0 H PHE A 62 8.569 1.949 6.313 1.00 0.00 H new ATOM 0 HA PHE A 62 9.934 0.517 8.343 1.00 0.00 H new ATOM 0 HB2 PHE A 62 8.248 2.584 8.268 1.00 0.00 H new ATOM 0 HB3 PHE A 62 7.005 1.351 8.345 1.00 0.00 H new ATOM 0 HD1 PHE A 62 10.148 2.306 10.113 1.00 0.00 H new ATOM 0 HD2 PHE A 62 6.241 0.727 10.431 1.00 0.00 H new ATOM 0 HE1 PHE A 62 10.384 2.224 12.601 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.475 0.646 12.919 1.00 0.00 H new ATOM 0 HZ PHE A 62 8.543 1.396 13.974 1.00 0.00 H new ATOM 948 N LEU A 63 7.265 -0.923 7.070 1.00 0.00 N ATOM 949 CA LEU A 63 6.556 -2.187 6.969 1.00 0.00 C ATOM 950 C LEU A 63 7.549 -3.296 6.613 1.00 0.00 C ATOM 951 O LEU A 63 7.689 -4.269 7.353 1.00 0.00 O ATOM 952 CB LEU A 63 5.388 -2.070 5.987 1.00 0.00 C ATOM 953 CG LEU A 63 4.148 -2.903 6.318 1.00 0.00 C ATOM 954 CD1 LEU A 63 2.869 -2.088 6.112 1.00 0.00 C ATOM 955 CD2 LEU A 63 4.133 -4.205 5.516 1.00 0.00 C ATOM 0 H LEU A 63 6.887 -0.175 6.489 1.00 0.00 H new ATOM 0 HA LEU A 63 6.111 -2.452 7.928 1.00 0.00 H new ATOM 0 HB2 LEU A 63 5.093 -1.022 5.928 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.741 -2.358 4.997 1.00 0.00 H new ATOM 0 HG LEU A 63 4.190 -3.175 7.373 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.002 -2.703 6.354 1.00 0.00 H new ATOM 0 HD12 LEU A 63 2.886 -1.213 6.762 1.00 0.00 H new ATOM 0 HD13 LEU A 63 2.806 -1.766 5.073 1.00 0.00 H new ATOM 0 HD21 LEU A 63 3.241 -4.778 5.770 1.00 0.00 H new ATOM 0 HD22 LEU A 63 4.126 -3.976 4.450 1.00 0.00 H new ATOM 0 HD23 LEU A 63 5.021 -4.790 5.755 1.00 0.00 H new ATOM 967 N ALA A 64 8.212 -3.112 5.481 1.00 0.00 N ATOM 968 CA ALA A 64 9.187 -4.085 5.019 1.00 0.00 C ATOM 969 C ALA A 64 10.171 -4.391 6.150 1.00 0.00 C ATOM 970 O ALA A 64 10.410 -5.554 6.471 1.00 0.00 O ATOM 971 CB ALA A 64 9.886 -3.552 3.767 1.00 0.00 C ATOM 0 H ALA A 64 8.093 -2.304 4.870 1.00 0.00 H new ATOM 0 HA ALA A 64 8.697 -5.020 4.746 1.00 0.00 H new ATOM 0 HB1 ALA A 64 10.618 -4.282 3.420 1.00 0.00 H new ATOM 0 HB2 ALA A 64 9.148 -3.378 2.984 1.00 0.00 H new ATOM 0 HB3 ALA A 64 10.392 -2.616 4.003 1.00 0.00 H new ATOM 977 N THR A 65 10.715 -3.328 6.723 1.00 0.00 N ATOM 978 CA THR A 65 11.667 -3.468 7.811 1.00 0.00 C ATOM 979 C THR A 65 11.062 -4.297 8.945 1.00 0.00 C ATOM 980 O THR A 65 11.778 -5.009 9.649 1.00 0.00 O ATOM 981 CB THR A 65 12.099 -2.066 8.246 1.00 0.00 C ATOM 982 OG1 THR A 65 13.014 -1.655 7.234 1.00 0.00 O ATOM 983 CG2 THR A 65 12.939 -2.082 9.524 1.00 0.00 C ATOM 0 H THR A 65 10.514 -2.365 6.454 1.00 0.00 H new ATOM 0 HA THR A 65 12.556 -4.012 7.491 1.00 0.00 H new ATOM 0 HB THR A 65 11.216 -1.446 8.400 1.00 0.00 H new ATOM 0 HG1 THR A 65 12.527 -1.193 6.520 1.00 0.00 H new ATOM 0 HG21 THR A 65 13.219 -1.062 9.788 1.00 0.00 H new ATOM 0 HG22 THR A 65 12.358 -2.521 10.336 1.00 0.00 H new ATOM 0 HG23 THR A 65 13.839 -2.674 9.360 1.00 0.00 H new ATOM 991 N ILE A 66 9.750 -4.178 9.088 1.00 0.00 N ATOM 992 CA ILE A 66 9.041 -4.907 10.125 1.00 0.00 C ATOM 993 C ILE A 66 8.900 -6.372 9.707 1.00 0.00 C ATOM 994 O ILE A 66 8.858 -7.262 10.555 1.00 0.00 O ATOM 995 CB ILE A 66 7.707 -4.227 10.442 1.00 0.00 C ATOM 996 CG1 ILE A 66 7.929 -2.828 11.019 1.00 0.00 C ATOM 997 CG2 ILE A 66 6.853 -5.099 11.364 1.00 0.00 C ATOM 998 CD1 ILE A 66 6.777 -1.892 10.645 1.00 0.00 C ATOM 0 H ILE A 66 9.160 -3.587 8.502 1.00 0.00 H new ATOM 0 HA ILE A 66 9.608 -4.894 11.056 1.00 0.00 H new ATOM 0 HB ILE A 66 7.154 -4.107 9.510 1.00 0.00 H new ATOM 0 HG12 ILE A 66 8.016 -2.888 12.104 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.869 -2.421 10.645 1.00 0.00 H new ATOM 0 HG21 ILE A 66 5.911 -4.593 11.574 1.00 0.00 H new ATOM 0 HG22 ILE A 66 6.652 -6.054 10.878 1.00 0.00 H new ATOM 0 HG23 ILE A 66 7.387 -5.273 12.298 1.00 0.00 H new ATOM 0 HD11 ILE A 66 6.959 -0.904 11.067 1.00 0.00 H new ATOM 0 HD12 ILE A 66 6.708 -1.816 9.560 1.00 0.00 H new ATOM 0 HD13 ILE A 66 5.842 -2.289 11.041 1.00 0.00 H new ATOM 1010 N MET A 67 8.831 -6.577 8.400 1.00 0.00 N ATOM 1011 CA MET A 67 8.696 -7.919 7.859 1.00 0.00 C ATOM 1012 C MET A 67 10.049 -8.634 7.821 1.00 0.00 C ATOM 1013 O MET A 67 10.193 -9.727 8.365 1.00 0.00 O ATOM 1014 CB MET A 67 8.119 -7.844 6.444 1.00 0.00 C ATOM 1015 CG MET A 67 6.915 -8.776 6.293 1.00 0.00 C ATOM 1016 SD MET A 67 7.459 -10.398 5.784 1.00 0.00 S ATOM 1017 CE MET A 67 6.082 -11.380 6.353 1.00 0.00 C ATOM 0 H MET A 67 8.866 -5.836 7.700 1.00 0.00 H new ATOM 0 HA MET A 67 8.025 -8.485 8.505 1.00 0.00 H new ATOM 0 HB2 MET A 67 7.820 -6.819 6.223 1.00 0.00 H new ATOM 0 HB3 MET A 67 8.887 -8.115 5.719 1.00 0.00 H new ATOM 0 HG2 MET A 67 6.376 -8.844 7.238 1.00 0.00 H new ATOM 0 HG3 MET A 67 6.220 -8.369 5.559 1.00 0.00 H new ATOM 0 HE1 MET A 67 6.259 -12.428 6.114 1.00 0.00 H new ATOM 0 HE2 MET A 67 5.976 -11.267 7.432 1.00 0.00 H new ATOM 0 HE3 MET A 67 5.169 -11.045 5.862 1.00 0.00 H new ATOM 1027 N GLY A 68 11.006 -7.986 7.173 1.00 0.00 N ATOM 1028 CA GLY A 68 12.342 -8.546 7.057 1.00 0.00 C ATOM 1029 C GLY A 68 12.513 -9.284 5.728 1.00 0.00 C ATOM 1030 O GLY A 68 12.845 -10.469 5.710 1.00 0.00 O ATOM 0 H GLY A 68 10.883 -7.079 6.723 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.082 -7.749 7.133 1.00 0.00 H new ATOM 0 HA3 GLY A 68 12.526 -9.232 7.884 1.00 0.00 H new ATOM 1034 N VAL A 69 12.280 -8.554 4.647 1.00 0.00 N ATOM 1035 CA VAL A 69 12.405 -9.125 3.317 1.00 0.00 C ATOM 1036 C VAL A 69 13.533 -8.416 2.566 1.00 0.00 C ATOM 1037 O VAL A 69 13.677 -7.197 2.660 1.00 0.00 O ATOM 1038 CB VAL A 69 11.062 -9.050 2.588 1.00 0.00 C ATOM 1039 CG1 VAL A 69 11.214 -9.442 1.117 1.00 0.00 C ATOM 1040 CG2 VAL A 69 10.012 -9.920 3.282 1.00 0.00 C ATOM 0 H VAL A 69 12.005 -7.572 4.665 1.00 0.00 H new ATOM 0 HA VAL A 69 12.669 -10.181 3.378 1.00 0.00 H new ATOM 0 HB VAL A 69 10.718 -8.016 2.625 1.00 0.00 H new ATOM 0 HG11 VAL A 69 10.245 -9.380 0.622 1.00 0.00 H new ATOM 0 HG12 VAL A 69 11.914 -8.763 0.630 1.00 0.00 H new ATOM 0 HG13 VAL A 69 11.591 -10.462 1.049 1.00 0.00 H new ATOM 0 HG21 VAL A 69 9.067 -9.849 2.744 1.00 0.00 H new ATOM 0 HG22 VAL A 69 10.347 -10.957 3.291 1.00 0.00 H new ATOM 0 HG23 VAL A 69 9.873 -9.575 4.307 1.00 0.00 H new ATOM 1050 N ARG A 70 14.305 -9.208 1.837 1.00 0.00 N ATOM 1051 CA ARG A 70 15.417 -8.671 1.071 1.00 0.00 C ATOM 1052 C ARG A 70 14.986 -8.403 -0.373 1.00 0.00 C ATOM 1053 O ARG A 70 13.960 -8.913 -0.823 1.00 0.00 O ATOM 1054 CB ARG A 70 16.603 -9.638 1.070 1.00 0.00 C ATOM 1055 CG ARG A 70 17.730 -9.123 1.968 1.00 0.00 C ATOM 1056 CD ARG A 70 18.299 -10.249 2.833 1.00 0.00 C ATOM 1057 NE ARG A 70 19.734 -10.004 3.103 1.00 0.00 N ATOM 1058 CZ ARG A 70 20.688 -10.017 2.162 1.00 0.00 C ATOM 1059 NH1 ARG A 70 20.366 -10.263 0.885 1.00 0.00 N ATOM 1060 NH2 ARG A 70 21.964 -9.785 2.499 1.00 0.00 N ATOM 0 H ARG A 70 14.183 -10.218 1.760 1.00 0.00 H new ATOM 0 HA ARG A 70 15.724 -7.737 1.542 1.00 0.00 H new ATOM 0 HB2 ARG A 70 16.277 -10.619 1.415 1.00 0.00 H new ATOM 0 HB3 ARG A 70 16.973 -9.765 0.053 1.00 0.00 H new ATOM 0 HG2 ARG A 70 18.523 -8.695 1.354 1.00 0.00 H new ATOM 0 HG3 ARG A 70 17.355 -8.323 2.606 1.00 0.00 H new ATOM 0 HD2 ARG A 70 17.749 -10.311 3.772 1.00 0.00 H new ATOM 0 HD3 ARG A 70 18.174 -11.206 2.327 1.00 0.00 H new ATOM 0 HE ARG A 70 20.014 -9.813 4.065 1.00 0.00 H new ATOM 0 HH11 ARG A 70 19.395 -10.440 0.629 1.00 0.00 H new ATOM 0 HH12 ARG A 70 21.092 -10.273 0.169 1.00 0.00 H new ATOM 0 HH21 ARG A 70 22.209 -9.599 3.471 1.00 0.00 H new ATOM 0 HH22 ARG A 70 22.690 -9.795 1.783 1.00 0.00 H new ATOM 1074 N PHE A 71 15.790 -7.604 -1.058 1.00 0.00 N ATOM 1075 CA PHE A 71 15.504 -7.262 -2.441 1.00 0.00 C ATOM 1076 C PHE A 71 15.891 -8.407 -3.380 1.00 0.00 C ATOM 1077 O PHE A 71 17.056 -8.798 -3.441 1.00 0.00 O ATOM 1078 CB PHE A 71 16.348 -6.032 -2.782 1.00 0.00 C ATOM 1079 CG PHE A 71 15.674 -4.702 -2.441 1.00 0.00 C ATOM 1080 CD1 PHE A 71 15.465 -4.358 -1.142 1.00 0.00 C ATOM 1081 CD2 PHE A 71 15.285 -3.862 -3.438 1.00 0.00 C ATOM 1082 CE1 PHE A 71 14.839 -3.123 -0.827 1.00 0.00 C ATOM 1083 CE2 PHE A 71 14.659 -2.627 -3.122 1.00 0.00 C ATOM 1084 CZ PHE A 71 14.449 -2.284 -1.823 1.00 0.00 C ATOM 0 H PHE A 71 16.640 -7.183 -0.681 1.00 0.00 H new ATOM 0 HA PHE A 71 14.438 -7.071 -2.564 1.00 0.00 H new ATOM 0 HB2 PHE A 71 17.296 -6.095 -2.248 1.00 0.00 H new ATOM 0 HB3 PHE A 71 16.581 -6.047 -3.847 1.00 0.00 H new ATOM 0 HD1 PHE A 71 15.775 -5.024 -0.350 1.00 0.00 H new ATOM 0 HD2 PHE A 71 15.452 -4.134 -4.470 1.00 0.00 H new ATOM 0 HE1 PHE A 71 14.673 -2.850 0.205 1.00 0.00 H new ATOM 0 HE2 PHE A 71 14.350 -1.960 -3.913 1.00 0.00 H new ATOM 0 HZ PHE A 71 13.972 -1.345 -1.583 1.00 0.00 H new ATOM 1094 N LYS A 72 14.892 -8.912 -4.088 1.00 0.00 N ATOM 1095 CA LYS A 72 15.112 -10.004 -5.021 1.00 0.00 C ATOM 1096 C LYS A 72 15.559 -11.247 -4.248 1.00 0.00 C ATOM 1097 O LYS A 72 16.533 -11.199 -3.499 1.00 0.00 O ATOM 1098 CB LYS A 72 16.088 -9.580 -6.121 1.00 0.00 C ATOM 1099 CG LYS A 72 15.724 -10.230 -7.457 1.00 0.00 C ATOM 1100 CD LYS A 72 15.083 -9.214 -8.405 1.00 0.00 C ATOM 1101 CE LYS A 72 16.147 -8.339 -9.071 1.00 0.00 C ATOM 1102 NZ LYS A 72 16.080 -8.471 -10.543 1.00 0.00 N ATOM 0 H LYS A 72 13.927 -8.585 -4.034 1.00 0.00 H new ATOM 0 HA LYS A 72 14.184 -10.262 -5.532 1.00 0.00 H new ATOM 0 HB2 LYS A 72 16.075 -8.495 -6.225 1.00 0.00 H new ATOM 0 HB3 LYS A 72 17.103 -9.862 -5.840 1.00 0.00 H new ATOM 0 HG2 LYS A 72 16.619 -10.648 -7.918 1.00 0.00 H new ATOM 0 HG3 LYS A 72 15.036 -11.058 -7.287 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.507 -9.737 -9.168 1.00 0.00 H new ATOM 0 HD3 LYS A 72 14.384 -8.586 -7.852 1.00 0.00 H new ATOM 0 HE2 LYS A 72 16.000 -7.297 -8.786 1.00 0.00 H new ATOM 0 HE3 LYS A 72 17.137 -8.629 -8.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 16.809 -7.871 -10.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 16.243 -9.463 -10.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 15.141 -8.173 -10.876 1.00 0.00 H new ATOM 1116 N ARG A 73 14.825 -12.330 -4.458 1.00 0.00 N ATOM 1117 CA ARG A 73 15.133 -13.583 -3.790 1.00 0.00 C ATOM 1118 C ARG A 73 14.304 -14.721 -4.388 1.00 0.00 C ATOM 1119 O ARG A 73 14.841 -15.775 -4.724 1.00 0.00 O ATOM 1120 CB ARG A 73 14.852 -13.491 -2.289 1.00 0.00 C ATOM 1121 CG ARG A 73 16.155 -13.409 -1.491 1.00 0.00 C ATOM 1122 CD ARG A 73 16.487 -14.754 -0.844 1.00 0.00 C ATOM 1123 NE ARG A 73 17.947 -14.995 -0.897 1.00 0.00 N ATOM 1124 CZ ARG A 73 18.530 -16.154 -0.563 1.00 0.00 C ATOM 1125 NH1 ARG A 73 17.781 -17.186 -0.149 1.00 0.00 N ATOM 1126 NH2 ARG A 73 19.861 -16.282 -0.642 1.00 0.00 N ATOM 0 H ARG A 73 14.018 -12.366 -5.081 1.00 0.00 H new ATOM 0 HA ARG A 73 16.194 -13.785 -3.938 1.00 0.00 H new ATOM 0 HB2 ARG A 73 14.240 -12.613 -2.083 1.00 0.00 H new ATOM 0 HB3 ARG A 73 14.279 -14.361 -1.969 1.00 0.00 H new ATOM 0 HG2 ARG A 73 16.970 -13.107 -2.149 1.00 0.00 H new ATOM 0 HG3 ARG A 73 16.066 -12.643 -0.721 1.00 0.00 H new ATOM 0 HD2 ARG A 73 16.146 -14.763 0.191 1.00 0.00 H new ATOM 0 HD3 ARG A 73 15.959 -15.556 -1.360 1.00 0.00 H new ATOM 0 HE ARG A 73 18.547 -14.230 -1.207 1.00 0.00 H new ATOM 0 HH11 ARG A 73 16.767 -17.089 -0.088 1.00 0.00 H new ATOM 0 HH12 ARG A 73 18.225 -18.069 0.105 1.00 0.00 H new ATOM 0 HH21 ARG A 73 20.431 -15.497 -0.957 1.00 0.00 H new ATOM 0 HH22 ARG A 73 20.304 -17.165 -0.388 1.00 0.00 H new ATOM 1140 N SER A 74 13.008 -14.469 -4.504 1.00 0.00 N ATOM 1141 CA SER A 74 12.099 -15.459 -5.056 1.00 0.00 C ATOM 1142 C SER A 74 11.798 -15.134 -6.520 1.00 0.00 C ATOM 1143 O SER A 74 12.026 -14.013 -6.970 1.00 0.00 O ATOM 1144 CB SER A 74 10.801 -15.526 -4.249 1.00 0.00 C ATOM 1145 OG SER A 74 10.811 -16.598 -3.309 1.00 0.00 O ATOM 0 H SER A 74 12.566 -13.593 -4.225 1.00 0.00 H new ATOM 0 HA SER A 74 12.581 -16.435 -4.999 1.00 0.00 H new ATOM 0 HB2 SER A 74 10.653 -14.583 -3.722 1.00 0.00 H new ATOM 0 HB3 SER A 74 9.957 -15.648 -4.929 1.00 0.00 H new ATOM 0 HG SER A 74 9.966 -16.606 -2.813 1.00 0.00 H new ATOM 1151 N LYS A 75 11.289 -16.136 -7.223 1.00 0.00 N ATOM 1152 CA LYS A 75 10.954 -15.971 -8.627 1.00 0.00 C ATOM 1153 C LYS A 75 9.461 -16.237 -8.825 1.00 0.00 C ATOM 1154 O LYS A 75 8.977 -17.329 -8.529 1.00 0.00 O ATOM 1155 CB LYS A 75 11.856 -16.846 -9.499 1.00 0.00 C ATOM 1156 CG LYS A 75 11.781 -18.312 -9.069 1.00 0.00 C ATOM 1157 CD LYS A 75 13.115 -18.781 -8.485 1.00 0.00 C ATOM 1158 CE LYS A 75 12.943 -20.086 -7.704 1.00 0.00 C ATOM 1159 NZ LYS A 75 13.082 -21.251 -8.606 1.00 0.00 N ATOM 0 H LYS A 75 11.101 -17.065 -6.846 1.00 0.00 H new ATOM 0 HA LYS A 75 11.140 -14.945 -8.945 1.00 0.00 H new ATOM 0 HB2 LYS A 75 11.558 -16.754 -10.543 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.886 -16.495 -9.430 1.00 0.00 H new ATOM 0 HG2 LYS A 75 10.991 -18.437 -8.328 1.00 0.00 H new ATOM 0 HG3 LYS A 75 11.516 -18.933 -9.925 1.00 0.00 H new ATOM 0 HD2 LYS A 75 13.837 -18.926 -9.289 1.00 0.00 H new ATOM 0 HD3 LYS A 75 13.520 -18.011 -7.829 1.00 0.00 H new ATOM 0 HE2 LYS A 75 13.687 -20.142 -6.910 1.00 0.00 H new ATOM 0 HE3 LYS A 75 11.964 -20.104 -7.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 12.963 -22.128 -8.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 12.356 -21.204 -9.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 14.026 -21.241 -9.043 1.00 0.00 H new ATOM 1173 N LYS A 76 8.772 -15.221 -9.324 1.00 0.00 N ATOM 1174 CA LYS A 76 7.344 -15.332 -9.565 1.00 0.00 C ATOM 1175 C LYS A 76 6.610 -15.417 -8.226 1.00 0.00 C ATOM 1176 O LYS A 76 5.859 -14.512 -7.866 1.00 0.00 O ATOM 1177 CB LYS A 76 7.048 -16.504 -10.504 1.00 0.00 C ATOM 1178 CG LYS A 76 7.686 -16.280 -11.877 1.00 0.00 C ATOM 1179 CD LYS A 76 9.050 -16.966 -11.966 1.00 0.00 C ATOM 1180 CE LYS A 76 10.103 -16.019 -12.545 1.00 0.00 C ATOM 1181 NZ LYS A 76 11.110 -16.776 -13.323 1.00 0.00 N ATOM 0 H LYS A 76 9.177 -14.317 -9.568 1.00 0.00 H new ATOM 0 HA LYS A 76 6.974 -14.443 -10.076 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.428 -17.428 -10.069 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.970 -16.623 -10.615 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.028 -16.668 -12.655 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.800 -15.211 -12.059 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.360 -17.298 -10.975 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.973 -17.856 -12.591 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.622 -15.279 -13.184 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.593 -15.474 -11.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 11.817 -16.118 -13.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 11.581 -17.466 -12.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.640 -17.277 -14.104 1.00 0.00 H new ATOM 1195 N ILE A 77 6.852 -16.515 -7.523 1.00 0.00 N ATOM 1196 CA ILE A 77 6.223 -16.730 -6.231 1.00 0.00 C ATOM 1197 C ILE A 77 6.823 -15.762 -5.209 1.00 0.00 C ATOM 1198 O ILE A 77 7.449 -16.186 -4.240 1.00 0.00 O ATOM 1199 CB ILE A 77 6.331 -18.200 -5.821 1.00 0.00 C ATOM 1200 CG1 ILE A 77 5.752 -18.423 -4.423 1.00 0.00 C ATOM 1201 CG2 ILE A 77 7.774 -18.696 -5.931 1.00 0.00 C ATOM 1202 CD1 ILE A 77 4.475 -19.262 -4.485 1.00 0.00 C ATOM 0 H ILE A 77 7.475 -17.264 -7.824 1.00 0.00 H new ATOM 0 HA ILE A 77 5.156 -16.515 -6.287 1.00 0.00 H new ATOM 0 HB ILE A 77 5.734 -18.793 -6.514 1.00 0.00 H new ATOM 0 HG12 ILE A 77 6.490 -18.923 -3.796 1.00 0.00 H new ATOM 0 HG13 ILE A 77 5.537 -17.461 -3.957 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.822 -19.744 -5.634 1.00 0.00 H new ATOM 0 HG22 ILE A 77 8.116 -18.595 -6.961 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.413 -18.103 -5.277 1.00 0.00 H new ATOM 0 HD11 ILE A 77 4.085 -19.405 -3.477 1.00 0.00 H new ATOM 0 HD12 ILE A 77 3.731 -18.747 -5.093 1.00 0.00 H new ATOM 0 HD13 ILE A 77 4.698 -20.232 -4.929 1.00 0.00 H new ATOM 1214 N MET A 78 6.610 -14.478 -5.462 1.00 0.00 N ATOM 1215 CA MET A 78 7.121 -13.446 -4.576 1.00 0.00 C ATOM 1216 C MET A 78 6.082 -12.345 -4.360 1.00 0.00 C ATOM 1217 O MET A 78 5.249 -12.093 -5.229 1.00 0.00 O ATOM 1218 CB MET A 78 8.391 -12.840 -5.178 1.00 0.00 C ATOM 1219 CG MET A 78 8.118 -12.267 -6.570 1.00 0.00 C ATOM 1220 SD MET A 78 9.486 -12.628 -7.658 1.00 0.00 S ATOM 1221 CE MET A 78 9.417 -11.201 -8.728 1.00 0.00 C ATOM 0 H MET A 78 6.091 -14.130 -6.268 1.00 0.00 H new ATOM 0 HA MET A 78 7.346 -13.900 -3.611 1.00 0.00 H new ATOM 0 HB2 MET A 78 8.768 -12.053 -4.524 1.00 0.00 H new ATOM 0 HB3 MET A 78 9.168 -13.602 -5.240 1.00 0.00 H new ATOM 0 HG2 MET A 78 7.199 -12.693 -6.974 1.00 0.00 H new ATOM 0 HG3 MET A 78 7.968 -11.189 -6.506 1.00 0.00 H new ATOM 0 HE1 MET A 78 10.210 -11.266 -9.473 1.00 0.00 H new ATOM 0 HE2 MET A 78 8.450 -11.168 -9.229 1.00 0.00 H new ATOM 0 HE3 MET A 78 9.550 -10.295 -8.136 1.00 0.00 H new ATOM 1231 N PRO A 79 6.167 -11.700 -3.166 1.00 0.00 N ATOM 1232 CA PRO A 79 5.244 -10.631 -2.825 1.00 0.00 C ATOM 1233 C PRO A 79 5.589 -9.347 -3.582 1.00 0.00 C ATOM 1234 O PRO A 79 5.776 -8.294 -2.973 1.00 0.00 O ATOM 1235 CB PRO A 79 5.358 -10.480 -1.316 1.00 0.00 C ATOM 1236 CG PRO A 79 6.669 -11.143 -0.929 1.00 0.00 C ATOM 1237 CD PRO A 79 7.141 -11.971 -2.113 1.00 0.00 C ATOM 0 HA PRO A 79 4.217 -10.854 -3.113 1.00 0.00 H new ATOM 0 HB2 PRO A 79 5.352 -9.429 -1.027 1.00 0.00 H new ATOM 0 HB3 PRO A 79 4.516 -10.954 -0.811 1.00 0.00 H new ATOM 0 HG2 PRO A 79 7.414 -10.392 -0.668 1.00 0.00 H new ATOM 0 HG3 PRO A 79 6.532 -11.775 -0.052 1.00 0.00 H new ATOM 0 HD2 PRO A 79 8.147 -11.685 -2.421 1.00 0.00 H new ATOM 0 HD3 PRO A 79 7.173 -13.032 -1.867 1.00 0.00 H new ATOM 1245 N ALA A 80 5.663 -9.475 -4.898 1.00 0.00 N ATOM 1246 CA ALA A 80 5.981 -8.338 -5.745 1.00 0.00 C ATOM 1247 C ALA A 80 4.800 -7.366 -5.751 1.00 0.00 C ATOM 1248 O ALA A 80 4.991 -6.151 -5.719 1.00 0.00 O ATOM 1249 CB ALA A 80 6.338 -8.831 -7.149 1.00 0.00 C ATOM 0 H ALA A 80 5.508 -10.350 -5.399 1.00 0.00 H new ATOM 0 HA ALA A 80 6.847 -7.802 -5.358 1.00 0.00 H new ATOM 0 HB1 ALA A 80 6.577 -7.978 -7.784 1.00 0.00 H new ATOM 0 HB2 ALA A 80 7.201 -9.494 -7.093 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.491 -9.372 -7.571 1.00 0.00 H new ATOM 1255 N GLY A 81 3.605 -7.936 -5.793 1.00 0.00 N ATOM 1256 CA GLY A 81 2.393 -7.135 -5.804 1.00 0.00 C ATOM 1257 C GLY A 81 2.540 -5.907 -4.903 1.00 0.00 C ATOM 1258 O GLY A 81 2.236 -4.789 -5.317 1.00 0.00 O ATOM 0 H GLY A 81 3.450 -8.944 -5.820 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.171 -6.818 -6.823 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.550 -7.739 -5.467 1.00 0.00 H new ATOM 1262 N LEU A 82 3.005 -6.157 -3.687 1.00 0.00 N ATOM 1263 CA LEU A 82 3.195 -5.085 -2.725 1.00 0.00 C ATOM 1264 C LEU A 82 3.874 -3.900 -3.414 1.00 0.00 C ATOM 1265 O LEU A 82 3.348 -2.788 -3.406 1.00 0.00 O ATOM 1266 CB LEU A 82 3.950 -5.597 -1.496 1.00 0.00 C ATOM 1267 CG LEU A 82 3.138 -5.699 -0.204 1.00 0.00 C ATOM 1268 CD1 LEU A 82 2.692 -7.141 0.051 1.00 0.00 C ATOM 1269 CD2 LEU A 82 3.916 -5.122 0.980 1.00 0.00 C ATOM 0 H LEU A 82 3.255 -7.085 -3.347 1.00 0.00 H new ATOM 0 HA LEU A 82 2.233 -4.730 -2.356 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.353 -6.583 -1.727 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.800 -4.939 -1.316 1.00 0.00 H new ATOM 0 HG LEU A 82 2.236 -5.098 -0.320 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.117 -7.186 0.976 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.073 -7.482 -0.779 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.569 -7.783 0.138 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.316 -5.207 1.886 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.847 -5.675 1.108 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.141 -4.072 0.791 1.00 0.00 H new ATOM 1281 N VAL A 83 5.031 -4.178 -3.995 1.00 0.00 N ATOM 1282 CA VAL A 83 5.787 -3.149 -4.688 1.00 0.00 C ATOM 1283 C VAL A 83 4.922 -2.545 -5.796 1.00 0.00 C ATOM 1284 O VAL A 83 4.984 -1.344 -6.052 1.00 0.00 O ATOM 1285 CB VAL A 83 7.105 -3.728 -5.207 1.00 0.00 C ATOM 1286 CG1 VAL A 83 7.816 -2.733 -6.127 1.00 0.00 C ATOM 1287 CG2 VAL A 83 8.013 -4.150 -4.050 1.00 0.00 C ATOM 0 H VAL A 83 5.464 -5.102 -4.000 1.00 0.00 H new ATOM 0 HA VAL A 83 6.049 -2.342 -4.004 1.00 0.00 H new ATOM 0 HB VAL A 83 6.872 -4.618 -5.791 1.00 0.00 H new ATOM 0 HG11 VAL A 83 8.750 -3.169 -6.482 1.00 0.00 H new ATOM 0 HG12 VAL A 83 7.176 -2.503 -6.979 1.00 0.00 H new ATOM 0 HG13 VAL A 83 8.030 -1.817 -5.576 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.943 -4.558 -4.447 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.234 -3.284 -3.426 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.510 -4.909 -3.451 1.00 0.00 H new ATOM 1297 N ALA A 84 4.134 -3.406 -6.423 1.00 0.00 N ATOM 1298 CA ALA A 84 3.257 -2.973 -7.498 1.00 0.00 C ATOM 1299 C ALA A 84 2.250 -1.960 -6.950 1.00 0.00 C ATOM 1300 O ALA A 84 1.821 -1.057 -7.667 1.00 0.00 O ATOM 1301 CB ALA A 84 2.577 -4.191 -8.124 1.00 0.00 C ATOM 0 H ALA A 84 4.084 -4.402 -6.207 1.00 0.00 H new ATOM 0 HA ALA A 84 3.828 -2.479 -8.284 1.00 0.00 H new ATOM 0 HB1 ALA A 84 1.919 -3.866 -8.930 1.00 0.00 H new ATOM 0 HB2 ALA A 84 3.335 -4.866 -8.523 1.00 0.00 H new ATOM 0 HB3 ALA A 84 1.992 -4.711 -7.365 1.00 0.00 H new ATOM 1307 N GLY A 85 1.901 -2.144 -5.685 1.00 0.00 N ATOM 1308 CA GLY A 85 0.952 -1.258 -5.034 1.00 0.00 C ATOM 1309 C GLY A 85 1.589 0.100 -4.729 1.00 0.00 C ATOM 1310 O GLY A 85 1.053 1.140 -5.107 1.00 0.00 O ATOM 0 H GLY A 85 2.259 -2.894 -5.094 1.00 0.00 H new ATOM 0 HA2 GLY A 85 0.081 -1.119 -5.674 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.599 -1.714 -4.109 1.00 0.00 H new ATOM 1314 N LEU A 86 2.725 0.045 -4.049 1.00 0.00 N ATOM 1315 CA LEU A 86 3.441 1.257 -3.690 1.00 0.00 C ATOM 1316 C LEU A 86 3.605 2.135 -4.932 1.00 0.00 C ATOM 1317 O LEU A 86 3.401 3.347 -4.872 1.00 0.00 O ATOM 1318 CB LEU A 86 4.763 0.914 -3.001 1.00 0.00 C ATOM 1319 CG LEU A 86 5.844 1.996 -3.046 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.560 3.098 -2.023 1.00 0.00 C ATOM 1321 CD2 LEU A 86 7.236 1.389 -2.863 1.00 0.00 C ATOM 0 H LEU A 86 3.167 -0.820 -3.737 1.00 0.00 H new ATOM 0 HA LEU A 86 2.870 1.835 -2.964 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.555 0.679 -1.957 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.164 0.009 -3.458 1.00 0.00 H new ATOM 0 HG LEU A 86 5.822 2.459 -4.032 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.343 3.854 -2.076 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.596 3.558 -2.242 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.538 2.668 -1.022 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.985 2.180 -2.899 1.00 0.00 H new ATOM 0 HD22 LEU A 86 7.288 0.883 -1.899 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.428 0.671 -3.660 1.00 0.00 H new ATOM 1333 N SER A 87 3.971 1.489 -6.030 1.00 0.00 N ATOM 1334 CA SER A 87 4.164 2.196 -7.284 1.00 0.00 C ATOM 1335 C SER A 87 2.840 2.803 -7.753 1.00 0.00 C ATOM 1336 O SER A 87 2.751 4.009 -7.977 1.00 0.00 O ATOM 1337 CB SER A 87 4.731 1.266 -8.359 1.00 0.00 C ATOM 1338 OG SER A 87 5.260 1.990 -9.467 1.00 0.00 O ATOM 0 H SER A 87 4.139 0.484 -6.077 1.00 0.00 H new ATOM 0 HA SER A 87 4.884 2.997 -7.117 1.00 0.00 H new ATOM 0 HB2 SER A 87 5.514 0.645 -7.925 1.00 0.00 H new ATOM 0 HB3 SER A 87 3.947 0.593 -8.707 1.00 0.00 H new ATOM 0 HG SER A 87 5.614 1.361 -10.130 1.00 0.00 H new ATOM 1344 N LEU A 88 1.844 1.939 -7.886 1.00 0.00 N ATOM 1345 CA LEU A 88 0.529 2.375 -8.324 1.00 0.00 C ATOM 1346 C LEU A 88 0.146 3.654 -7.577 1.00 0.00 C ATOM 1347 O LEU A 88 -0.431 4.569 -8.162 1.00 0.00 O ATOM 1348 CB LEU A 88 -0.489 1.243 -8.168 1.00 0.00 C ATOM 1349 CG LEU A 88 -1.112 0.719 -9.463 1.00 0.00 C ATOM 1350 CD1 LEU A 88 -2.214 1.657 -9.960 1.00 0.00 C ATOM 1351 CD2 LEU A 88 -0.041 0.477 -10.528 1.00 0.00 C ATOM 0 H LEU A 88 1.921 0.939 -7.698 1.00 0.00 H new ATOM 0 HA LEU A 88 0.542 2.618 -9.387 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -0.002 0.411 -7.659 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.291 1.590 -7.516 1.00 0.00 H new ATOM 0 HG LEU A 88 -1.579 -0.243 -9.253 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -2.640 1.261 -10.882 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.995 1.734 -9.203 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.793 2.644 -10.149 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -0.511 0.105 -11.438 1.00 0.00 H new ATOM 0 HD22 LEU A 88 0.476 1.412 -10.743 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.676 -0.259 -10.163 1.00 0.00 H new ATOM 1363 N MET A 89 0.483 3.677 -6.296 1.00 0.00 N ATOM 1364 CA MET A 89 0.181 4.829 -5.463 1.00 0.00 C ATOM 1365 C MET A 89 0.992 6.050 -5.903 1.00 0.00 C ATOM 1366 O MET A 89 0.436 7.129 -6.103 1.00 0.00 O ATOM 1367 CB MET A 89 0.502 4.502 -4.003 1.00 0.00 C ATOM 1368 CG MET A 89 -0.712 4.754 -3.106 1.00 0.00 C ATOM 1369 SD MET A 89 -0.655 3.676 -1.685 1.00 0.00 S ATOM 1370 CE MET A 89 -1.429 2.220 -2.369 1.00 0.00 C ATOM 0 H MET A 89 0.962 2.916 -5.814 1.00 0.00 H new ATOM 0 HA MET A 89 -0.879 5.062 -5.568 1.00 0.00 H new ATOM 0 HB2 MET A 89 0.811 3.460 -3.919 1.00 0.00 H new ATOM 0 HB3 MET A 89 1.341 5.111 -3.666 1.00 0.00 H new ATOM 0 HG2 MET A 89 -0.726 5.795 -2.783 1.00 0.00 H new ATOM 0 HG3 MET A 89 -1.631 4.582 -3.667 1.00 0.00 H new ATOM 0 HE1 MET A 89 -1.475 1.441 -1.608 1.00 0.00 H new ATOM 0 HE2 MET A 89 -2.439 2.465 -2.698 1.00 0.00 H new ATOM 0 HE3 MET A 89 -0.847 1.864 -3.219 1.00 0.00 H new ATOM 1380 N MET A 90 2.292 5.839 -6.039 1.00 0.00 N ATOM 1381 CA MET A 90 3.185 6.909 -6.451 1.00 0.00 C ATOM 1382 C MET A 90 2.669 7.597 -7.717 1.00 0.00 C ATOM 1383 O MET A 90 2.363 8.788 -7.700 1.00 0.00 O ATOM 1384 CB MET A 90 4.580 6.339 -6.713 1.00 0.00 C ATOM 1385 CG MET A 90 5.648 7.138 -5.963 1.00 0.00 C ATOM 1386 SD MET A 90 7.244 6.366 -6.170 1.00 0.00 S ATOM 1387 CE MET A 90 8.295 7.808 -6.122 1.00 0.00 C ATOM 0 H MET A 90 2.749 4.943 -5.871 1.00 0.00 H new ATOM 0 HA MET A 90 3.229 7.647 -5.650 1.00 0.00 H new ATOM 0 HB2 MET A 90 4.615 5.295 -6.400 1.00 0.00 H new ATOM 0 HB3 MET A 90 4.790 6.359 -7.782 1.00 0.00 H new ATOM 0 HG2 MET A 90 5.678 8.161 -6.337 1.00 0.00 H new ATOM 0 HG3 MET A 90 5.396 7.193 -4.904 1.00 0.00 H new ATOM 0 HE1 MET A 90 9.335 7.504 -6.238 1.00 0.00 H new ATOM 0 HE2 MET A 90 8.022 8.484 -6.932 1.00 0.00 H new ATOM 0 HE3 MET A 90 8.170 8.317 -5.166 1.00 0.00 H new ATOM 1397 N ILE A 91 2.587 6.816 -8.785 1.00 0.00 N ATOM 1398 CA ILE A 91 2.113 7.335 -10.057 1.00 0.00 C ATOM 1399 C ILE A 91 0.771 8.039 -9.847 1.00 0.00 C ATOM 1400 O ILE A 91 0.578 9.163 -10.306 1.00 0.00 O ATOM 1401 CB ILE A 91 2.067 6.222 -11.105 1.00 0.00 C ATOM 1402 CG1 ILE A 91 1.258 5.025 -10.600 1.00 0.00 C ATOM 1403 CG2 ILE A 91 3.477 5.818 -11.539 1.00 0.00 C ATOM 1404 CD1 ILE A 91 -0.167 5.052 -11.157 1.00 0.00 C ATOM 0 H ILE A 91 2.841 5.828 -8.795 1.00 0.00 H new ATOM 0 HA ILE A 91 2.806 8.080 -10.447 1.00 0.00 H new ATOM 0 HB ILE A 91 1.556 6.606 -11.988 1.00 0.00 H new ATOM 0 HG12 ILE A 91 1.750 4.098 -10.895 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.227 5.036 -9.511 1.00 0.00 H new ATOM 0 HG21 ILE A 91 3.415 5.025 -12.284 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.987 6.681 -11.968 1.00 0.00 H new ATOM 0 HG23 ILE A 91 4.035 5.460 -10.674 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.720 4.191 -10.783 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.664 5.969 -10.840 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -0.133 5.016 -12.246 1.00 0.00 H new ATOM 1416 N LEU A 92 -0.122 7.348 -9.154 1.00 0.00 N ATOM 1417 CA LEU A 92 -1.440 7.893 -8.878 1.00 0.00 C ATOM 1418 C LEU A 92 -1.292 9.263 -8.213 1.00 0.00 C ATOM 1419 O LEU A 92 -2.110 10.155 -8.432 1.00 0.00 O ATOM 1420 CB LEU A 92 -2.270 6.900 -8.062 1.00 0.00 C ATOM 1421 CG LEU A 92 -3.166 5.955 -8.866 1.00 0.00 C ATOM 1422 CD1 LEU A 92 -3.021 4.513 -8.376 1.00 0.00 C ATOM 1423 CD2 LEU A 92 -4.621 6.425 -8.841 1.00 0.00 C ATOM 0 H LEU A 92 0.042 6.415 -8.775 1.00 0.00 H new ATOM 0 HA LEU A 92 -1.991 8.047 -9.806 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.590 6.299 -7.458 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -2.897 7.463 -7.371 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.839 5.976 -9.906 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.668 3.862 -8.964 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -1.985 4.193 -8.489 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.306 4.455 -7.326 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -5.236 5.736 -9.420 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.977 6.452 -7.811 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.689 7.423 -9.274 1.00 0.00 H new ATOM 1435 N ARG A 93 -0.243 9.386 -7.413 1.00 0.00 N ATOM 1436 CA ARG A 93 0.023 10.632 -6.714 1.00 0.00 C ATOM 1437 C ARG A 93 0.603 11.668 -7.679 1.00 0.00 C ATOM 1438 O ARG A 93 0.403 12.869 -7.501 1.00 0.00 O ATOM 1439 CB ARG A 93 1.001 10.418 -5.558 1.00 0.00 C ATOM 1440 CG ARG A 93 0.435 9.429 -4.537 1.00 0.00 C ATOM 1441 CD ARG A 93 0.065 10.140 -3.233 1.00 0.00 C ATOM 1442 NE ARG A 93 -0.260 9.143 -2.188 1.00 0.00 N ATOM 1443 CZ ARG A 93 -1.022 9.400 -1.116 1.00 0.00 C ATOM 1444 NH1 ARG A 93 -1.542 10.623 -0.941 1.00 0.00 N ATOM 1445 NH2 ARG A 93 -1.265 8.434 -0.220 1.00 0.00 N ATOM 0 H ARG A 93 0.433 8.643 -7.233 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.923 10.994 -6.311 1.00 0.00 H new ATOM 0 HB2 ARG A 93 1.950 10.045 -5.944 1.00 0.00 H new ATOM 0 HB3 ARG A 93 1.208 11.371 -5.071 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -0.446 8.938 -4.950 1.00 0.00 H new ATOM 0 HG3 ARG A 93 1.169 8.649 -4.335 1.00 0.00 H new ATOM 0 HD2 ARG A 93 0.893 10.768 -2.904 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -0.788 10.798 -3.397 1.00 0.00 H new ATOM 0 HE ARG A 93 0.120 8.202 -2.290 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -1.358 11.358 -1.624 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -2.122 10.819 -0.125 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -0.870 7.503 -0.354 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -1.845 8.629 0.596 1.00 0.00 H new ATOM 1459 N LEU A 94 1.311 11.167 -8.680 1.00 0.00 N ATOM 1460 CA LEU A 94 1.923 12.034 -9.673 1.00 0.00 C ATOM 1461 C LEU A 94 0.884 13.040 -10.173 1.00 0.00 C ATOM 1462 O LEU A 94 1.136 14.244 -10.181 1.00 0.00 O ATOM 1463 CB LEU A 94 2.561 11.204 -10.789 1.00 0.00 C ATOM 1464 CG LEU A 94 3.877 11.741 -11.355 1.00 0.00 C ATOM 1465 CD1 LEU A 94 5.077 11.056 -10.697 1.00 0.00 C ATOM 1466 CD2 LEU A 94 3.910 11.616 -12.879 1.00 0.00 C ATOM 0 H LEU A 94 1.475 10.171 -8.825 1.00 0.00 H new ATOM 0 HA LEU A 94 2.737 12.608 -9.229 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.735 10.196 -10.411 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.845 11.119 -11.606 1.00 0.00 H new ATOM 0 HG LEU A 94 3.943 12.803 -11.118 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.000 11.456 -11.117 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.058 11.241 -9.623 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.030 9.983 -10.881 1.00 0.00 H new ATOM 0 HD21 LEU A 94 4.856 12.005 -13.256 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.811 10.568 -13.160 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.087 12.186 -13.309 1.00 0.00 H new ATOM 1478 N VAL A 95 -0.260 12.510 -10.577 1.00 0.00 N ATOM 1479 CA VAL A 95 -1.338 13.347 -11.077 1.00 0.00 C ATOM 1480 C VAL A 95 -2.033 14.033 -9.900 1.00 0.00 C ATOM 1481 O VAL A 95 -2.360 15.217 -9.971 1.00 0.00 O ATOM 1482 CB VAL A 95 -2.294 12.514 -11.933 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -3.177 11.622 -11.058 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -3.144 13.410 -12.836 1.00 0.00 C ATOM 0 H VAL A 95 -0.465 11.511 -10.569 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.944 14.131 -11.724 1.00 0.00 H new ATOM 0 HB VAL A 95 -1.694 11.867 -12.573 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.847 11.040 -11.691 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.549 10.946 -10.477 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -3.764 12.243 -10.382 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -3.815 12.793 -13.434 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.731 14.094 -12.222 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.493 13.983 -13.496 1.00 0.00 H new ATOM 1494 N LEU A 96 -2.238 13.261 -8.843 1.00 0.00 N ATOM 1495 CA LEU A 96 -2.889 13.779 -7.652 1.00 0.00 C ATOM 1496 C LEU A 96 -2.267 15.127 -7.282 1.00 0.00 C ATOM 1497 O LEU A 96 -2.960 16.026 -6.809 1.00 0.00 O ATOM 1498 CB LEU A 96 -2.839 12.749 -6.522 1.00 0.00 C ATOM 1499 CG LEU A 96 -4.081 12.669 -5.632 1.00 0.00 C ATOM 1500 CD1 LEU A 96 -5.161 11.796 -6.274 1.00 0.00 C ATOM 1501 CD2 LEU A 96 -3.716 12.189 -4.225 1.00 0.00 C ATOM 0 H LEU A 96 -1.964 12.280 -8.787 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.947 13.956 -7.844 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.667 11.766 -6.960 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.978 12.972 -5.892 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.496 13.672 -5.533 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -6.033 11.756 -5.621 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -5.448 12.221 -7.236 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -4.773 10.788 -6.423 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -4.616 12.141 -3.612 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -3.264 11.199 -4.284 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.008 12.885 -3.775 1.00 0.00 H new ATOM 1513 N LEU A 97 -0.965 15.225 -7.512 1.00 0.00 N ATOM 1514 CA LEU A 97 -0.242 16.448 -7.209 1.00 0.00 C ATOM 1515 C LEU A 97 -1.073 17.652 -7.659 1.00 0.00 C ATOM 1516 O LEU A 97 -1.139 18.662 -6.959 1.00 0.00 O ATOM 1517 CB LEU A 97 1.161 16.407 -7.818 1.00 0.00 C ATOM 1518 CG LEU A 97 2.324 16.553 -6.836 1.00 0.00 C ATOM 1519 CD1 LEU A 97 2.777 15.187 -6.315 1.00 0.00 C ATOM 1520 CD2 LEU A 97 3.477 17.338 -7.464 1.00 0.00 C ATOM 0 H LEU A 97 -0.393 14.477 -7.905 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.094 16.546 -6.134 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.277 15.462 -8.350 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.236 17.202 -8.560 1.00 0.00 H new ATOM 0 HG LEU A 97 1.975 17.126 -5.977 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.605 15.320 -5.619 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.947 14.699 -5.803 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.102 14.568 -7.151 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.291 17.427 -6.744 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.833 16.814 -8.351 1.00 0.00 H new ATOM 0 HD23 LEU A 97 3.130 18.332 -7.744 1.00 0.00 H new ATOM 1532 N LEU A 98 -1.686 17.505 -8.824 1.00 0.00 N ATOM 1533 CA LEU A 98 -2.509 18.567 -9.376 1.00 0.00 C ATOM 1534 C LEU A 98 -3.765 18.731 -8.517 1.00 0.00 C ATOM 1535 O LEU A 98 -4.133 19.848 -8.156 1.00 0.00 O ATOM 1536 CB LEU A 98 -2.804 18.304 -10.854 1.00 0.00 C ATOM 1537 CG LEU A 98 -2.519 19.462 -11.812 1.00 0.00 C ATOM 1538 CD1 LEU A 98 -1.050 19.473 -12.237 1.00 0.00 C ATOM 1539 CD2 LEU A 98 -3.464 19.424 -13.015 1.00 0.00 C ATOM 0 H LEU A 98 -1.629 16.666 -9.401 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.976 19.517 -9.346 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.218 17.442 -11.173 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.854 18.029 -10.951 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.708 20.397 -11.284 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -0.874 20.306 -12.918 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -0.417 19.584 -11.356 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.810 18.536 -12.740 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.240 20.258 -13.680 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -3.331 18.485 -13.553 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.495 19.502 -12.670 1.00 0.00 H new ATOM 1551 N LEU A 99 -4.389 17.602 -8.217 1.00 0.00 N ATOM 1552 CA LEU A 99 -5.596 17.606 -7.408 1.00 0.00 C ATOM 1553 C LEU A 99 -5.336 18.383 -6.116 1.00 0.00 C ATOM 1554 O LEU A 99 -4.645 17.896 -5.222 1.00 0.00 O ATOM 1555 CB LEU A 99 -6.091 16.177 -7.176 1.00 0.00 C ATOM 1556 CG LEU A 99 -7.240 15.711 -8.073 1.00 0.00 C ATOM 1557 CD1 LEU A 99 -6.728 15.316 -9.460 1.00 0.00 C ATOM 1558 CD2 LEU A 99 -8.030 14.581 -7.410 1.00 0.00 C ATOM 0 H LEU A 99 -4.082 16.678 -8.520 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.403 18.117 -7.932 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.251 15.496 -7.312 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.408 16.088 -6.137 1.00 0.00 H new ATOM 0 HG LEU A 99 -7.927 16.546 -8.210 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -7.565 14.989 -10.077 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -6.246 16.174 -9.928 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -6.008 14.503 -9.364 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -8.840 14.269 -8.069 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.368 13.735 -7.223 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -8.445 14.933 -6.465 1.00 0.00 H new TER 1570 LEU A 99