USER MOD reduce.3.24.130724 H: found=0, std=0, add=657, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 655 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 9 GLN : amide:sc= 0 X(o=1,f=0.67) USER MOD Set 1.2: A 11 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 21 SER OG : rot 29:sc= 1.01 USER MOD Single : A 1 GLY N :NH3+ -179:sc= 0 (180deg=-0.000262) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -147:sc= 0 (180deg=-0.765) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 20 CYS SG : rot 103:sc= -2.02! USER MOD Single : A 23 GLN : amide:sc= -1.52 K(o=-1.5,f=-3.7!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 38 SER OG : rot -86:sc= 1.09 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.747 X(o=-0.75,f=-0.62) USER MOD Single : A 47 GLN :FLIP amide:sc= -0.566 F(o=-1.2,f=-0.57) USER MOD Single : A 48 GLN : amide:sc= -1.21 K(o=-1.2,f=-4!) USER MOD Single : A 53 LYS NZ :NH3+ 168:sc= -0.0164 (180deg=-0.158) USER MOD Single : A 55 LYS NZ :NH3+ -128:sc= -0.113 (180deg=-0.942) USER MOD Single : A 61 LYS NZ :NH3+ -107:sc= -1.67! (180deg=-4.53!) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 SER OG : rot 111:sc= 1.14 USER MOD Single : A 73 LYS NZ :NH3+ -156:sc= -0.166 (180deg=-1.16) USER MOD Single : A 75 ASN : amide:sc= -0.198 X(o=-0.2,f=-0.2) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.080 -14.227 4.784 1.00 0.00 N ATOM 2 CA GLY A 1 12.213 -15.101 4.545 1.00 0.00 C ATOM 3 C GLY A 1 12.177 -16.346 5.409 1.00 0.00 C ATOM 4 O GLY A 1 12.023 -17.457 4.902 1.00 0.00 O ATOM 0 H1 GLY A 1 11.142 -13.399 4.158 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.197 -14.742 4.591 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.087 -13.912 5.775 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.228 -15.392 3.495 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.136 -14.555 4.738 1.00 0.00 H new ATOM 8 N SER A 2 12.322 -16.161 6.717 1.00 0.00 N ATOM 9 CA SER A 2 12.311 -17.279 7.653 1.00 0.00 C ATOM 10 C SER A 2 10.886 -17.614 8.082 1.00 0.00 C ATOM 11 O SER A 2 9.948 -16.872 7.792 1.00 0.00 O ATOM 12 CB SER A 2 13.162 -16.952 8.882 1.00 0.00 C ATOM 13 OG SER A 2 14.539 -16.909 8.551 1.00 0.00 O ATOM 0 H SER A 2 12.448 -15.247 7.153 1.00 0.00 H new ATOM 0 HA SER A 2 12.734 -18.147 7.148 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.854 -15.992 9.297 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.994 -17.702 9.655 1.00 0.00 H new ATOM 0 HG SER A 2 15.062 -16.697 9.352 1.00 0.00 H new ATOM 19 N SER A 3 10.732 -18.738 8.775 1.00 0.00 N ATOM 20 CA SER A 3 9.421 -19.175 9.242 1.00 0.00 C ATOM 21 C SER A 3 8.722 -18.063 10.018 1.00 0.00 C ATOM 22 O SER A 3 7.554 -17.762 9.777 1.00 0.00 O ATOM 23 CB SER A 3 9.559 -20.419 10.122 1.00 0.00 C ATOM 24 OG SER A 3 8.294 -20.852 10.593 1.00 0.00 O ATOM 0 H SER A 3 11.499 -19.363 9.025 1.00 0.00 H new ATOM 0 HA SER A 3 8.815 -19.421 8.370 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.033 -21.220 9.554 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.210 -20.200 10.968 1.00 0.00 H new ATOM 0 HG SER A 3 8.408 -21.649 11.152 1.00 0.00 H new ATOM 30 N GLY A 4 9.448 -17.455 10.952 1.00 0.00 N ATOM 31 CA GLY A 4 8.882 -16.384 11.750 1.00 0.00 C ATOM 32 C GLY A 4 8.285 -15.280 10.899 1.00 0.00 C ATOM 33 O GLY A 4 7.086 -15.012 10.971 1.00 0.00 O ATOM 0 H GLY A 4 10.418 -17.685 11.170 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.111 -16.791 12.405 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.657 -15.965 12.392 1.00 0.00 H new ATOM 37 N SER A 5 9.123 -14.638 10.092 1.00 0.00 N ATOM 38 CA SER A 5 8.672 -13.554 9.228 1.00 0.00 C ATOM 39 C SER A 5 7.617 -14.047 8.242 1.00 0.00 C ATOM 40 O SER A 5 7.768 -15.107 7.634 1.00 0.00 O ATOM 41 CB SER A 5 9.856 -12.954 8.467 1.00 0.00 C ATOM 42 OG SER A 5 10.890 -12.566 9.355 1.00 0.00 O ATOM 0 H SER A 5 10.118 -14.850 10.018 1.00 0.00 H new ATOM 0 HA SER A 5 8.225 -12.784 9.857 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.240 -13.683 7.753 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.523 -12.090 7.892 1.00 0.00 H new ATOM 0 HG SER A 5 11.635 -12.187 8.844 1.00 0.00 H new ATOM 48 N SER A 6 6.549 -13.271 8.091 1.00 0.00 N ATOM 49 CA SER A 6 5.466 -13.630 7.182 1.00 0.00 C ATOM 50 C SER A 6 5.564 -12.839 5.881 1.00 0.00 C ATOM 51 O SER A 6 5.329 -11.632 5.856 1.00 0.00 O ATOM 52 CB SER A 6 4.111 -13.377 7.846 1.00 0.00 C ATOM 53 OG SER A 6 3.050 -13.567 6.926 1.00 0.00 O ATOM 0 H SER A 6 6.410 -12.390 8.586 1.00 0.00 H new ATOM 0 HA SER A 6 5.556 -14.691 6.949 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.986 -14.050 8.694 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.079 -12.361 8.239 1.00 0.00 H new ATOM 0 HG SER A 6 2.195 -13.401 7.374 1.00 0.00 H new ATOM 59 N GLY A 7 5.913 -13.531 4.801 1.00 0.00 N ATOM 60 CA GLY A 7 6.037 -12.878 3.510 1.00 0.00 C ATOM 61 C GLY A 7 7.079 -11.777 3.515 1.00 0.00 C ATOM 62 O GLY A 7 8.278 -12.049 3.549 1.00 0.00 O ATOM 0 H GLY A 7 6.112 -14.531 4.796 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.300 -13.619 2.755 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.072 -12.460 3.224 1.00 0.00 H new ATOM 66 N MET A 8 6.620 -10.530 3.478 1.00 0.00 N ATOM 67 CA MET A 8 7.521 -9.384 3.477 1.00 0.00 C ATOM 68 C MET A 8 6.931 -8.228 4.278 1.00 0.00 C ATOM 69 O MET A 8 5.735 -8.209 4.567 1.00 0.00 O ATOM 70 CB MET A 8 7.807 -8.934 2.044 1.00 0.00 C ATOM 71 CG MET A 8 6.626 -8.250 1.375 1.00 0.00 C ATOM 72 SD MET A 8 6.823 -8.115 -0.413 1.00 0.00 S ATOM 73 CE MET A 8 5.293 -7.299 -0.861 1.00 0.00 C ATOM 0 H MET A 8 5.630 -10.288 3.448 1.00 0.00 H new ATOM 0 HA MET A 8 8.456 -9.688 3.947 1.00 0.00 H new ATOM 0 HB2 MET A 8 8.657 -8.251 2.049 1.00 0.00 H new ATOM 0 HB3 MET A 8 8.098 -9.801 1.451 1.00 0.00 H new ATOM 0 HG2 MET A 8 5.716 -8.808 1.595 1.00 0.00 H new ATOM 0 HG3 MET A 8 6.500 -7.254 1.799 1.00 0.00 H new ATOM 0 HE1 MET A 8 4.973 -7.641 -1.845 1.00 0.00 H new ATOM 0 HE2 MET A 8 4.524 -7.538 -0.126 1.00 0.00 H new ATOM 0 HE3 MET A 8 5.449 -6.221 -0.885 1.00 0.00 H new ATOM 83 N GLN A 9 7.778 -7.266 4.633 1.00 0.00 N ATOM 84 CA GLN A 9 7.339 -6.107 5.401 1.00 0.00 C ATOM 85 C GLN A 9 7.266 -4.865 4.518 1.00 0.00 C ATOM 86 O GLN A 9 8.191 -4.575 3.759 1.00 0.00 O ATOM 87 CB GLN A 9 8.287 -5.858 6.575 1.00 0.00 C ATOM 88 CG GLN A 9 7.722 -4.911 7.622 1.00 0.00 C ATOM 89 CD GLN A 9 8.299 -5.157 9.002 1.00 0.00 C ATOM 90 OE1 GLN A 9 9.424 -5.639 9.141 1.00 0.00 O ATOM 91 NE2 GLN A 9 7.530 -4.826 10.033 1.00 0.00 N ATOM 0 H GLN A 9 8.771 -7.267 4.401 1.00 0.00 H new ATOM 0 HA GLN A 9 6.341 -6.315 5.787 1.00 0.00 H new ATOM 0 HB2 GLN A 9 8.524 -6.811 7.049 1.00 0.00 H new ATOM 0 HB3 GLN A 9 9.223 -5.450 6.195 1.00 0.00 H new ATOM 0 HG2 GLN A 9 7.927 -3.883 7.325 1.00 0.00 H new ATOM 0 HG3 GLN A 9 6.638 -5.022 7.660 1.00 0.00 H new ATOM 0 HE21 GLN A 9 6.604 -4.429 9.872 1.00 0.00 H new ATOM 0 HE22 GLN A 9 7.865 -4.968 10.986 1.00 0.00 H new ATOM 100 N LEU A 10 6.161 -4.136 4.623 1.00 0.00 N ATOM 101 CA LEU A 10 5.966 -2.924 3.834 1.00 0.00 C ATOM 102 C LEU A 10 5.767 -1.712 4.738 1.00 0.00 C ATOM 103 O LEU A 10 5.323 -1.841 5.879 1.00 0.00 O ATOM 104 CB LEU A 10 4.763 -3.085 2.903 1.00 0.00 C ATOM 105 CG LEU A 10 4.963 -4.006 1.699 1.00 0.00 C ATOM 106 CD1 LEU A 10 3.654 -4.199 0.951 1.00 0.00 C ATOM 107 CD2 LEU A 10 6.033 -3.447 0.772 1.00 0.00 C ATOM 0 H LEU A 10 5.386 -4.362 5.246 1.00 0.00 H new ATOM 0 HA LEU A 10 6.862 -2.763 3.234 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.924 -3.462 3.488 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.478 -2.099 2.537 1.00 0.00 H new ATOM 0 HG LEU A 10 5.297 -4.978 2.061 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.816 -4.857 0.098 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.916 -4.645 1.618 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.290 -3.233 0.600 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.162 -4.115 -0.079 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.729 -2.462 0.417 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.975 -3.363 1.313 1.00 0.00 H new ATOM 119 N THR A 11 6.095 -0.533 4.219 1.00 0.00 N ATOM 120 CA THR A 11 5.951 0.703 4.978 1.00 0.00 C ATOM 121 C THR A 11 5.286 1.789 4.140 1.00 0.00 C ATOM 122 O THR A 11 5.917 2.387 3.267 1.00 0.00 O ATOM 123 CB THR A 11 7.314 1.218 5.478 1.00 0.00 C ATOM 124 OG1 THR A 11 8.109 0.123 5.945 1.00 0.00 O ATOM 125 CG2 THR A 11 7.132 2.233 6.596 1.00 0.00 C ATOM 0 H THR A 11 6.462 -0.408 3.276 1.00 0.00 H new ATOM 0 HA THR A 11 5.320 0.474 5.837 1.00 0.00 H new ATOM 0 HB THR A 11 7.821 1.706 4.646 1.00 0.00 H new ATOM 0 HG1 THR A 11 8.975 0.458 6.260 1.00 0.00 H new ATOM 0 HG21 THR A 11 8.108 2.582 6.933 1.00 0.00 H new ATOM 0 HG22 THR A 11 6.551 3.079 6.229 1.00 0.00 H new ATOM 0 HG23 THR A 11 6.606 1.766 7.429 1.00 0.00 H new ATOM 133 N VAL A 12 4.009 2.040 4.410 1.00 0.00 N ATOM 134 CA VAL A 12 3.260 3.057 3.681 1.00 0.00 C ATOM 135 C VAL A 12 3.460 4.436 4.299 1.00 0.00 C ATOM 136 O VAL A 12 3.076 4.677 5.444 1.00 0.00 O ATOM 137 CB VAL A 12 1.754 2.732 3.653 1.00 0.00 C ATOM 138 CG1 VAL A 12 0.965 3.904 3.090 1.00 0.00 C ATOM 139 CG2 VAL A 12 1.497 1.468 2.847 1.00 0.00 C ATOM 0 H VAL A 12 3.472 1.554 5.128 1.00 0.00 H new ATOM 0 HA VAL A 12 3.643 3.061 2.660 1.00 0.00 H new ATOM 0 HB VAL A 12 1.418 2.558 4.675 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -0.096 3.656 3.078 1.00 0.00 H new ATOM 0 HG12 VAL A 12 1.125 4.783 3.714 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.300 4.114 2.074 1.00 0.00 H new ATOM 0 HG21 VAL A 12 0.428 1.253 2.838 1.00 0.00 H new ATOM 0 HG22 VAL A 12 1.847 1.611 1.825 1.00 0.00 H new ATOM 0 HG23 VAL A 12 2.031 0.633 3.300 1.00 0.00 H new ATOM 149 N LYS A 13 4.062 5.339 3.533 1.00 0.00 N ATOM 150 CA LYS A 13 4.312 6.697 4.003 1.00 0.00 C ATOM 151 C LYS A 13 3.402 7.695 3.294 1.00 0.00 C ATOM 152 O LYS A 13 3.374 7.759 2.065 1.00 0.00 O ATOM 153 CB LYS A 13 5.778 7.075 3.776 1.00 0.00 C ATOM 154 CG LYS A 13 6.218 8.301 4.557 1.00 0.00 C ATOM 155 CD LYS A 13 7.732 8.403 4.629 1.00 0.00 C ATOM 156 CE LYS A 13 8.173 9.467 5.623 1.00 0.00 C ATOM 157 NZ LYS A 13 9.574 9.254 6.078 1.00 0.00 N ATOM 0 H LYS A 13 4.386 5.155 2.583 1.00 0.00 H new ATOM 0 HA LYS A 13 4.095 6.731 5.071 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.409 6.231 4.055 1.00 0.00 H new ATOM 0 HB3 LYS A 13 5.938 7.255 2.713 1.00 0.00 H new ATOM 0 HG2 LYS A 13 5.814 9.197 4.086 1.00 0.00 H new ATOM 0 HG3 LYS A 13 5.807 8.258 5.566 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.149 7.438 4.918 1.00 0.00 H new ATOM 0 HD3 LYS A 13 8.129 8.639 3.642 1.00 0.00 H new ATOM 0 HE2 LYS A 13 8.086 10.452 5.163 1.00 0.00 H new ATOM 0 HE3 LYS A 13 7.506 9.458 6.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.837 9.999 6.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.652 8.325 6.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 10.214 9.288 5.259 1.00 0.00 H new ATOM 171 N ALA A 14 2.661 8.472 4.076 1.00 0.00 N ATOM 172 CA ALA A 14 1.753 9.469 3.523 1.00 0.00 C ATOM 173 C ALA A 14 2.474 10.790 3.274 1.00 0.00 C ATOM 174 O ALA A 14 3.314 11.210 4.071 1.00 0.00 O ATOM 175 CB ALA A 14 0.569 9.679 4.454 1.00 0.00 C ATOM 0 H ALA A 14 2.672 8.430 5.095 1.00 0.00 H new ATOM 0 HA ALA A 14 1.386 9.099 2.565 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -0.101 10.426 4.028 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.032 8.739 4.577 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.926 10.023 5.425 1.00 0.00 H new ATOM 181 N LEU A 15 2.141 11.440 2.165 1.00 0.00 N ATOM 182 CA LEU A 15 2.758 12.714 1.810 1.00 0.00 C ATOM 183 C LEU A 15 2.851 13.631 3.026 1.00 0.00 C ATOM 184 O LEU A 15 3.869 14.288 3.242 1.00 0.00 O ATOM 185 CB LEU A 15 1.957 13.400 0.701 1.00 0.00 C ATOM 186 CG LEU A 15 2.025 12.744 -0.678 1.00 0.00 C ATOM 187 CD1 LEU A 15 0.981 13.345 -1.607 1.00 0.00 C ATOM 188 CD2 LEU A 15 3.418 12.894 -1.272 1.00 0.00 C ATOM 0 H LEU A 15 1.447 11.106 1.496 1.00 0.00 H new ATOM 0 HA LEU A 15 3.767 12.513 1.450 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.912 13.445 1.009 1.00 0.00 H new ATOM 0 HB3 LEU A 15 2.307 14.428 0.610 1.00 0.00 H new ATOM 0 HG LEU A 15 1.812 11.681 -0.564 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.044 12.866 -2.584 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.013 13.186 -1.189 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.163 14.414 -1.715 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.448 12.421 -2.254 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.659 13.952 -1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.146 12.416 -0.617 1.00 0.00 H new ATOM 200 N GLN A 16 1.784 13.667 3.817 1.00 0.00 N ATOM 201 CA GLN A 16 1.747 14.501 5.012 1.00 0.00 C ATOM 202 C GLN A 16 2.931 14.198 5.925 1.00 0.00 C ATOM 203 O GLN A 16 3.569 15.108 6.452 1.00 0.00 O ATOM 204 CB GLN A 16 0.435 14.286 5.770 1.00 0.00 C ATOM 205 CG GLN A 16 -0.750 15.012 5.154 1.00 0.00 C ATOM 206 CD GLN A 16 -1.849 15.293 6.160 1.00 0.00 C ATOM 207 OE1 GLN A 16 -2.036 14.543 7.118 1.00 0.00 O ATOM 208 NE2 GLN A 16 -2.583 16.379 5.946 1.00 0.00 N ATOM 0 H GLN A 16 0.934 13.128 3.652 1.00 0.00 H new ATOM 0 HA GLN A 16 1.811 15.543 4.699 1.00 0.00 H new ATOM 0 HB2 GLN A 16 0.217 13.219 5.807 1.00 0.00 H new ATOM 0 HB3 GLN A 16 0.561 14.621 6.799 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -0.410 15.953 4.721 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -1.154 14.413 4.338 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -2.393 16.972 5.138 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -3.337 16.620 6.589 1.00 0.00 H new ATOM 217 N GLY A 17 3.218 12.913 6.106 1.00 0.00 N ATOM 218 CA GLY A 17 4.325 12.513 6.956 1.00 0.00 C ATOM 219 C GLY A 17 4.046 11.224 7.703 1.00 0.00 C ATOM 220 O GLY A 17 4.929 10.379 7.848 1.00 0.00 O ATOM 0 H GLY A 17 2.704 12.142 5.680 1.00 0.00 H new ATOM 0 HA2 GLY A 17 5.221 12.390 6.347 1.00 0.00 H new ATOM 0 HA3 GLY A 17 4.534 13.307 7.673 1.00 0.00 H new ATOM 224 N ARG A 18 2.815 11.074 8.181 1.00 0.00 N ATOM 225 CA ARG A 18 2.423 9.880 8.921 1.00 0.00 C ATOM 226 C ARG A 18 2.662 8.623 8.090 1.00 0.00 C ATOM 227 O ARG A 18 2.380 8.596 6.892 1.00 0.00 O ATOM 228 CB ARG A 18 0.949 9.964 9.324 1.00 0.00 C ATOM 229 CG ARG A 18 0.703 10.823 10.554 1.00 0.00 C ATOM 230 CD ARG A 18 -0.644 10.513 11.188 1.00 0.00 C ATOM 231 NE ARG A 18 -1.216 11.680 11.855 1.00 0.00 N ATOM 232 CZ ARG A 18 -0.703 12.222 12.954 1.00 0.00 C ATOM 233 NH1 ARG A 18 0.387 11.706 13.505 1.00 0.00 N ATOM 234 NH2 ARG A 18 -1.280 13.283 13.503 1.00 0.00 N ATOM 0 H ARG A 18 2.072 11.764 8.069 1.00 0.00 H new ATOM 0 HA ARG A 18 3.036 9.823 9.820 1.00 0.00 H new ATOM 0 HB2 ARG A 18 0.375 10.366 8.489 1.00 0.00 H new ATOM 0 HB3 ARG A 18 0.575 8.958 9.513 1.00 0.00 H new ATOM 0 HG2 ARG A 18 1.497 10.654 11.282 1.00 0.00 H new ATOM 0 HG3 ARG A 18 0.743 11.877 10.278 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -1.333 10.160 10.421 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.528 9.704 11.909 1.00 0.00 H new ATOM 0 HE ARG A 18 -2.055 12.101 11.455 1.00 0.00 H new ATOM 0 HH11 ARG A 18 0.834 10.891 13.085 1.00 0.00 H new ATOM 0 HH12 ARG A 18 0.779 12.124 14.349 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -2.118 13.683 13.081 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -0.886 13.699 14.347 1.00 0.00 H new ATOM 248 N GLU A 19 3.186 7.584 8.734 1.00 0.00 N ATOM 249 CA GLU A 19 3.465 6.325 8.053 1.00 0.00 C ATOM 250 C GLU A 19 2.943 5.142 8.863 1.00 0.00 C ATOM 251 O GLU A 19 2.420 5.313 9.965 1.00 0.00 O ATOM 252 CB GLU A 19 4.968 6.171 7.815 1.00 0.00 C ATOM 253 CG GLU A 19 5.782 6.089 9.095 1.00 0.00 C ATOM 254 CD GLU A 19 7.258 5.854 8.834 1.00 0.00 C ATOM 255 OE1 GLU A 19 7.810 6.504 7.922 1.00 0.00 O ATOM 256 OE2 GLU A 19 7.859 5.020 9.542 1.00 0.00 O ATOM 0 H GLU A 19 3.426 7.590 9.725 1.00 0.00 H new ATOM 0 HA GLU A 19 2.952 6.339 7.091 1.00 0.00 H new ATOM 0 HB2 GLU A 19 5.143 5.272 7.225 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.322 7.015 7.223 1.00 0.00 H new ATOM 0 HG2 GLU A 19 5.659 7.014 9.659 1.00 0.00 H new ATOM 0 HG3 GLU A 19 5.394 5.282 9.717 1.00 0.00 H new ATOM 263 N CYS A 20 3.088 3.944 8.309 1.00 0.00 N ATOM 264 CA CYS A 20 2.631 2.731 8.978 1.00 0.00 C ATOM 265 C CYS A 20 3.180 1.488 8.286 1.00 0.00 C ATOM 266 O CYS A 20 3.141 1.380 7.060 1.00 0.00 O ATOM 267 CB CYS A 20 1.103 2.683 9.004 1.00 0.00 C ATOM 268 SG CYS A 20 0.334 2.792 7.371 1.00 0.00 S ATOM 0 H CYS A 20 3.519 3.786 7.398 1.00 0.00 H new ATOM 0 HA CYS A 20 3.004 2.748 10.002 1.00 0.00 H new ATOM 0 HB2 CYS A 20 0.787 1.755 9.481 1.00 0.00 H new ATOM 0 HB3 CYS A 20 0.735 3.501 9.623 1.00 0.00 H new ATOM 0 HG CYS A 20 -0.062 1.611 6.998 1.00 0.00 H new ATOM 274 N SER A 21 3.692 0.552 9.079 1.00 0.00 N ATOM 275 CA SER A 21 4.253 -0.682 8.542 1.00 0.00 C ATOM 276 C SER A 21 3.309 -1.856 8.777 1.00 0.00 C ATOM 277 O SER A 21 2.558 -1.879 9.754 1.00 0.00 O ATOM 278 CB SER A 21 5.613 -0.969 9.183 1.00 0.00 C ATOM 279 OG SER A 21 6.274 -2.032 8.520 1.00 0.00 O ATOM 0 H SER A 21 3.730 0.625 10.096 1.00 0.00 H new ATOM 0 HA SER A 21 4.385 -0.555 7.467 1.00 0.00 H new ATOM 0 HB2 SER A 21 6.232 -0.073 9.147 1.00 0.00 H new ATOM 0 HB3 SER A 21 5.477 -1.221 10.235 1.00 0.00 H new ATOM 0 HG SER A 21 5.990 -2.060 7.582 1.00 0.00 H new ATOM 285 N LEU A 22 3.351 -2.831 7.876 1.00 0.00 N ATOM 286 CA LEU A 22 2.500 -4.011 7.983 1.00 0.00 C ATOM 287 C LEU A 22 3.179 -5.231 7.370 1.00 0.00 C ATOM 288 O LEU A 22 4.159 -5.103 6.637 1.00 0.00 O ATOM 289 CB LEU A 22 1.158 -3.760 7.294 1.00 0.00 C ATOM 290 CG LEU A 22 0.087 -3.069 8.139 1.00 0.00 C ATOM 291 CD1 LEU A 22 -0.836 -2.241 7.259 1.00 0.00 C ATOM 292 CD2 LEU A 22 -0.709 -4.095 8.933 1.00 0.00 C ATOM 0 H LEU A 22 3.966 -2.828 7.062 1.00 0.00 H new ATOM 0 HA LEU A 22 2.327 -4.209 9.041 1.00 0.00 H new ATOM 0 HB2 LEU A 22 1.337 -3.155 6.405 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.762 -4.717 6.954 1.00 0.00 H new ATOM 0 HG LEU A 22 0.582 -2.399 8.842 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.591 -1.757 7.878 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -0.255 -1.482 6.735 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -1.324 -2.890 6.532 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.467 -3.586 9.529 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.193 -4.790 8.247 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.038 -4.645 9.593 1.00 0.00 H new ATOM 304 N GLN A 23 2.651 -6.412 7.675 1.00 0.00 N ATOM 305 CA GLN A 23 3.206 -7.654 7.152 1.00 0.00 C ATOM 306 C GLN A 23 2.266 -8.283 6.130 1.00 0.00 C ATOM 307 O GLN A 23 1.135 -8.647 6.452 1.00 0.00 O ATOM 308 CB GLN A 23 3.470 -8.639 8.293 1.00 0.00 C ATOM 309 CG GLN A 23 2.319 -8.752 9.278 1.00 0.00 C ATOM 310 CD GLN A 23 2.339 -7.658 10.328 1.00 0.00 C ATOM 311 OE1 GLN A 23 3.275 -6.860 10.391 1.00 0.00 O ATOM 312 NE2 GLN A 23 1.304 -7.615 11.159 1.00 0.00 N ATOM 0 H GLN A 23 1.840 -6.534 8.281 1.00 0.00 H new ATOM 0 HA GLN A 23 4.148 -7.421 6.656 1.00 0.00 H new ATOM 0 HB2 GLN A 23 3.675 -9.623 7.872 1.00 0.00 H new ATOM 0 HB3 GLN A 23 4.367 -8.329 8.829 1.00 0.00 H new ATOM 0 HG2 GLN A 23 1.375 -8.711 8.734 1.00 0.00 H new ATOM 0 HG3 GLN A 23 2.361 -9.724 9.770 1.00 0.00 H new ATOM 0 HE21 GLN A 23 0.550 -8.296 11.070 1.00 0.00 H new ATOM 0 HE22 GLN A 23 1.263 -6.900 11.886 1.00 0.00 H new ATOM 321 N VAL A 24 2.740 -8.407 4.894 1.00 0.00 N ATOM 322 CA VAL A 24 1.942 -8.993 3.824 1.00 0.00 C ATOM 323 C VAL A 24 2.810 -9.817 2.879 1.00 0.00 C ATOM 324 O VAL A 24 4.005 -9.569 2.719 1.00 0.00 O ATOM 325 CB VAL A 24 1.208 -7.908 3.014 1.00 0.00 C ATOM 326 CG1 VAL A 24 0.160 -7.218 3.873 1.00 0.00 C ATOM 327 CG2 VAL A 24 2.199 -6.899 2.454 1.00 0.00 C ATOM 0 H VAL A 24 3.673 -8.109 4.609 1.00 0.00 H new ATOM 0 HA VAL A 24 1.206 -9.644 4.297 1.00 0.00 H new ATOM 0 HB VAL A 24 0.700 -8.386 2.177 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -0.348 -6.455 3.284 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.567 -7.952 4.220 1.00 0.00 H new ATOM 0 HG13 VAL A 24 0.643 -6.752 4.732 1.00 0.00 H new ATOM 0 HG21 VAL A 24 1.663 -6.140 1.885 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.738 -6.424 3.274 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.908 -7.409 1.801 1.00 0.00 H new ATOM 337 N PRO A 25 2.196 -10.821 2.236 1.00 0.00 N ATOM 338 CA PRO A 25 2.893 -11.702 1.294 1.00 0.00 C ATOM 339 C PRO A 25 3.280 -10.984 0.006 1.00 0.00 C ATOM 340 O PRO A 25 3.011 -9.794 -0.156 1.00 0.00 O ATOM 341 CB PRO A 25 1.865 -12.799 1.007 1.00 0.00 C ATOM 342 CG PRO A 25 0.545 -12.158 1.264 1.00 0.00 C ATOM 343 CD PRO A 25 0.773 -11.173 2.378 1.00 0.00 C ATOM 0 HA PRO A 25 3.832 -12.075 1.704 1.00 0.00 H new ATOM 0 HB2 PRO A 25 1.940 -13.152 -0.021 1.00 0.00 H new ATOM 0 HB3 PRO A 25 2.018 -13.663 1.653 1.00 0.00 H new ATOM 0 HG2 PRO A 25 0.174 -11.657 0.370 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -0.201 -12.901 1.546 1.00 0.00 H new ATOM 0 HD2 PRO A 25 0.131 -10.298 2.278 1.00 0.00 H new ATOM 0 HD3 PRO A 25 0.563 -11.613 3.353 1.00 0.00 H new ATOM 351 N GLU A 26 3.913 -11.714 -0.906 1.00 0.00 N ATOM 352 CA GLU A 26 4.337 -11.145 -2.180 1.00 0.00 C ATOM 353 C GLU A 26 3.195 -11.166 -3.193 1.00 0.00 C ATOM 354 O GLU A 26 3.062 -10.259 -4.014 1.00 0.00 O ATOM 355 CB GLU A 26 5.538 -11.914 -2.733 1.00 0.00 C ATOM 356 CG GLU A 26 5.228 -13.360 -3.079 1.00 0.00 C ATOM 357 CD GLU A 26 6.477 -14.174 -3.358 1.00 0.00 C ATOM 358 OE1 GLU A 26 7.497 -13.578 -3.762 1.00 0.00 O ATOM 359 OE2 GLU A 26 6.434 -15.409 -3.171 1.00 0.00 O ATOM 0 H GLU A 26 4.144 -12.700 -0.787 1.00 0.00 H new ATOM 0 HA GLU A 26 4.627 -10.109 -2.007 1.00 0.00 H new ATOM 0 HB2 GLU A 26 5.904 -11.406 -3.625 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.344 -11.890 -1.999 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.678 -13.817 -2.256 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.577 -13.389 -3.953 1.00 0.00 H new ATOM 366 N ASP A 27 2.375 -12.209 -3.127 1.00 0.00 N ATOM 367 CA ASP A 27 1.244 -12.350 -4.037 1.00 0.00 C ATOM 368 C ASP A 27 -0.004 -11.690 -3.459 1.00 0.00 C ATOM 369 O ASP A 27 -1.127 -12.052 -3.809 1.00 0.00 O ATOM 370 CB ASP A 27 0.970 -13.828 -4.320 1.00 0.00 C ATOM 371 CG ASP A 27 0.208 -14.501 -3.195 1.00 0.00 C ATOM 372 OD1 ASP A 27 0.827 -14.790 -2.150 1.00 0.00 O ATOM 373 OD2 ASP A 27 -1.006 -14.740 -3.361 1.00 0.00 O ATOM 0 H ASP A 27 2.472 -12.969 -2.453 1.00 0.00 H new ATOM 0 HA ASP A 27 1.498 -11.850 -4.972 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.401 -13.918 -5.245 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.916 -14.347 -4.475 1.00 0.00 H new ATOM 378 N GLU A 28 0.201 -10.721 -2.573 1.00 0.00 N ATOM 379 CA GLU A 28 -0.908 -10.013 -1.945 1.00 0.00 C ATOM 380 C GLU A 28 -1.626 -9.122 -2.955 1.00 0.00 C ATOM 381 O GLU A 28 -0.994 -8.502 -3.812 1.00 0.00 O ATOM 382 CB GLU A 28 -0.406 -9.170 -0.771 1.00 0.00 C ATOM 383 CG GLU A 28 -1.504 -8.749 0.190 1.00 0.00 C ATOM 384 CD GLU A 28 -1.965 -9.884 1.083 1.00 0.00 C ATOM 385 OE1 GLU A 28 -2.066 -11.026 0.588 1.00 0.00 O ATOM 386 OE2 GLU A 28 -2.224 -9.630 2.278 1.00 0.00 O ATOM 0 H GLU A 28 1.125 -10.408 -2.274 1.00 0.00 H new ATOM 0 HA GLU A 28 -1.615 -10.755 -1.573 1.00 0.00 H new ATOM 0 HB2 GLU A 28 0.347 -9.737 -0.223 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.087 -8.279 -1.159 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.144 -7.928 0.810 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.354 -8.371 -0.378 1.00 0.00 H new ATOM 393 N LEU A 29 -2.949 -9.063 -2.848 1.00 0.00 N ATOM 394 CA LEU A 29 -3.754 -8.248 -3.752 1.00 0.00 C ATOM 395 C LEU A 29 -3.748 -6.786 -3.318 1.00 0.00 C ATOM 396 O LEU A 29 -3.948 -6.475 -2.143 1.00 0.00 O ATOM 397 CB LEU A 29 -5.190 -8.772 -3.799 1.00 0.00 C ATOM 398 CG LEU A 29 -5.350 -10.293 -3.800 1.00 0.00 C ATOM 399 CD1 LEU A 29 -6.767 -10.681 -3.408 1.00 0.00 C ATOM 400 CD2 LEU A 29 -4.997 -10.865 -5.165 1.00 0.00 C ATOM 0 H LEU A 29 -3.487 -9.569 -2.145 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.317 -8.314 -4.748 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.730 -8.370 -2.942 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.671 -8.376 -4.693 1.00 0.00 H new ATOM 0 HG LEU A 29 -4.664 -10.712 -3.064 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -6.862 -11.767 -3.414 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -6.984 -10.304 -2.409 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -7.472 -10.251 -4.120 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -5.116 -11.948 -5.148 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -5.658 -10.439 -5.920 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.963 -10.618 -5.407 1.00 0.00 H new ATOM 412 N VAL A 30 -3.519 -5.891 -4.274 1.00 0.00 N ATOM 413 CA VAL A 30 -3.491 -4.461 -3.992 1.00 0.00 C ATOM 414 C VAL A 30 -4.759 -4.018 -3.271 1.00 0.00 C ATOM 415 O VAL A 30 -4.739 -3.071 -2.485 1.00 0.00 O ATOM 416 CB VAL A 30 -3.333 -3.637 -5.284 1.00 0.00 C ATOM 417 CG1 VAL A 30 -3.167 -2.161 -4.958 1.00 0.00 C ATOM 418 CG2 VAL A 30 -2.156 -4.148 -6.100 1.00 0.00 C ATOM 0 H VAL A 30 -3.350 -6.131 -5.251 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.630 -4.282 -3.348 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.237 -3.752 -5.882 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.057 -1.594 -5.883 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.045 -1.807 -4.418 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.280 -2.022 -4.340 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.059 -3.555 -7.009 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.242 -4.064 -5.512 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.322 -5.192 -6.364 1.00 0.00 H new ATOM 428 N SER A 31 -5.861 -4.710 -3.543 1.00 0.00 N ATOM 429 CA SER A 31 -7.140 -4.385 -2.923 1.00 0.00 C ATOM 430 C SER A 31 -7.089 -4.624 -1.417 1.00 0.00 C ATOM 431 O SER A 31 -7.613 -3.832 -0.633 1.00 0.00 O ATOM 432 CB SER A 31 -8.259 -5.222 -3.546 1.00 0.00 C ATOM 433 OG SER A 31 -9.482 -5.032 -2.856 1.00 0.00 O ATOM 0 H SER A 31 -5.894 -5.499 -4.189 1.00 0.00 H new ATOM 0 HA SER A 31 -7.344 -3.329 -3.099 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.382 -4.948 -4.594 1.00 0.00 H new ATOM 0 HB3 SER A 31 -7.985 -6.277 -3.523 1.00 0.00 H new ATOM 0 HG SER A 31 -10.181 -5.576 -3.274 1.00 0.00 H new ATOM 439 N THR A 32 -6.454 -5.722 -1.019 1.00 0.00 N ATOM 440 CA THR A 32 -6.335 -6.067 0.392 1.00 0.00 C ATOM 441 C THR A 32 -5.207 -5.285 1.056 1.00 0.00 C ATOM 442 O THR A 32 -5.311 -4.892 2.219 1.00 0.00 O ATOM 443 CB THR A 32 -6.080 -7.574 0.582 1.00 0.00 C ATOM 444 OG1 THR A 32 -7.181 -8.326 0.059 1.00 0.00 O ATOM 445 CG2 THR A 32 -5.885 -7.908 2.054 1.00 0.00 C ATOM 0 H THR A 32 -6.014 -6.388 -1.654 1.00 0.00 H new ATOM 0 HA THR A 32 -7.282 -5.804 0.863 1.00 0.00 H new ATOM 0 HB THR A 32 -5.171 -7.838 0.042 1.00 0.00 H new ATOM 0 HG1 THR A 32 -7.011 -9.283 0.182 1.00 0.00 H new ATOM 0 HG21 THR A 32 -5.706 -8.978 2.164 1.00 0.00 H new ATOM 0 HG22 THR A 32 -5.029 -7.356 2.442 1.00 0.00 H new ATOM 0 HG23 THR A 32 -6.779 -7.630 2.612 1.00 0.00 H new ATOM 453 N LEU A 33 -4.131 -5.061 0.311 1.00 0.00 N ATOM 454 CA LEU A 33 -2.983 -4.324 0.827 1.00 0.00 C ATOM 455 C LEU A 33 -3.382 -2.909 1.234 1.00 0.00 C ATOM 456 O LEU A 33 -2.725 -2.281 2.065 1.00 0.00 O ATOM 457 CB LEU A 33 -1.871 -4.270 -0.223 1.00 0.00 C ATOM 458 CG LEU A 33 -1.096 -5.569 -0.446 1.00 0.00 C ATOM 459 CD1 LEU A 33 -0.523 -5.613 -1.854 1.00 0.00 C ATOM 460 CD2 LEU A 33 0.011 -5.714 0.587 1.00 0.00 C ATOM 0 H LEU A 33 -4.029 -5.379 -0.653 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.615 -4.847 1.710 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.310 -3.964 -1.173 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -1.163 -3.493 0.066 1.00 0.00 H new ATOM 0 HG LEU A 33 -1.785 -6.405 -0.330 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.025 -6.544 -1.995 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.335 -5.557 -2.579 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.152 -4.769 -1.999 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.552 -6.644 0.413 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.699 -4.873 0.503 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.424 -5.729 1.586 1.00 0.00 H new ATOM 472 N LYS A 34 -4.465 -2.413 0.645 1.00 0.00 N ATOM 473 CA LYS A 34 -4.955 -1.074 0.948 1.00 0.00 C ATOM 474 C LYS A 34 -5.915 -1.101 2.134 1.00 0.00 C ATOM 475 O LYS A 34 -5.818 -0.274 3.040 1.00 0.00 O ATOM 476 CB LYS A 34 -5.655 -0.476 -0.274 1.00 0.00 C ATOM 477 CG LYS A 34 -4.727 -0.248 -1.455 1.00 0.00 C ATOM 478 CD LYS A 34 -5.496 -0.189 -2.765 1.00 0.00 C ATOM 479 CE LYS A 34 -4.687 0.497 -3.855 1.00 0.00 C ATOM 480 NZ LYS A 34 -4.835 1.978 -3.808 1.00 0.00 N ATOM 0 H LYS A 34 -5.020 -2.919 -0.045 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.099 -0.452 1.210 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -6.463 -1.140 -0.581 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -6.111 0.473 0.007 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -4.177 0.682 -1.313 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -3.990 -1.050 -1.500 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -5.754 -1.199 -3.083 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -6.433 0.347 -2.614 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -3.635 0.234 -3.746 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -5.008 0.131 -4.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -4.268 2.408 -4.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -5.835 2.231 -3.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -4.505 2.331 -2.887 1.00 0.00 H new ATOM 494 N GLN A 35 -6.838 -2.057 2.120 1.00 0.00 N ATOM 495 CA GLN A 35 -7.814 -2.191 3.195 1.00 0.00 C ATOM 496 C GLN A 35 -7.121 -2.296 4.550 1.00 0.00 C ATOM 497 O GLN A 35 -7.559 -1.695 5.532 1.00 0.00 O ATOM 498 CB GLN A 35 -8.694 -3.420 2.963 1.00 0.00 C ATOM 499 CG GLN A 35 -9.633 -3.281 1.776 1.00 0.00 C ATOM 500 CD GLN A 35 -10.501 -4.506 1.571 1.00 0.00 C ATOM 501 OE1 GLN A 35 -10.078 -5.632 1.836 1.00 0.00 O ATOM 502 NE2 GLN A 35 -11.723 -4.294 1.097 1.00 0.00 N ATOM 0 H GLN A 35 -6.931 -2.750 1.377 1.00 0.00 H new ATOM 0 HA GLN A 35 -8.440 -1.299 3.196 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -8.055 -4.290 2.810 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -9.282 -3.610 3.861 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -10.271 -2.409 1.922 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.048 -3.100 0.874 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -12.032 -3.344 0.891 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.352 -5.081 0.939 1.00 0.00 H new ATOM 511 N LEU A 36 -6.036 -3.062 4.596 1.00 0.00 N ATOM 512 CA LEU A 36 -5.282 -3.246 5.831 1.00 0.00 C ATOM 513 C LEU A 36 -4.930 -1.902 6.460 1.00 0.00 C ATOM 514 O LEU A 36 -5.248 -1.646 7.621 1.00 0.00 O ATOM 515 CB LEU A 36 -4.005 -4.043 5.558 1.00 0.00 C ATOM 516 CG LEU A 36 -4.190 -5.540 5.304 1.00 0.00 C ATOM 517 CD1 LEU A 36 -2.903 -6.155 4.777 1.00 0.00 C ATOM 518 CD2 LEU A 36 -4.638 -6.245 6.576 1.00 0.00 C ATOM 0 H LEU A 36 -5.659 -3.565 3.793 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.908 -3.801 6.530 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.506 -3.607 4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.334 -3.919 6.408 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.965 -5.668 4.549 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.054 -7.220 4.602 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.624 -5.670 3.842 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.107 -6.016 5.509 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.765 -7.309 6.377 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.885 -6.108 7.352 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.586 -5.823 6.911 1.00 0.00 H new ATOM 530 N VAL A 37 -4.274 -1.045 5.684 1.00 0.00 N ATOM 531 CA VAL A 37 -3.882 0.275 6.164 1.00 0.00 C ATOM 532 C VAL A 37 -5.102 1.162 6.392 1.00 0.00 C ATOM 533 O VAL A 37 -5.152 1.932 7.350 1.00 0.00 O ATOM 534 CB VAL A 37 -2.932 0.973 5.173 1.00 0.00 C ATOM 535 CG1 VAL A 37 -2.518 2.338 5.701 1.00 0.00 C ATOM 536 CG2 VAL A 37 -1.713 0.105 4.902 1.00 0.00 C ATOM 0 H VAL A 37 -4.003 -1.241 4.720 1.00 0.00 H new ATOM 0 HA VAL A 37 -3.363 0.126 7.111 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.461 1.120 4.232 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -1.847 2.816 4.987 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -3.403 2.959 5.838 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -2.007 2.219 6.656 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -1.053 0.614 4.200 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -1.180 -0.075 5.836 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -2.031 -0.847 4.476 1.00 0.00 H new ATOM 546 N SER A 38 -6.084 1.046 5.504 1.00 0.00 N ATOM 547 CA SER A 38 -7.304 1.840 5.606 1.00 0.00 C ATOM 548 C SER A 38 -7.797 1.894 7.049 1.00 0.00 C ATOM 549 O SER A 38 -8.498 2.827 7.441 1.00 0.00 O ATOM 550 CB SER A 38 -8.394 1.257 4.704 1.00 0.00 C ATOM 551 OG SER A 38 -9.133 0.255 5.381 1.00 0.00 O ATOM 0 H SER A 38 -6.059 0.411 4.706 1.00 0.00 H new ATOM 0 HA SER A 38 -7.077 2.855 5.279 1.00 0.00 H new ATOM 0 HB2 SER A 38 -9.065 2.052 4.379 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.941 0.836 3.807 1.00 0.00 H new ATOM 0 HG SER A 38 -8.678 -0.608 5.285 1.00 0.00 H new ATOM 557 N GLU A 39 -7.425 0.888 7.833 1.00 0.00 N ATOM 558 CA GLU A 39 -7.830 0.821 9.233 1.00 0.00 C ATOM 559 C GLU A 39 -6.754 1.411 10.140 1.00 0.00 C ATOM 560 O GLU A 39 -7.057 2.061 11.140 1.00 0.00 O ATOM 561 CB GLU A 39 -8.114 -0.628 9.635 1.00 0.00 C ATOM 562 CG GLU A 39 -9.303 -1.238 8.913 1.00 0.00 C ATOM 563 CD GLU A 39 -9.879 -2.435 9.645 1.00 0.00 C ATOM 564 OE1 GLU A 39 -10.044 -2.353 10.879 1.00 0.00 O ATOM 565 OE2 GLU A 39 -10.164 -3.454 8.981 1.00 0.00 O ATOM 0 H GLU A 39 -6.844 0.108 7.524 1.00 0.00 H new ATOM 0 HA GLU A 39 -8.741 1.409 9.350 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -7.229 -1.232 9.434 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -8.292 -0.670 10.710 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -10.079 -0.481 8.795 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -8.998 -1.541 7.911 1.00 0.00 H new ATOM 572 N LYS A 40 -5.495 1.179 9.783 1.00 0.00 N ATOM 573 CA LYS A 40 -4.373 1.686 10.562 1.00 0.00 C ATOM 574 C LYS A 40 -4.463 3.200 10.724 1.00 0.00 C ATOM 575 O LYS A 40 -4.631 3.707 11.835 1.00 0.00 O ATOM 576 CB LYS A 40 -3.049 1.313 9.890 1.00 0.00 C ATOM 577 CG LYS A 40 -2.489 -0.022 10.349 1.00 0.00 C ATOM 578 CD LYS A 40 -3.424 -1.168 10.000 1.00 0.00 C ATOM 579 CE LYS A 40 -3.215 -2.360 10.922 1.00 0.00 C ATOM 580 NZ LYS A 40 -4.345 -3.326 10.845 1.00 0.00 N ATOM 0 H LYS A 40 -5.227 0.642 8.958 1.00 0.00 H new ATOM 0 HA LYS A 40 -4.414 1.229 11.551 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -3.195 1.284 8.810 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -2.316 2.094 10.092 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -1.517 -0.189 9.884 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -2.327 0.001 11.427 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -4.458 -0.830 10.070 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -3.258 -1.473 8.967 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -2.286 -2.866 10.657 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -3.106 -2.010 11.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -4.164 -4.123 11.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -5.227 -2.851 11.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.434 -3.680 9.871 1.00 0.00 H new ATOM 594 N LEU A 41 -4.353 3.918 9.612 1.00 0.00 N ATOM 595 CA LEU A 41 -4.425 5.375 9.631 1.00 0.00 C ATOM 596 C LEU A 41 -5.869 5.851 9.506 1.00 0.00 C ATOM 597 O LEU A 41 -6.125 7.028 9.259 1.00 0.00 O ATOM 598 CB LEU A 41 -3.582 5.961 8.496 1.00 0.00 C ATOM 599 CG LEU A 41 -2.070 5.773 8.618 1.00 0.00 C ATOM 600 CD1 LEU A 41 -1.373 6.212 7.339 1.00 0.00 C ATOM 601 CD2 LEU A 41 -1.531 6.546 9.813 1.00 0.00 C ATOM 0 H LEU A 41 -4.214 3.515 8.685 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.030 5.722 10.586 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -3.909 5.512 7.558 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -3.791 7.029 8.429 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.866 4.714 8.774 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.297 6.071 7.444 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -1.737 5.615 6.503 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -1.584 7.265 7.152 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -0.453 6.401 9.884 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.746 7.607 9.687 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.007 6.185 10.725 1.00 0.00 H new ATOM 613 N ASN A 42 -6.808 4.927 9.680 1.00 0.00 N ATOM 614 CA ASN A 42 -8.227 5.253 9.589 1.00 0.00 C ATOM 615 C ASN A 42 -8.514 6.087 8.344 1.00 0.00 C ATOM 616 O ASN A 42 -9.208 7.101 8.409 1.00 0.00 O ATOM 617 CB ASN A 42 -8.679 6.010 10.839 1.00 0.00 C ATOM 618 CG ASN A 42 -8.944 5.085 12.011 1.00 0.00 C ATOM 619 OD1 ASN A 42 -8.394 3.986 12.085 1.00 0.00 O ATOM 620 ND2 ASN A 42 -9.790 5.527 12.934 1.00 0.00 N ATOM 0 H ASN A 42 -6.612 3.947 9.885 1.00 0.00 H new ATOM 0 HA ASN A 42 -8.785 4.320 9.516 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -7.914 6.735 11.118 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.584 6.573 10.612 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -10.007 4.949 13.746 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -10.223 6.445 12.831 1.00 0.00 H new ATOM 627 N VAL A 43 -7.975 5.651 7.209 1.00 0.00 N ATOM 628 CA VAL A 43 -8.175 6.356 5.948 1.00 0.00 C ATOM 629 C VAL A 43 -8.924 5.486 4.945 1.00 0.00 C ATOM 630 O VAL A 43 -8.665 4.290 4.807 1.00 0.00 O ATOM 631 CB VAL A 43 -6.833 6.792 5.331 1.00 0.00 C ATOM 632 CG1 VAL A 43 -7.063 7.535 4.024 1.00 0.00 C ATOM 633 CG2 VAL A 43 -6.050 7.652 6.312 1.00 0.00 C ATOM 0 H VAL A 43 -7.397 4.814 7.137 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.769 7.242 6.171 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.245 5.900 5.116 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -6.104 7.835 3.603 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -7.580 6.882 3.321 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -7.670 8.421 4.211 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.105 7.951 5.859 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.630 8.540 6.561 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.853 7.081 7.220 1.00 0.00 H new ATOM 643 N PRO A 44 -9.877 6.098 4.227 1.00 0.00 N ATOM 644 CA PRO A 44 -10.683 5.398 3.222 1.00 0.00 C ATOM 645 C PRO A 44 -9.869 5.010 1.993 1.00 0.00 C ATOM 646 O PRO A 44 -9.278 5.864 1.332 1.00 0.00 O ATOM 647 CB PRO A 44 -11.756 6.426 2.850 1.00 0.00 C ATOM 648 CG PRO A 44 -11.137 7.746 3.153 1.00 0.00 C ATOM 649 CD PRO A 44 -10.240 7.521 4.339 1.00 0.00 C ATOM 0 HA PRO A 44 -11.085 4.460 3.604 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.030 6.349 1.798 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -12.667 6.274 3.428 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -10.569 8.116 2.299 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -11.899 8.492 3.376 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -9.360 8.164 4.305 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -10.753 7.732 5.277 1.00 0.00 H new ATOM 657 N VAL A 45 -9.842 3.715 1.692 1.00 0.00 N ATOM 658 CA VAL A 45 -9.101 3.213 0.541 1.00 0.00 C ATOM 659 C VAL A 45 -9.392 4.044 -0.704 1.00 0.00 C ATOM 660 O VAL A 45 -8.492 4.335 -1.492 1.00 0.00 O ATOM 661 CB VAL A 45 -9.442 1.739 0.253 1.00 0.00 C ATOM 662 CG1 VAL A 45 -8.671 1.240 -0.959 1.00 0.00 C ATOM 663 CG2 VAL A 45 -9.152 0.878 1.472 1.00 0.00 C ATOM 0 H VAL A 45 -10.325 2.995 2.229 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.042 3.291 0.787 1.00 0.00 H new ATOM 0 HB VAL A 45 -10.507 1.666 0.031 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -8.925 0.197 -1.147 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -8.934 1.840 -1.830 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.601 1.325 -0.770 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.399 -0.160 1.251 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.095 0.953 1.728 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.754 1.223 2.313 1.00 0.00 H new ATOM 673 N ARG A 46 -10.654 4.422 -0.875 1.00 0.00 N ATOM 674 CA ARG A 46 -11.064 5.219 -2.025 1.00 0.00 C ATOM 675 C ARG A 46 -10.139 6.418 -2.213 1.00 0.00 C ATOM 676 O ARG A 46 -9.836 6.809 -3.340 1.00 0.00 O ATOM 677 CB ARG A 46 -12.507 5.696 -1.853 1.00 0.00 C ATOM 678 CG ARG A 46 -13.540 4.600 -2.055 1.00 0.00 C ATOM 679 CD ARG A 46 -14.903 5.175 -2.405 1.00 0.00 C ATOM 680 NE ARG A 46 -15.446 5.994 -1.324 1.00 0.00 N ATOM 681 CZ ARG A 46 -16.515 6.771 -1.457 1.00 0.00 C ATOM 682 NH1 ARG A 46 -17.153 6.834 -2.617 1.00 0.00 N ATOM 683 NH2 ARG A 46 -16.949 7.486 -0.427 1.00 0.00 N ATOM 0 H ARG A 46 -11.411 4.189 -0.232 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.000 4.590 -2.913 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.625 6.115 -0.854 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.701 6.501 -2.561 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.211 3.931 -2.850 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -13.619 4.001 -1.147 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -14.821 5.777 -3.310 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -15.594 4.361 -2.625 1.00 0.00 H new ATOM 0 HE ARG A 46 -14.979 5.968 -0.418 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -16.823 6.285 -3.411 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -17.974 7.432 -2.716 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -16.462 7.439 0.468 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.770 8.082 -0.530 1.00 0.00 H new ATOM 697 N GLN A 47 -9.695 6.997 -1.102 1.00 0.00 N ATOM 698 CA GLN A 47 -8.806 8.152 -1.145 1.00 0.00 C ATOM 699 C GLN A 47 -7.349 7.713 -1.241 1.00 0.00 C ATOM 700 O GLN A 47 -6.732 7.806 -2.302 1.00 0.00 O ATOM 701 CB GLN A 47 -9.008 9.024 0.095 1.00 0.00 C ATOM 702 CG GLN A 47 -10.411 9.598 0.213 1.00 0.00 C ATOM 703 CD GLN A 47 -10.808 10.423 -0.996 1.00 0.00 C ATOM 704 OE1 GLN A 47 -10.014 11.441 -1.304 1.00 0.00 O flip ATOM 705 NE2 GLN A 47 -11.817 10.148 -1.646 1.00 0.00 N flip ATOM 0 H GLN A 47 -9.936 6.685 -0.161 1.00 0.00 H new ATOM 0 HA GLN A 47 -9.050 8.735 -2.033 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -8.790 8.433 0.984 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -8.290 9.844 0.074 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -11.123 8.783 0.342 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -10.472 10.218 1.107 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -12.399 9.356 -1.373 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -12.071 10.712 -2.457 1.00 0.00 H new ATOM 714 N GLN A 48 -6.805 7.236 -0.126 1.00 0.00 N ATOM 715 CA GLN A 48 -5.419 6.785 -0.085 1.00 0.00 C ATOM 716 C GLN A 48 -5.048 6.050 -1.368 1.00 0.00 C ATOM 717 O GLN A 48 -5.748 5.131 -1.794 1.00 0.00 O ATOM 718 CB GLN A 48 -5.193 5.873 1.123 1.00 0.00 C ATOM 719 CG GLN A 48 -6.133 4.679 1.168 1.00 0.00 C ATOM 720 CD GLN A 48 -5.984 3.867 2.439 1.00 0.00 C ATOM 721 OE1 GLN A 48 -5.783 4.418 3.522 1.00 0.00 O ATOM 722 NE2 GLN A 48 -6.082 2.548 2.315 1.00 0.00 N ATOM 0 H GLN A 48 -7.303 7.152 0.760 1.00 0.00 H new ATOM 0 HA GLN A 48 -4.780 7.663 0.007 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.164 5.514 1.109 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -5.315 6.456 2.036 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -7.162 5.028 1.083 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -5.942 4.038 0.307 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.249 2.133 1.398 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -5.990 1.950 3.136 1.00 0.00 H new ATOM 731 N ARG A 49 -3.942 6.461 -1.981 1.00 0.00 N ATOM 732 CA ARG A 49 -3.479 5.842 -3.218 1.00 0.00 C ATOM 733 C ARG A 49 -2.075 5.270 -3.046 1.00 0.00 C ATOM 734 O ARG A 49 -1.170 5.952 -2.565 1.00 0.00 O ATOM 735 CB ARG A 49 -3.490 6.862 -4.358 1.00 0.00 C ATOM 736 CG ARG A 49 -2.430 6.603 -5.417 1.00 0.00 C ATOM 737 CD ARG A 49 -2.767 7.302 -6.724 1.00 0.00 C ATOM 738 NE ARG A 49 -3.383 8.608 -6.505 1.00 0.00 N ATOM 739 CZ ARG A 49 -3.462 9.550 -7.438 1.00 0.00 C ATOM 740 NH1 ARG A 49 -2.966 9.332 -8.648 1.00 0.00 N ATOM 741 NH2 ARG A 49 -4.038 10.713 -7.161 1.00 0.00 N ATOM 0 H ARG A 49 -3.350 7.219 -1.642 1.00 0.00 H new ATOM 0 HA ARG A 49 -4.158 5.025 -3.464 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.472 6.856 -4.830 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -3.342 7.859 -3.944 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -1.462 6.950 -5.057 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -2.340 5.530 -5.589 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -1.859 7.424 -7.314 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -3.443 6.676 -7.306 1.00 0.00 H new ATOM 0 HE ARG A 49 -3.774 8.808 -5.584 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -2.523 8.439 -8.864 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -3.028 10.057 -9.363 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -4.420 10.884 -6.231 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -4.098 11.436 -7.878 1.00 0.00 H new ATOM 755 N LEU A 50 -1.902 4.014 -3.443 1.00 0.00 N ATOM 756 CA LEU A 50 -0.608 3.349 -3.333 1.00 0.00 C ATOM 757 C LEU A 50 0.246 3.612 -4.569 1.00 0.00 C ATOM 758 O LEU A 50 -0.217 3.465 -5.700 1.00 0.00 O ATOM 759 CB LEU A 50 -0.801 1.843 -3.144 1.00 0.00 C ATOM 760 CG LEU A 50 -1.274 1.396 -1.760 1.00 0.00 C ATOM 761 CD1 LEU A 50 -1.439 -0.115 -1.715 1.00 0.00 C ATOM 762 CD2 LEU A 50 -0.299 1.859 -0.688 1.00 0.00 C ATOM 0 H LEU A 50 -2.641 3.436 -3.844 1.00 0.00 H new ATOM 0 HA LEU A 50 -0.091 3.755 -2.464 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.522 1.494 -3.883 1.00 0.00 H new ATOM 0 HB3 LEU A 50 0.144 1.346 -3.361 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.244 1.853 -1.563 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.776 -0.415 -0.723 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.176 -0.423 -2.457 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.483 -0.592 -1.933 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -0.652 1.532 0.290 1.00 0.00 H new ATOM 0 HD22 LEU A 50 0.684 1.430 -0.881 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.230 2.947 -0.704 1.00 0.00 H new ATOM 774 N LEU A 51 1.497 4.001 -4.345 1.00 0.00 N ATOM 775 CA LEU A 51 2.418 4.283 -5.440 1.00 0.00 C ATOM 776 C LEU A 51 3.753 3.577 -5.225 1.00 0.00 C ATOM 777 O LEU A 51 4.248 3.492 -4.101 1.00 0.00 O ATOM 778 CB LEU A 51 2.641 5.791 -5.570 1.00 0.00 C ATOM 779 CG LEU A 51 1.514 6.581 -6.236 1.00 0.00 C ATOM 780 CD1 LEU A 51 1.688 8.071 -5.988 1.00 0.00 C ATOM 781 CD2 LEU A 51 1.468 6.289 -7.729 1.00 0.00 C ATOM 0 H LEU A 51 1.896 4.128 -3.415 1.00 0.00 H new ATOM 0 HA LEU A 51 1.973 3.907 -6.361 1.00 0.00 H new ATOM 0 HB2 LEU A 51 2.805 6.201 -4.574 1.00 0.00 H new ATOM 0 HB3 LEU A 51 3.557 5.955 -6.137 1.00 0.00 H new ATOM 0 HG LEU A 51 0.567 6.268 -5.795 1.00 0.00 H new ATOM 0 HD11 LEU A 51 0.877 8.617 -6.469 1.00 0.00 H new ATOM 0 HD12 LEU A 51 1.670 8.266 -4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.642 8.400 -6.401 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.660 6.860 -8.187 1.00 0.00 H new ATOM 0 HD22 LEU A 51 2.416 6.573 -8.185 1.00 0.00 H new ATOM 0 HD23 LEU A 51 1.295 5.224 -7.886 1.00 0.00 H new ATOM 793 N PHE A 52 4.331 3.072 -6.310 1.00 0.00 N ATOM 794 CA PHE A 52 5.610 2.374 -6.240 1.00 0.00 C ATOM 795 C PHE A 52 6.595 2.941 -7.258 1.00 0.00 C ATOM 796 O PHE A 52 6.400 2.812 -8.466 1.00 0.00 O ATOM 797 CB PHE A 52 5.411 0.877 -6.484 1.00 0.00 C ATOM 798 CG PHE A 52 6.678 0.078 -6.371 1.00 0.00 C ATOM 799 CD1 PHE A 52 7.224 -0.207 -5.129 1.00 0.00 C ATOM 800 CD2 PHE A 52 7.323 -0.388 -7.505 1.00 0.00 C ATOM 801 CE1 PHE A 52 8.390 -0.942 -5.023 1.00 0.00 C ATOM 802 CE2 PHE A 52 8.489 -1.124 -7.404 1.00 0.00 C ATOM 803 CZ PHE A 52 9.023 -1.401 -6.161 1.00 0.00 C ATOM 0 H PHE A 52 3.934 3.133 -7.248 1.00 0.00 H new ATOM 0 HA PHE A 52 6.022 2.521 -5.242 1.00 0.00 H new ATOM 0 HB2 PHE A 52 4.684 0.494 -5.768 1.00 0.00 H new ATOM 0 HB3 PHE A 52 4.987 0.732 -7.478 1.00 0.00 H new ATOM 0 HD1 PHE A 52 6.733 0.149 -4.235 1.00 0.00 H new ATOM 0 HD2 PHE A 52 6.910 -0.174 -8.480 1.00 0.00 H new ATOM 0 HE1 PHE A 52 8.806 -1.157 -4.050 1.00 0.00 H new ATOM 0 HE2 PHE A 52 8.982 -1.482 -8.296 1.00 0.00 H new ATOM 0 HZ PHE A 52 9.934 -1.975 -6.079 1.00 0.00 H new ATOM 813 N LYS A 53 7.655 3.570 -6.760 1.00 0.00 N ATOM 814 CA LYS A 53 8.672 4.156 -7.623 1.00 0.00 C ATOM 815 C LYS A 53 8.045 5.114 -8.631 1.00 0.00 C ATOM 816 O LYS A 53 8.543 5.273 -9.745 1.00 0.00 O ATOM 817 CB LYS A 53 9.442 3.057 -8.359 1.00 0.00 C ATOM 818 CG LYS A 53 10.232 2.146 -7.436 1.00 0.00 C ATOM 819 CD LYS A 53 11.454 2.850 -6.870 1.00 0.00 C ATOM 820 CE LYS A 53 12.229 1.946 -5.923 1.00 0.00 C ATOM 821 NZ LYS A 53 12.760 0.741 -6.618 1.00 0.00 N ATOM 0 H LYS A 53 7.831 3.686 -5.762 1.00 0.00 H new ATOM 0 HA LYS A 53 9.364 4.718 -6.996 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.739 2.455 -8.935 1.00 0.00 H new ATOM 0 HB3 LYS A 53 10.125 3.519 -9.072 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.593 1.811 -6.619 1.00 0.00 H new ATOM 0 HG3 LYS A 53 10.544 1.256 -7.982 1.00 0.00 H new ATOM 0 HD2 LYS A 53 12.104 3.166 -7.686 1.00 0.00 H new ATOM 0 HD3 LYS A 53 11.144 3.752 -6.342 1.00 0.00 H new ATOM 0 HE2 LYS A 53 13.055 2.504 -5.482 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.580 1.636 -5.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.445 0.258 -6.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.976 0.094 -6.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 13.231 1.028 -7.500 1.00 0.00 H new ATOM 835 N GLY A 54 6.947 5.750 -8.233 1.00 0.00 N ATOM 836 CA GLY A 54 6.271 6.685 -9.113 1.00 0.00 C ATOM 837 C GLY A 54 5.318 5.995 -10.069 1.00 0.00 C ATOM 838 O GLY A 54 4.936 6.561 -11.093 1.00 0.00 O ATOM 0 H GLY A 54 6.514 5.634 -7.317 1.00 0.00 H new ATOM 0 HA2 GLY A 54 5.719 7.409 -8.514 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.013 7.243 -9.684 1.00 0.00 H new ATOM 842 N LYS A 55 4.934 4.768 -9.736 1.00 0.00 N ATOM 843 CA LYS A 55 4.020 3.998 -10.572 1.00 0.00 C ATOM 844 C LYS A 55 2.690 3.774 -9.861 1.00 0.00 C ATOM 845 O LYS A 55 2.657 3.414 -8.685 1.00 0.00 O ATOM 846 CB LYS A 55 4.646 2.652 -10.942 1.00 0.00 C ATOM 847 CG LYS A 55 4.182 2.113 -12.284 1.00 0.00 C ATOM 848 CD LYS A 55 2.843 1.403 -12.167 1.00 0.00 C ATOM 849 CE LYS A 55 2.177 1.241 -13.524 1.00 0.00 C ATOM 850 NZ LYS A 55 2.911 0.277 -14.390 1.00 0.00 N ATOM 0 H LYS A 55 5.242 4.285 -8.892 1.00 0.00 H new ATOM 0 HA LYS A 55 3.833 4.567 -11.483 1.00 0.00 H new ATOM 0 HB2 LYS A 55 5.731 2.758 -10.958 1.00 0.00 H new ATOM 0 HB3 LYS A 55 4.408 1.925 -10.166 1.00 0.00 H new ATOM 0 HG2 LYS A 55 4.099 2.933 -12.997 1.00 0.00 H new ATOM 0 HG3 LYS A 55 4.928 1.422 -12.677 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.988 0.423 -11.713 1.00 0.00 H new ATOM 0 HD3 LYS A 55 2.187 1.968 -11.504 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.152 0.898 -13.387 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.125 2.210 -14.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 3.107 0.718 -15.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 3.808 0.014 -13.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.331 -0.575 -14.530 1.00 0.00 H new ATOM 864 N ALA A 56 1.595 3.989 -10.583 1.00 0.00 N ATOM 865 CA ALA A 56 0.262 3.806 -10.022 1.00 0.00 C ATOM 866 C ALA A 56 -0.124 2.332 -9.991 1.00 0.00 C ATOM 867 O ALA A 56 -0.106 1.653 -11.019 1.00 0.00 O ATOM 868 CB ALA A 56 -0.760 4.605 -10.818 1.00 0.00 C ATOM 0 H ALA A 56 1.605 4.290 -11.558 1.00 0.00 H new ATOM 0 HA ALA A 56 0.274 4.172 -8.995 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -1.751 4.459 -10.388 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -0.502 5.663 -10.783 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -0.760 4.266 -11.854 1.00 0.00 H new ATOM 874 N LEU A 57 -0.472 1.841 -8.807 1.00 0.00 N ATOM 875 CA LEU A 57 -0.862 0.445 -8.642 1.00 0.00 C ATOM 876 C LEU A 57 -2.372 0.280 -8.787 1.00 0.00 C ATOM 877 O LEU A 57 -3.140 1.171 -8.428 1.00 0.00 O ATOM 878 CB LEU A 57 -0.410 -0.074 -7.276 1.00 0.00 C ATOM 879 CG LEU A 57 1.007 0.310 -6.848 1.00 0.00 C ATOM 880 CD1 LEU A 57 1.393 -0.417 -5.569 1.00 0.00 C ATOM 881 CD2 LEU A 57 2.001 0.004 -7.959 1.00 0.00 C ATOM 0 H LEU A 57 -0.492 2.389 -7.947 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.375 -0.137 -9.424 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.107 0.291 -6.522 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.485 -1.161 -7.280 1.00 0.00 H new ATOM 0 HG LEU A 57 1.030 1.382 -6.653 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.404 -0.132 -5.279 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.698 -0.148 -4.774 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.354 -1.493 -5.736 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.004 0.284 -7.637 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.977 -1.062 -8.186 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.735 0.571 -8.851 1.00 0.00 H new ATOM 893 N ALA A 58 -2.789 -0.866 -9.314 1.00 0.00 N ATOM 894 CA ALA A 58 -4.206 -1.150 -9.502 1.00 0.00 C ATOM 895 C ALA A 58 -4.743 -2.033 -8.381 1.00 0.00 C ATOM 896 O ALA A 58 -4.239 -3.131 -8.147 1.00 0.00 O ATOM 897 CB ALA A 58 -4.438 -1.810 -10.853 1.00 0.00 C ATOM 0 H ALA A 58 -2.165 -1.613 -9.619 1.00 0.00 H new ATOM 0 HA ALA A 58 -4.747 -0.204 -9.475 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -5.501 -2.016 -10.979 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -4.101 -1.143 -11.646 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -3.879 -2.744 -10.902 1.00 0.00 H new ATOM 903 N ASP A 59 -5.768 -1.546 -7.690 1.00 0.00 N ATOM 904 CA ASP A 59 -6.374 -2.292 -6.593 1.00 0.00 C ATOM 905 C ASP A 59 -6.589 -3.751 -6.982 1.00 0.00 C ATOM 906 O ASP A 59 -6.595 -4.637 -6.128 1.00 0.00 O ATOM 907 CB ASP A 59 -7.706 -1.656 -6.190 1.00 0.00 C ATOM 908 CG ASP A 59 -8.554 -1.282 -7.389 1.00 0.00 C ATOM 909 OD1 ASP A 59 -9.037 -2.200 -8.084 1.00 0.00 O ATOM 910 OD2 ASP A 59 -8.735 -0.070 -7.633 1.00 0.00 O ATOM 0 H ASP A 59 -6.197 -0.638 -7.870 1.00 0.00 H new ATOM 0 HA ASP A 59 -5.693 -2.258 -5.743 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -8.261 -2.350 -5.559 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -7.514 -0.765 -5.592 1.00 0.00 H new ATOM 915 N GLY A 60 -6.767 -3.994 -8.277 1.00 0.00 N ATOM 916 CA GLY A 60 -6.982 -5.347 -8.756 1.00 0.00 C ATOM 917 C GLY A 60 -5.683 -6.074 -9.040 1.00 0.00 C ATOM 918 O GLY A 60 -5.593 -7.290 -8.870 1.00 0.00 O ATOM 0 H GLY A 60 -6.766 -3.278 -9.003 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -7.553 -5.905 -8.014 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -7.584 -5.316 -9.664 1.00 0.00 H new ATOM 922 N LYS A 61 -4.672 -5.329 -9.476 1.00 0.00 N ATOM 923 CA LYS A 61 -3.371 -5.909 -9.785 1.00 0.00 C ATOM 924 C LYS A 61 -2.714 -6.472 -8.529 1.00 0.00 C ATOM 925 O LYS A 61 -3.283 -6.412 -7.439 1.00 0.00 O ATOM 926 CB LYS A 61 -2.460 -4.858 -10.423 1.00 0.00 C ATOM 927 CG LYS A 61 -2.878 -4.463 -11.829 1.00 0.00 C ATOM 928 CD LYS A 61 -2.189 -5.320 -12.877 1.00 0.00 C ATOM 929 CE LYS A 61 -3.002 -6.563 -13.203 1.00 0.00 C ATOM 930 NZ LYS A 61 -2.621 -7.717 -12.343 1.00 0.00 N ATOM 0 H LYS A 61 -4.730 -4.321 -9.623 1.00 0.00 H new ATOM 0 HA LYS A 61 -3.523 -6.726 -10.491 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.449 -3.969 -9.793 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.440 -5.242 -10.451 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.959 -4.562 -11.930 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -2.637 -3.414 -12.000 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -2.037 -4.735 -13.784 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -1.203 -5.613 -12.518 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -4.063 -6.348 -13.073 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -2.857 -6.827 -14.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -2.082 -8.406 -12.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -2.035 -7.382 -11.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -3.479 -8.171 -11.970 1.00 0.00 H new ATOM 944 N ARG A 62 -1.513 -7.018 -8.689 1.00 0.00 N ATOM 945 CA ARG A 62 -0.778 -7.591 -7.568 1.00 0.00 C ATOM 946 C ARG A 62 0.632 -7.015 -7.490 1.00 0.00 C ATOM 947 O ARG A 62 1.228 -6.663 -8.509 1.00 0.00 O ATOM 948 CB ARG A 62 -0.712 -9.114 -7.699 1.00 0.00 C ATOM 949 CG ARG A 62 -2.054 -9.801 -7.505 1.00 0.00 C ATOM 950 CD ARG A 62 -1.902 -11.313 -7.440 1.00 0.00 C ATOM 951 NE ARG A 62 -1.934 -11.923 -8.766 1.00 0.00 N ATOM 952 CZ ARG A 62 -1.723 -13.216 -8.985 1.00 0.00 C ATOM 953 NH1 ARG A 62 -1.466 -14.031 -7.971 1.00 0.00 N ATOM 954 NH2 ARG A 62 -1.769 -13.697 -10.221 1.00 0.00 N ATOM 0 H ARG A 62 -1.028 -7.076 -9.585 1.00 0.00 H new ATOM 0 HA ARG A 62 -1.307 -7.334 -6.650 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -0.322 -9.369 -8.684 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -0.005 -9.503 -6.966 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -2.519 -9.441 -6.587 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -2.721 -9.536 -8.325 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -0.961 -11.562 -6.949 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -2.701 -11.732 -6.829 1.00 0.00 H new ATOM 0 HE ARG A 62 -2.129 -11.324 -9.568 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -1.430 -13.665 -7.019 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -1.304 -15.023 -8.143 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -1.966 -13.074 -11.004 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -1.607 -14.690 -10.388 1.00 0.00 H new ATOM 968 N LEU A 63 1.161 -6.921 -6.275 1.00 0.00 N ATOM 969 CA LEU A 63 2.502 -6.387 -6.063 1.00 0.00 C ATOM 970 C LEU A 63 3.546 -7.237 -6.780 1.00 0.00 C ATOM 971 O LEU A 63 4.483 -6.711 -7.381 1.00 0.00 O ATOM 972 CB LEU A 63 2.817 -6.325 -4.568 1.00 0.00 C ATOM 973 CG LEU A 63 2.027 -5.297 -3.757 1.00 0.00 C ATOM 974 CD1 LEU A 63 2.498 -5.281 -2.311 1.00 0.00 C ATOM 975 CD2 LEU A 63 2.158 -3.914 -4.377 1.00 0.00 C ATOM 0 H LEU A 63 0.682 -7.208 -5.421 1.00 0.00 H new ATOM 0 HA LEU A 63 2.535 -5.379 -6.477 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.639 -7.311 -4.139 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.880 -6.113 -4.450 1.00 0.00 H new ATOM 0 HG LEU A 63 0.975 -5.582 -3.772 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.924 -4.543 -1.750 1.00 0.00 H new ATOM 0 HD12 LEU A 63 2.352 -6.267 -1.870 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.556 -5.021 -2.276 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.589 -3.195 -3.787 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.208 -3.621 -4.393 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.771 -3.934 -5.396 1.00 0.00 H new ATOM 987 N SER A 64 3.377 -8.554 -6.714 1.00 0.00 N ATOM 988 CA SER A 64 4.305 -9.477 -7.355 1.00 0.00 C ATOM 989 C SER A 64 4.408 -9.193 -8.850 1.00 0.00 C ATOM 990 O SER A 64 5.467 -9.363 -9.455 1.00 0.00 O ATOM 991 CB SER A 64 3.859 -10.923 -7.128 1.00 0.00 C ATOM 992 OG SER A 64 4.913 -11.830 -7.397 1.00 0.00 O ATOM 0 H SER A 64 2.605 -9.005 -6.223 1.00 0.00 H new ATOM 0 HA SER A 64 5.288 -9.334 -6.907 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.523 -11.046 -6.098 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.008 -11.149 -7.770 1.00 0.00 H new ATOM 0 HG SER A 64 4.603 -12.747 -7.243 1.00 0.00 H new ATOM 998 N ASP A 65 3.299 -8.760 -9.441 1.00 0.00 N ATOM 999 CA ASP A 65 3.263 -8.451 -10.866 1.00 0.00 C ATOM 1000 C ASP A 65 4.155 -7.256 -11.186 1.00 0.00 C ATOM 1001 O ASP A 65 4.806 -7.216 -12.230 1.00 0.00 O ATOM 1002 CB ASP A 65 1.828 -8.167 -11.311 1.00 0.00 C ATOM 1003 CG ASP A 65 1.611 -8.453 -12.784 1.00 0.00 C ATOM 1004 OD1 ASP A 65 2.481 -8.073 -13.596 1.00 0.00 O ATOM 1005 OD2 ASP A 65 0.571 -9.055 -13.125 1.00 0.00 O ATOM 0 H ASP A 65 2.414 -8.615 -8.955 1.00 0.00 H new ATOM 0 HA ASP A 65 3.639 -9.317 -11.410 1.00 0.00 H new ATOM 0 HB2 ASP A 65 1.141 -8.774 -10.721 1.00 0.00 H new ATOM 0 HB3 ASP A 65 1.587 -7.124 -11.107 1.00 0.00 H new ATOM 1010 N TYR A 66 4.178 -6.283 -10.281 1.00 0.00 N ATOM 1011 CA TYR A 66 4.987 -5.085 -10.469 1.00 0.00 C ATOM 1012 C TYR A 66 6.442 -5.344 -10.089 1.00 0.00 C ATOM 1013 O TYR A 66 7.230 -4.412 -9.933 1.00 0.00 O ATOM 1014 CB TYR A 66 4.429 -3.931 -9.633 1.00 0.00 C ATOM 1015 CG TYR A 66 3.165 -3.328 -10.203 1.00 0.00 C ATOM 1016 CD1 TYR A 66 3.213 -2.457 -11.285 1.00 0.00 C ATOM 1017 CD2 TYR A 66 1.922 -3.629 -9.659 1.00 0.00 C ATOM 1018 CE1 TYR A 66 2.061 -1.903 -11.808 1.00 0.00 C ATOM 1019 CE2 TYR A 66 0.764 -3.080 -10.177 1.00 0.00 C ATOM 1020 CZ TYR A 66 0.839 -2.218 -11.251 1.00 0.00 C ATOM 1021 OH TYR A 66 -0.311 -1.668 -11.770 1.00 0.00 O ATOM 0 H TYR A 66 3.646 -6.301 -9.411 1.00 0.00 H new ATOM 0 HA TYR A 66 4.948 -4.814 -11.524 1.00 0.00 H new ATOM 0 HB2 TYR A 66 4.228 -4.289 -8.623 1.00 0.00 H new ATOM 0 HB3 TYR A 66 5.188 -3.153 -9.550 1.00 0.00 H new ATOM 0 HD1 TYR A 66 4.168 -2.209 -11.725 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.860 -4.303 -8.817 1.00 0.00 H new ATOM 0 HE1 TYR A 66 2.117 -1.227 -12.648 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -0.194 -3.325 -9.743 1.00 0.00 H new ATOM 0 HH TYR A 66 -1.086 -1.992 -11.265 1.00 0.00 H new ATOM 1031 N SER A 67 6.790 -6.619 -9.943 1.00 0.00 N ATOM 1032 CA SER A 67 8.149 -7.003 -9.579 1.00 0.00 C ATOM 1033 C SER A 67 8.601 -6.271 -8.320 1.00 0.00 C ATOM 1034 O SER A 67 9.723 -5.768 -8.250 1.00 0.00 O ATOM 1035 CB SER A 67 9.111 -6.705 -10.730 1.00 0.00 C ATOM 1036 OG SER A 67 10.262 -7.529 -10.659 1.00 0.00 O ATOM 0 H SER A 67 6.150 -7.403 -10.071 1.00 0.00 H new ATOM 0 HA SER A 67 8.156 -8.074 -9.377 1.00 0.00 H new ATOM 0 HB2 SER A 67 8.604 -6.864 -11.682 1.00 0.00 H new ATOM 0 HB3 SER A 67 9.408 -5.657 -10.698 1.00 0.00 H new ATOM 0 HG SER A 67 10.860 -7.320 -11.406 1.00 0.00 H new ATOM 1042 N ILE A 68 7.720 -6.216 -7.326 1.00 0.00 N ATOM 1043 CA ILE A 68 8.029 -5.546 -6.069 1.00 0.00 C ATOM 1044 C ILE A 68 8.496 -6.545 -5.015 1.00 0.00 C ATOM 1045 O ILE A 68 7.702 -7.317 -4.481 1.00 0.00 O ATOM 1046 CB ILE A 68 6.810 -4.778 -5.526 1.00 0.00 C ATOM 1047 CG1 ILE A 68 6.442 -3.630 -6.469 1.00 0.00 C ATOM 1048 CG2 ILE A 68 7.095 -4.251 -4.128 1.00 0.00 C ATOM 1049 CD1 ILE A 68 5.083 -3.028 -6.187 1.00 0.00 C ATOM 0 H ILE A 68 6.787 -6.627 -7.367 1.00 0.00 H new ATOM 0 HA ILE A 68 8.831 -4.838 -6.277 1.00 0.00 H new ATOM 0 HB ILE A 68 5.964 -5.463 -5.469 1.00 0.00 H new ATOM 0 HG12 ILE A 68 7.199 -2.850 -6.391 1.00 0.00 H new ATOM 0 HG13 ILE A 68 6.463 -3.994 -7.496 1.00 0.00 H new ATOM 0 HG21 ILE A 68 6.224 -3.711 -3.758 1.00 0.00 H new ATOM 0 HG22 ILE A 68 7.314 -5.086 -3.462 1.00 0.00 H new ATOM 0 HG23 ILE A 68 7.952 -3.579 -4.160 1.00 0.00 H new ATOM 0 HD11 ILE A 68 4.889 -2.221 -6.893 1.00 0.00 H new ATOM 0 HD12 ILE A 68 4.316 -3.795 -6.293 1.00 0.00 H new ATOM 0 HD13 ILE A 68 5.063 -2.634 -5.171 1.00 0.00 H new ATOM 1061 N GLY A 69 9.793 -6.521 -4.719 1.00 0.00 N ATOM 1062 CA GLY A 69 10.344 -7.428 -3.729 1.00 0.00 C ATOM 1063 C GLY A 69 10.051 -6.984 -2.310 1.00 0.00 C ATOM 1064 O GLY A 69 9.324 -6.017 -2.076 1.00 0.00 O ATOM 0 H GLY A 69 10.471 -5.890 -5.147 1.00 0.00 H new ATOM 0 HA2 GLY A 69 9.934 -8.426 -3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 69 11.423 -7.501 -3.868 1.00 0.00 H new ATOM 1068 N PRO A 70 10.623 -7.700 -1.331 1.00 0.00 N ATOM 1069 CA PRO A 70 10.432 -7.394 0.090 1.00 0.00 C ATOM 1070 C PRO A 70 11.123 -6.098 0.501 1.00 0.00 C ATOM 1071 O PRO A 70 11.838 -5.487 -0.291 1.00 0.00 O ATOM 1072 CB PRO A 70 11.072 -8.590 0.800 1.00 0.00 C ATOM 1073 CG PRO A 70 12.076 -9.112 -0.169 1.00 0.00 C ATOM 1074 CD PRO A 70 11.501 -8.865 -1.536 1.00 0.00 C ATOM 0 HA PRO A 70 9.381 -7.247 0.338 1.00 0.00 H new ATOM 0 HB2 PRO A 70 11.544 -8.289 1.735 1.00 0.00 H new ATOM 0 HB3 PRO A 70 10.329 -9.348 1.047 1.00 0.00 H new ATOM 0 HG2 PRO A 70 13.033 -8.604 -0.051 1.00 0.00 H new ATOM 0 HG3 PRO A 70 12.257 -10.175 -0.008 1.00 0.00 H new ATOM 0 HD2 PRO A 70 12.281 -8.657 -2.268 1.00 0.00 H new ATOM 0 HD3 PRO A 70 10.944 -9.729 -1.900 1.00 0.00 H new ATOM 1082 N ASN A 71 10.905 -5.686 1.746 1.00 0.00 N ATOM 1083 CA ASN A 71 11.507 -4.462 2.262 1.00 0.00 C ATOM 1084 C ASN A 71 11.289 -3.300 1.298 1.00 0.00 C ATOM 1085 O ASN A 71 12.201 -2.515 1.040 1.00 0.00 O ATOM 1086 CB ASN A 71 13.004 -4.667 2.502 1.00 0.00 C ATOM 1087 CG ASN A 71 13.286 -5.415 3.790 1.00 0.00 C ATOM 1088 OD1 ASN A 71 13.113 -4.878 4.884 1.00 0.00 O ATOM 1089 ND2 ASN A 71 13.724 -6.663 3.666 1.00 0.00 N ATOM 0 H ASN A 71 10.316 -6.182 2.416 1.00 0.00 H new ATOM 0 HA ASN A 71 11.024 -4.220 3.209 1.00 0.00 H new ATOM 0 HB2 ASN A 71 13.431 -5.218 1.664 1.00 0.00 H new ATOM 0 HB3 ASN A 71 13.500 -3.697 2.532 1.00 0.00 H new ATOM 0 HD21 ASN A 71 13.931 -7.216 4.498 1.00 0.00 H new ATOM 0 HD22 ASN A 71 13.853 -7.068 2.739 1.00 0.00 H new ATOM 1096 N SER A 72 10.074 -3.197 0.769 1.00 0.00 N ATOM 1097 CA SER A 72 9.736 -2.132 -0.169 1.00 0.00 C ATOM 1098 C SER A 72 8.912 -1.046 0.515 1.00 0.00 C ATOM 1099 O SER A 72 8.179 -1.314 1.468 1.00 0.00 O ATOM 1100 CB SER A 72 8.964 -2.700 -1.361 1.00 0.00 C ATOM 1101 OG SER A 72 9.842 -3.293 -2.302 1.00 0.00 O ATOM 0 H SER A 72 9.307 -3.838 0.974 1.00 0.00 H new ATOM 0 HA SER A 72 10.665 -1.687 -0.526 1.00 0.00 H new ATOM 0 HB2 SER A 72 8.245 -3.441 -1.013 1.00 0.00 H new ATOM 0 HB3 SER A 72 8.394 -1.905 -1.842 1.00 0.00 H new ATOM 0 HG SER A 72 9.716 -4.265 -2.300 1.00 0.00 H new ATOM 1107 N LYS A 73 9.037 0.181 0.023 1.00 0.00 N ATOM 1108 CA LYS A 73 8.303 1.310 0.583 1.00 0.00 C ATOM 1109 C LYS A 73 7.383 1.934 -0.461 1.00 0.00 C ATOM 1110 O LYS A 73 7.827 2.319 -1.544 1.00 0.00 O ATOM 1111 CB LYS A 73 9.277 2.364 1.116 1.00 0.00 C ATOM 1112 CG LYS A 73 8.718 3.182 2.266 1.00 0.00 C ATOM 1113 CD LYS A 73 9.826 3.734 3.148 1.00 0.00 C ATOM 1114 CE LYS A 73 10.289 5.102 2.672 1.00 0.00 C ATOM 1115 NZ LYS A 73 10.918 5.036 1.323 1.00 0.00 N ATOM 0 H LYS A 73 9.641 0.420 -0.764 1.00 0.00 H new ATOM 0 HA LYS A 73 7.691 0.941 1.406 1.00 0.00 H new ATOM 0 HB2 LYS A 73 10.191 1.869 1.444 1.00 0.00 H new ATOM 0 HB3 LYS A 73 9.552 3.036 0.303 1.00 0.00 H new ATOM 0 HG2 LYS A 73 8.121 4.005 1.872 1.00 0.00 H new ATOM 0 HG3 LYS A 73 8.050 2.562 2.864 1.00 0.00 H new ATOM 0 HD2 LYS A 73 9.472 3.806 4.176 1.00 0.00 H new ATOM 0 HD3 LYS A 73 10.669 3.044 3.149 1.00 0.00 H new ATOM 0 HE2 LYS A 73 9.439 5.784 2.643 1.00 0.00 H new ATOM 0 HE3 LYS A 73 11.003 5.513 3.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 11.563 5.843 1.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 11.453 4.149 1.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 10.178 5.070 0.593 1.00 0.00 H new ATOM 1129 N LEU A 74 6.101 2.033 -0.129 1.00 0.00 N ATOM 1130 CA LEU A 74 5.118 2.613 -1.038 1.00 0.00 C ATOM 1131 C LEU A 74 4.682 3.994 -0.560 1.00 0.00 C ATOM 1132 O LEU A 74 4.817 4.325 0.617 1.00 0.00 O ATOM 1133 CB LEU A 74 3.901 1.694 -1.158 1.00 0.00 C ATOM 1134 CG LEU A 74 4.134 0.361 -1.868 1.00 0.00 C ATOM 1135 CD1 LEU A 74 3.107 -0.669 -1.421 1.00 0.00 C ATOM 1136 CD2 LEU A 74 4.083 0.545 -3.378 1.00 0.00 C ATOM 0 H LEU A 74 5.717 1.719 0.763 1.00 0.00 H new ATOM 0 HA LEU A 74 5.584 2.719 -2.018 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.526 1.488 -0.155 1.00 0.00 H new ATOM 0 HB3 LEU A 74 3.115 2.232 -1.688 1.00 0.00 H new ATOM 0 HG LEU A 74 5.125 -0.003 -1.599 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.289 -1.612 -1.937 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.190 -0.822 -0.345 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.105 -0.312 -1.660 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.251 -0.414 -3.867 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.105 0.932 -3.665 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.856 1.249 -3.685 1.00 0.00 H new ATOM 1148 N ASN A 75 4.158 4.795 -1.482 1.00 0.00 N ATOM 1149 CA ASN A 75 3.700 6.141 -1.154 1.00 0.00 C ATOM 1150 C ASN A 75 2.178 6.190 -1.060 1.00 0.00 C ATOM 1151 O ASN A 75 1.477 5.494 -1.795 1.00 0.00 O ATOM 1152 CB ASN A 75 4.189 7.139 -2.205 1.00 0.00 C ATOM 1153 CG ASN A 75 4.410 8.524 -1.629 1.00 0.00 C ATOM 1154 OD1 ASN A 75 3.851 9.507 -2.116 1.00 0.00 O ATOM 1155 ND2 ASN A 75 5.227 8.608 -0.586 1.00 0.00 N ATOM 0 H ASN A 75 4.040 4.536 -2.461 1.00 0.00 H new ATOM 0 HA ASN A 75 4.115 6.413 -0.184 1.00 0.00 H new ATOM 0 HB2 ASN A 75 5.120 6.777 -2.640 1.00 0.00 H new ATOM 0 HB3 ASN A 75 3.460 7.197 -3.014 1.00 0.00 H new ATOM 0 HD21 ASN A 75 5.413 9.514 -0.155 1.00 0.00 H new ATOM 0 HD22 ASN A 75 5.669 7.767 -0.215 1.00 0.00 H new ATOM 1162 N LEU A 76 1.673 7.016 -0.150 1.00 0.00 N ATOM 1163 CA LEU A 76 0.234 7.157 0.040 1.00 0.00 C ATOM 1164 C LEU A 76 -0.224 8.572 -0.301 1.00 0.00 C ATOM 1165 O LEU A 76 0.143 9.534 0.374 1.00 0.00 O ATOM 1166 CB LEU A 76 -0.145 6.820 1.484 1.00 0.00 C ATOM 1167 CG LEU A 76 -1.586 6.361 1.710 1.00 0.00 C ATOM 1168 CD1 LEU A 76 -1.829 5.018 1.039 1.00 0.00 C ATOM 1169 CD2 LEU A 76 -1.892 6.279 3.198 1.00 0.00 C ATOM 0 H LEU A 76 2.239 7.598 0.468 1.00 0.00 H new ATOM 0 HA LEU A 76 -0.267 6.461 -0.633 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.525 6.038 1.841 1.00 0.00 H new ATOM 0 HB3 LEU A 76 0.036 7.700 2.101 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.256 7.095 1.262 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.860 4.707 1.210 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.651 5.109 -0.032 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -1.151 4.274 1.458 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -2.922 5.951 3.340 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.216 5.566 3.670 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -1.758 7.261 3.652 1.00 0.00 H new ATOM 1181 N VAL A 77 -1.031 8.690 -1.351 1.00 0.00 N ATOM 1182 CA VAL A 77 -1.542 9.986 -1.780 1.00 0.00 C ATOM 1183 C VAL A 77 -3.056 10.061 -1.616 1.00 0.00 C ATOM 1184 O VAL A 77 -3.782 9.158 -2.033 1.00 0.00 O ATOM 1185 CB VAL A 77 -1.181 10.274 -3.249 1.00 0.00 C ATOM 1186 CG1 VAL A 77 -1.290 11.762 -3.544 1.00 0.00 C ATOM 1187 CG2 VAL A 77 0.216 9.761 -3.564 1.00 0.00 C ATOM 0 H VAL A 77 -1.345 7.904 -1.920 1.00 0.00 H new ATOM 0 HA VAL A 77 -1.073 10.737 -1.145 1.00 0.00 H new ATOM 0 HB VAL A 77 -1.890 9.748 -3.889 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -1.031 11.946 -4.587 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.311 12.096 -3.359 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -0.606 12.312 -2.898 1.00 0.00 H new ATOM 0 HG21 VAL A 77 0.455 9.973 -4.606 1.00 0.00 H new ATOM 0 HG22 VAL A 77 0.940 10.257 -2.918 1.00 0.00 H new ATOM 0 HG23 VAL A 77 0.255 8.685 -3.394 1.00 0.00 H new ATOM 1197 N VAL A 78 -3.528 11.144 -1.006 1.00 0.00 N ATOM 1198 CA VAL A 78 -4.956 11.338 -0.789 1.00 0.00 C ATOM 1199 C VAL A 78 -5.626 11.926 -2.026 1.00 0.00 C ATOM 1200 O VAL A 78 -5.572 13.133 -2.260 1.00 0.00 O ATOM 1201 CB VAL A 78 -5.220 12.265 0.413 1.00 0.00 C ATOM 1202 CG1 VAL A 78 -6.714 12.422 0.649 1.00 0.00 C ATOM 1203 CG2 VAL A 78 -4.528 11.731 1.659 1.00 0.00 C ATOM 0 H VAL A 78 -2.941 11.900 -0.653 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.380 10.356 -0.582 1.00 0.00 H new ATOM 0 HB VAL A 78 -4.807 13.249 0.189 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.880 13.080 1.502 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.179 12.853 -0.238 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -7.155 11.446 0.852 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.725 12.398 2.499 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -4.909 10.736 1.889 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.454 11.676 1.483 1.00 0.00 H new ATOM 1213 N LYS A 79 -6.257 11.064 -2.815 1.00 0.00 N ATOM 1214 CA LYS A 79 -6.940 11.496 -4.029 1.00 0.00 C ATOM 1215 C LYS A 79 -7.843 12.692 -3.749 1.00 0.00 C ATOM 1216 O LYS A 79 -8.317 12.894 -2.630 1.00 0.00 O ATOM 1217 CB LYS A 79 -7.765 10.346 -4.612 1.00 0.00 C ATOM 1218 CG LYS A 79 -6.980 9.450 -5.554 1.00 0.00 C ATOM 1219 CD LYS A 79 -7.768 8.205 -5.926 1.00 0.00 C ATOM 1220 CE LYS A 79 -6.909 7.210 -6.691 1.00 0.00 C ATOM 1221 NZ LYS A 79 -7.613 5.915 -6.900 1.00 0.00 N ATOM 0 H LYS A 79 -6.310 10.061 -2.636 1.00 0.00 H new ATOM 0 HA LYS A 79 -6.183 11.796 -4.754 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.160 9.742 -3.795 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -8.621 10.758 -5.146 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -6.726 10.004 -6.457 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -6.041 9.160 -5.083 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -8.155 7.734 -5.022 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -8.629 8.486 -6.532 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -6.635 7.634 -7.657 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -5.982 7.035 -6.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -6.994 5.264 -7.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -7.852 5.497 -5.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -8.485 6.078 -7.443 1.00 0.00 H new ATOM 1235 N PRO A 80 -8.089 13.505 -4.787 1.00 0.00 N ATOM 1236 CA PRO A 80 -8.939 14.695 -4.677 1.00 0.00 C ATOM 1237 C PRO A 80 -10.409 14.340 -4.479 1.00 0.00 C ATOM 1238 O PRO A 80 -10.921 13.403 -5.093 1.00 0.00 O ATOM 1239 CB PRO A 80 -8.735 15.402 -6.019 1.00 0.00 C ATOM 1240 CG PRO A 80 -8.341 14.318 -6.962 1.00 0.00 C ATOM 1241 CD PRO A 80 -7.558 13.326 -6.148 1.00 0.00 C ATOM 0 HA PRO A 80 -8.676 15.306 -3.814 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -9.648 15.900 -6.347 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -7.962 16.167 -5.950 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -9.219 13.851 -7.408 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -7.739 14.713 -7.781 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.706 12.307 -6.506 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -6.488 13.527 -6.191 1.00 0.00 H new ATOM 1249 N LEU A 81 -11.084 15.095 -3.619 1.00 0.00 N ATOM 1250 CA LEU A 81 -12.497 14.861 -3.341 1.00 0.00 C ATOM 1251 C LEU A 81 -13.376 15.505 -4.408 1.00 0.00 C ATOM 1252 O LEU A 81 -13.172 16.660 -4.781 1.00 0.00 O ATOM 1253 CB LEU A 81 -12.864 15.412 -1.962 1.00 0.00 C ATOM 1254 CG LEU A 81 -13.129 16.916 -1.888 1.00 0.00 C ATOM 1255 CD1 LEU A 81 -14.589 17.215 -2.192 1.00 0.00 C ATOM 1256 CD2 LEU A 81 -12.745 17.459 -0.520 1.00 0.00 C ATOM 0 H LEU A 81 -10.676 15.874 -3.102 1.00 0.00 H new ATOM 0 HA LEU A 81 -12.671 13.785 -3.354 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -13.753 14.889 -1.609 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -12.057 15.171 -1.270 1.00 0.00 H new ATOM 0 HG LEU A 81 -12.513 17.412 -2.638 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -14.760 18.290 -2.135 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -14.832 16.862 -3.194 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -15.223 16.708 -1.465 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -12.941 18.531 -0.486 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -13.334 16.958 0.249 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -11.685 17.278 -0.341 1.00 0.00 H new TER 1268 LEU A 81