USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 785 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 143:sc= -0.125 (180deg=-0.643) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 22:sc= 0.153 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -171:sc= -0.0201 (180deg=-0.138) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -171:sc= 0.905 (180deg=0.522) USER MOD Single : A 63 THR OG1 : rot 23:sc= 0.111 USER MOD Single : A 66 LYS NZ :NH3+ -168:sc= -0.0303 (180deg=-0.207) USER MOD Single : A 68 SER OG : rot 180:sc= -0.21 USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 LYS NZ :NH3+ -168:sc= -0.038 (180deg=-0.208) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot -63:sc= 0.891 USER MOD Single : A 98 LYS NZ :NH3+ 167:sc= -0.0179 (180deg=-0.247) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.101 -18.119 7.655 1.00 0.00 N ATOM 2 CA MET A 1 0.711 -17.200 6.591 1.00 0.00 C ATOM 3 C MET A 1 1.460 -15.876 6.712 1.00 0.00 C ATOM 4 O MET A 1 1.469 -15.251 7.773 1.00 0.00 O ATOM 5 CB MET A 1 -0.798 -16.953 6.629 1.00 0.00 C ATOM 6 CG MET A 1 -1.288 -16.015 5.538 1.00 0.00 C ATOM 7 SD MET A 1 -0.927 -16.628 3.881 1.00 0.00 S ATOM 8 CE MET A 1 -1.815 -18.182 3.894 1.00 0.00 C ATOM 0 H1 MET A 1 0.578 -19.012 7.551 1.00 0.00 H new ATOM 0 H2 MET A 1 2.122 -18.307 7.595 1.00 0.00 H new ATOM 0 H3 MET A 1 0.881 -17.694 8.578 1.00 0.00 H new ATOM 0 HA MET A 1 0.973 -17.657 5.637 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.317 -17.907 6.536 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.066 -16.538 7.601 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.364 -15.873 5.642 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.823 -15.038 5.669 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.254 -18.359 2.912 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.127 -18.992 4.135 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.606 -18.143 4.643 1.00 0.00 H new ATOM 18 N ARG A 2 2.089 -15.459 5.620 1.00 0.00 N ATOM 19 CA ARG A 2 2.844 -14.211 5.597 1.00 0.00 C ATOM 20 C ARG A 2 2.077 -13.117 4.861 1.00 0.00 C ATOM 21 O ARG A 2 1.483 -13.360 3.811 1.00 0.00 O ATOM 22 CB ARG A 2 4.206 -14.431 4.937 1.00 0.00 C ATOM 23 CG ARG A 2 4.116 -15.004 3.532 1.00 0.00 C ATOM 24 CD ARG A 2 5.497 -15.213 2.927 1.00 0.00 C ATOM 25 NE ARG A 2 5.430 -15.858 1.617 1.00 0.00 N ATOM 26 CZ ARG A 2 5.011 -17.108 1.425 1.00 0.00 C ATOM 27 NH1 ARG A 2 4.663 -17.865 2.458 1.00 0.00 N ATOM 28 NH2 ARG A 2 4.953 -17.604 0.197 1.00 0.00 N ATOM 0 H ARG A 2 2.091 -15.968 4.736 1.00 0.00 H new ATOM 0 HA ARG A 2 2.993 -13.887 6.627 1.00 0.00 H new ATOM 0 HB2 ARG A 2 4.740 -13.481 4.900 1.00 0.00 H new ATOM 0 HB3 ARG A 2 4.797 -15.105 5.558 1.00 0.00 H new ATOM 0 HG2 ARG A 2 3.581 -15.954 3.558 1.00 0.00 H new ATOM 0 HG3 ARG A 2 3.538 -14.330 2.899 1.00 0.00 H new ATOM 0 HD2 ARG A 2 6.000 -14.251 2.832 1.00 0.00 H new ATOM 0 HD3 ARG A 2 6.099 -15.823 3.601 1.00 0.00 H new ATOM 0 HE ARG A 2 5.721 -15.319 0.801 1.00 0.00 H new ATOM 0 HH11 ARG A 2 4.716 -17.491 3.405 1.00 0.00 H new ATOM 0 HH12 ARG A 2 4.343 -18.821 2.305 1.00 0.00 H new ATOM 0 HH21 ARG A 2 5.229 -17.029 -0.599 1.00 0.00 H new ATOM 0 HH22 ARG A 2 4.632 -18.561 0.048 1.00 0.00 H new ATOM 42 N VAL A 3 2.095 -11.911 5.420 1.00 0.00 N ATOM 43 CA VAL A 3 1.405 -10.779 4.817 1.00 0.00 C ATOM 44 C VAL A 3 2.302 -9.547 4.780 1.00 0.00 C ATOM 45 O VAL A 3 2.938 -9.200 5.773 1.00 0.00 O ATOM 46 CB VAL A 3 0.109 -10.432 5.582 1.00 0.00 C ATOM 47 CG1 VAL A 3 0.417 -10.055 7.024 1.00 0.00 C ATOM 48 CG2 VAL A 3 -0.644 -9.313 4.878 1.00 0.00 C ATOM 0 H VAL A 3 2.581 -11.694 6.290 1.00 0.00 H new ATOM 0 HA VAL A 3 1.149 -11.073 3.799 1.00 0.00 H new ATOM 0 HB VAL A 3 -0.528 -11.316 5.594 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -0.511 -9.815 7.543 1.00 0.00 H new ATOM 0 HG12 VAL A 3 0.905 -10.892 7.523 1.00 0.00 H new ATOM 0 HG13 VAL A 3 1.077 -9.188 7.040 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -1.554 -9.082 5.432 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -0.014 -8.425 4.829 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -0.904 -9.629 3.868 1.00 0.00 H new ATOM 58 N GLY A 4 2.333 -8.879 3.632 1.00 0.00 N ATOM 59 CA GLY A 4 3.140 -7.682 3.492 1.00 0.00 C ATOM 60 C GLY A 4 2.473 -6.475 4.120 1.00 0.00 C ATOM 61 O GLY A 4 1.261 -6.306 4.004 1.00 0.00 O ATOM 0 H GLY A 4 1.813 -9.146 2.796 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.112 -7.843 3.958 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.321 -7.488 2.435 1.00 0.00 H new ATOM 65 N ALA A 5 3.255 -5.637 4.794 1.00 0.00 N ATOM 66 CA ALA A 5 2.708 -4.451 5.443 1.00 0.00 C ATOM 67 C ALA A 5 3.509 -3.202 5.098 1.00 0.00 C ATOM 68 O ALA A 5 4.740 -3.212 5.128 1.00 0.00 O ATOM 69 CB ALA A 5 2.662 -4.649 6.950 1.00 0.00 C ATOM 0 H ALA A 5 4.262 -5.756 4.904 1.00 0.00 H new ATOM 0 HA ALA A 5 1.694 -4.307 5.071 1.00 0.00 H new ATOM 0 HB1 ALA A 5 2.252 -3.756 7.422 1.00 0.00 H new ATOM 0 HB2 ALA A 5 2.031 -5.506 7.185 1.00 0.00 H new ATOM 0 HB3 ALA A 5 3.670 -4.827 7.325 1.00 0.00 H new ATOM 75 N LEU A 6 2.798 -2.128 4.773 1.00 0.00 N ATOM 76 CA LEU A 6 3.436 -0.863 4.424 1.00 0.00 C ATOM 77 C LEU A 6 3.049 0.238 5.409 1.00 0.00 C ATOM 78 O LEU A 6 1.887 0.355 5.800 1.00 0.00 O ATOM 79 CB LEU A 6 3.054 -0.448 3.001 1.00 0.00 C ATOM 80 CG LEU A 6 3.542 -1.389 1.899 1.00 0.00 C ATOM 81 CD1 LEU A 6 3.117 -0.873 0.533 1.00 0.00 C ATOM 82 CD2 LEU A 6 5.057 -1.551 1.967 1.00 0.00 C ATOM 0 H LEU A 6 1.779 -2.108 4.744 1.00 0.00 H new ATOM 0 HA LEU A 6 4.515 -1.007 4.476 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.968 -0.374 2.940 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.453 0.548 2.810 1.00 0.00 H new ATOM 0 HG LEU A 6 3.087 -2.367 2.052 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.472 -1.554 -0.240 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.030 -0.811 0.490 1.00 0.00 H new ATOM 0 HD13 LEU A 6 3.544 0.116 0.369 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.387 -2.224 1.176 1.00 0.00 H new ATOM 0 HD22 LEU A 6 5.533 -0.579 1.839 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.335 -1.966 2.936 1.00 0.00 H new ATOM 94 N ASP A 7 4.032 1.041 5.805 1.00 0.00 N ATOM 95 CA ASP A 7 3.796 2.136 6.741 1.00 0.00 C ATOM 96 C ASP A 7 4.603 3.368 6.351 1.00 0.00 C ATOM 97 O ASP A 7 5.778 3.267 6.004 1.00 0.00 O ATOM 98 CB ASP A 7 4.152 1.710 8.166 1.00 0.00 C ATOM 99 CG ASP A 7 5.567 1.185 8.279 1.00 0.00 C ATOM 100 OD1 ASP A 7 5.852 0.124 7.688 1.00 0.00 O ATOM 101 OD2 ASP A 7 6.390 1.834 8.960 1.00 0.00 O ATOM 0 H ASP A 7 4.999 0.954 5.493 1.00 0.00 H new ATOM 0 HA ASP A 7 2.736 2.388 6.701 1.00 0.00 H new ATOM 0 HB2 ASP A 7 4.029 2.560 8.837 1.00 0.00 H new ATOM 0 HB3 ASP A 7 3.455 0.940 8.496 1.00 0.00 H new ATOM 106 N VAL A 8 3.961 4.530 6.410 1.00 0.00 N ATOM 107 CA VAL A 8 4.617 5.786 6.063 1.00 0.00 C ATOM 108 C VAL A 8 4.959 6.597 7.309 1.00 0.00 C ATOM 109 O VAL A 8 4.156 6.695 8.237 1.00 0.00 O ATOM 110 CB VAL A 8 3.731 6.640 5.133 1.00 0.00 C ATOM 111 CG1 VAL A 8 4.456 7.909 4.707 1.00 0.00 C ATOM 112 CG2 VAL A 8 3.301 5.830 3.918 1.00 0.00 C ATOM 0 H VAL A 8 2.987 4.628 6.695 1.00 0.00 H new ATOM 0 HA VAL A 8 5.539 5.527 5.542 1.00 0.00 H new ATOM 0 HB VAL A 8 2.838 6.933 5.685 1.00 0.00 H new ATOM 0 HG11 VAL A 8 3.811 8.494 4.052 1.00 0.00 H new ATOM 0 HG12 VAL A 8 4.707 8.498 5.589 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.370 7.645 4.175 1.00 0.00 H new ATOM 0 HG21 VAL A 8 2.676 6.447 3.272 1.00 0.00 H new ATOM 0 HG22 VAL A 8 4.183 5.505 3.367 1.00 0.00 H new ATOM 0 HG23 VAL A 8 2.735 4.958 4.244 1.00 0.00 H new ATOM 122 N GLY A 9 6.155 7.178 7.322 1.00 0.00 N ATOM 123 CA GLY A 9 6.581 7.975 8.458 1.00 0.00 C ATOM 124 C GLY A 9 7.254 9.266 8.033 1.00 0.00 C ATOM 125 O GLY A 9 6.968 10.331 8.580 1.00 0.00 O ATOM 0 H GLY A 9 6.837 7.111 6.566 1.00 0.00 H new ATOM 0 HA2 GLY A 9 5.717 8.206 9.082 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.270 7.393 9.070 1.00 0.00 H new ATOM 129 N GLU A 10 8.145 9.173 7.050 1.00 0.00 N ATOM 130 CA GLU A 10 8.855 10.341 6.544 1.00 0.00 C ATOM 131 C GLU A 10 9.788 9.954 5.400 1.00 0.00 C ATOM 132 O GLU A 10 10.839 9.354 5.621 1.00 0.00 O ATOM 133 CB GLU A 10 9.657 11.005 7.668 1.00 0.00 C ATOM 134 CG GLU A 10 10.425 12.239 7.222 1.00 0.00 C ATOM 135 CD GLU A 10 11.215 12.872 8.351 1.00 0.00 C ATOM 136 OE1 GLU A 10 12.089 12.189 8.922 1.00 0.00 O ATOM 137 OE2 GLU A 10 10.958 14.055 8.662 1.00 0.00 O ATOM 0 H GLU A 10 8.392 8.298 6.588 1.00 0.00 H new ATOM 0 HA GLU A 10 8.117 11.049 6.167 1.00 0.00 H new ATOM 0 HB2 GLU A 10 8.977 11.282 8.473 1.00 0.00 H new ATOM 0 HB3 GLU A 10 10.359 10.280 8.079 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.105 11.967 6.415 1.00 0.00 H new ATOM 0 HG3 GLU A 10 9.726 12.971 6.817 1.00 0.00 H new ATOM 144 N ALA A 11 9.394 10.303 4.177 1.00 0.00 N ATOM 145 CA ALA A 11 10.190 9.995 2.991 1.00 0.00 C ATOM 146 C ALA A 11 10.691 8.553 3.019 1.00 0.00 C ATOM 147 O ALA A 11 11.757 8.245 2.485 1.00 0.00 O ATOM 148 CB ALA A 11 11.361 10.958 2.880 1.00 0.00 C ATOM 0 H ALA A 11 8.526 10.801 3.981 1.00 0.00 H new ATOM 0 HA ALA A 11 9.550 10.111 2.116 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.946 10.718 1.992 1.00 0.00 H new ATOM 0 HB2 ALA A 11 10.987 11.979 2.803 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.991 10.869 3.765 1.00 0.00 H new ATOM 154 N ARG A 12 9.916 7.675 3.645 1.00 0.00 N ATOM 155 CA ARG A 12 10.291 6.270 3.747 1.00 0.00 C ATOM 156 C ARG A 12 9.107 5.418 4.190 1.00 0.00 C ATOM 157 O ARG A 12 8.295 5.841 5.014 1.00 0.00 O ATOM 158 CB ARG A 12 11.446 6.106 4.737 1.00 0.00 C ATOM 159 CG ARG A 12 11.945 4.677 4.861 1.00 0.00 C ATOM 160 CD ARG A 12 13.038 4.559 5.910 1.00 0.00 C ATOM 161 NE ARG A 12 14.165 5.452 5.637 1.00 0.00 N ATOM 162 CZ ARG A 12 14.974 5.331 4.587 1.00 0.00 C ATOM 163 NH1 ARG A 12 14.815 4.334 3.727 1.00 0.00 N ATOM 164 NH2 ARG A 12 15.954 6.205 4.404 1.00 0.00 N ATOM 0 H ARG A 12 9.028 7.910 4.088 1.00 0.00 H new ATOM 0 HA ARG A 12 10.608 5.932 2.761 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.273 6.745 4.426 1.00 0.00 H new ATOM 0 HB3 ARG A 12 11.125 6.456 5.718 1.00 0.00 H new ATOM 0 HG2 ARG A 12 11.114 4.022 5.124 1.00 0.00 H new ATOM 0 HG3 ARG A 12 12.326 4.338 3.897 1.00 0.00 H new ATOM 0 HD2 ARG A 12 12.624 4.789 6.891 1.00 0.00 H new ATOM 0 HD3 ARG A 12 13.393 3.529 5.948 1.00 0.00 H new ATOM 0 HE ARG A 12 14.341 6.214 6.292 1.00 0.00 H new ATOM 0 HH11 ARG A 12 14.069 3.653 3.868 1.00 0.00 H new ATOM 0 HH12 ARG A 12 15.439 4.248 2.925 1.00 0.00 H new ATOM 0 HH21 ARG A 12 16.087 6.968 5.067 1.00 0.00 H new ATOM 0 HH22 ARG A 12 16.575 6.114 3.600 1.00 0.00 H new ATOM 178 N ILE A 13 9.022 4.212 3.641 1.00 0.00 N ATOM 179 CA ILE A 13 7.948 3.289 3.978 1.00 0.00 C ATOM 180 C ILE A 13 8.501 2.080 4.728 1.00 0.00 C ATOM 181 O ILE A 13 9.510 1.502 4.323 1.00 0.00 O ATOM 182 CB ILE A 13 7.206 2.810 2.714 1.00 0.00 C ATOM 183 CG1 ILE A 13 6.689 4.008 1.917 1.00 0.00 C ATOM 184 CG2 ILE A 13 6.055 1.882 3.085 1.00 0.00 C ATOM 185 CD1 ILE A 13 5.957 3.623 0.649 1.00 0.00 C ATOM 0 H ILE A 13 9.688 3.851 2.958 1.00 0.00 H new ATOM 0 HA ILE A 13 7.243 3.823 4.616 1.00 0.00 H new ATOM 0 HB ILE A 13 7.908 2.253 2.093 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.021 4.593 2.549 1.00 0.00 H new ATOM 0 HG13 ILE A 13 7.530 4.653 1.660 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.544 1.555 2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.445 1.013 3.615 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.352 2.413 3.726 1.00 0.00 H new ATOM 0 HD11 ILE A 13 5.619 4.524 0.136 1.00 0.00 H new ATOM 0 HD12 ILE A 13 6.628 3.064 -0.003 1.00 0.00 H new ATOM 0 HD13 ILE A 13 5.096 3.004 0.900 1.00 0.00 H new ATOM 197 N GLY A 14 7.845 1.699 5.821 1.00 0.00 N ATOM 198 CA GLY A 14 8.306 0.562 6.592 1.00 0.00 C ATOM 199 C GLY A 14 7.848 -0.760 6.010 1.00 0.00 C ATOM 200 O GLY A 14 6.679 -0.919 5.655 1.00 0.00 O ATOM 0 H GLY A 14 7.008 2.155 6.183 1.00 0.00 H new ATOM 0 HA2 GLY A 14 9.395 0.577 6.639 1.00 0.00 H new ATOM 0 HA3 GLY A 14 7.942 0.650 7.616 1.00 0.00 H new ATOM 204 N LEU A 15 8.769 -1.713 5.912 1.00 0.00 N ATOM 205 CA LEU A 15 8.453 -3.031 5.373 1.00 0.00 C ATOM 206 C LEU A 15 8.367 -4.067 6.488 1.00 0.00 C ATOM 207 O LEU A 15 9.260 -4.167 7.329 1.00 0.00 O ATOM 208 CB LEU A 15 9.501 -3.456 4.345 1.00 0.00 C ATOM 209 CG LEU A 15 9.597 -2.563 3.107 1.00 0.00 C ATOM 210 CD1 LEU A 15 10.673 -3.074 2.161 1.00 0.00 C ATOM 211 CD2 LEU A 15 8.253 -2.490 2.400 1.00 0.00 C ATOM 0 H LEU A 15 9.741 -1.597 6.199 1.00 0.00 H new ATOM 0 HA LEU A 15 7.482 -2.969 4.881 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.476 -3.481 4.832 1.00 0.00 H new ATOM 0 HB3 LEU A 15 9.280 -4.474 4.023 1.00 0.00 H new ATOM 0 HG LEU A 15 9.873 -1.558 3.427 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.726 -2.426 1.286 1.00 0.00 H new ATOM 0 HD12 LEU A 15 11.636 -3.074 2.672 1.00 0.00 H new ATOM 0 HD13 LEU A 15 10.429 -4.089 1.846 1.00 0.00 H new ATOM 0 HD21 LEU A 15 8.338 -1.851 1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.949 -3.491 2.093 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.507 -2.076 3.079 1.00 0.00 H new ATOM 223 N ALA A 16 7.283 -4.835 6.489 1.00 0.00 N ATOM 224 CA ALA A 16 7.073 -5.864 7.499 1.00 0.00 C ATOM 225 C ALA A 16 6.288 -7.035 6.919 1.00 0.00 C ATOM 226 O ALA A 16 5.467 -6.855 6.021 1.00 0.00 O ATOM 227 CB ALA A 16 6.349 -5.280 8.705 1.00 0.00 C ATOM 0 H ALA A 16 6.535 -4.764 5.799 1.00 0.00 H new ATOM 0 HA ALA A 16 8.046 -6.234 7.823 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.199 -6.060 9.452 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.947 -4.477 9.135 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.382 -4.885 8.393 1.00 0.00 H new ATOM 233 N VAL A 17 6.548 -8.234 7.431 1.00 0.00 N ATOM 234 CA VAL A 17 5.859 -9.424 6.943 1.00 0.00 C ATOM 235 C VAL A 17 5.648 -10.443 8.056 1.00 0.00 C ATOM 236 O VAL A 17 6.587 -10.826 8.756 1.00 0.00 O ATOM 237 CB VAL A 17 6.637 -10.088 5.788 1.00 0.00 C ATOM 238 CG1 VAL A 17 5.897 -11.314 5.274 1.00 0.00 C ATOM 239 CG2 VAL A 17 6.875 -9.093 4.663 1.00 0.00 C ATOM 0 H VAL A 17 7.223 -8.407 8.176 1.00 0.00 H new ATOM 0 HA VAL A 17 4.887 -9.095 6.576 1.00 0.00 H new ATOM 0 HB VAL A 17 7.605 -10.412 6.170 1.00 0.00 H new ATOM 0 HG11 VAL A 17 6.464 -11.766 4.460 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.784 -12.036 6.083 1.00 0.00 H new ATOM 0 HG13 VAL A 17 4.913 -11.019 4.911 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.425 -9.579 3.857 1.00 0.00 H new ATOM 0 HG22 VAL A 17 5.917 -8.736 4.284 1.00 0.00 H new ATOM 0 HG23 VAL A 17 7.454 -8.249 5.040 1.00 0.00 H new ATOM 249 N GLY A 18 4.403 -10.884 8.207 1.00 0.00 N ATOM 250 CA GLY A 18 4.069 -11.862 9.223 1.00 0.00 C ATOM 251 C GLY A 18 2.594 -12.213 9.218 1.00 0.00 C ATOM 252 O GLY A 18 1.942 -12.163 8.176 1.00 0.00 O ATOM 0 H GLY A 18 3.614 -10.577 7.638 1.00 0.00 H new ATOM 0 HA2 GLY A 18 4.656 -12.766 9.062 1.00 0.00 H new ATOM 0 HA3 GLY A 18 4.345 -11.474 10.203 1.00 0.00 H new ATOM 256 N GLU A 19 2.066 -12.561 10.386 1.00 0.00 N ATOM 257 CA GLU A 19 0.655 -12.912 10.513 1.00 0.00 C ATOM 258 C GLU A 19 -0.196 -11.660 10.698 1.00 0.00 C ATOM 259 O GLU A 19 0.209 -10.718 11.377 1.00 0.00 O ATOM 260 CB GLU A 19 0.446 -13.865 11.692 1.00 0.00 C ATOM 261 CG GLU A 19 0.871 -13.280 13.031 1.00 0.00 C ATOM 262 CD GLU A 19 0.653 -14.242 14.185 1.00 0.00 C ATOM 263 OE1 GLU A 19 0.168 -15.366 13.939 1.00 0.00 O ATOM 264 OE2 GLU A 19 0.967 -13.868 15.334 1.00 0.00 O ATOM 0 H GLU A 19 2.593 -12.608 11.258 1.00 0.00 H new ATOM 0 HA GLU A 19 0.345 -13.412 9.596 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -0.607 -14.141 11.743 1.00 0.00 H new ATOM 0 HB3 GLU A 19 1.007 -14.782 11.511 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.925 -13.006 12.985 1.00 0.00 H new ATOM 0 HG3 GLU A 19 0.311 -12.363 13.217 1.00 0.00 H new ATOM 271 N GLU A 20 -1.380 -11.652 10.090 1.00 0.00 N ATOM 272 CA GLU A 20 -2.283 -10.509 10.195 1.00 0.00 C ATOM 273 C GLU A 20 -2.497 -10.118 11.654 1.00 0.00 C ATOM 274 O GLU A 20 -2.740 -10.973 12.506 1.00 0.00 O ATOM 275 CB GLU A 20 -3.629 -10.831 9.542 1.00 0.00 C ATOM 276 CG GLU A 20 -3.525 -11.177 8.067 1.00 0.00 C ATOM 277 CD GLU A 20 -4.876 -11.465 7.440 1.00 0.00 C ATOM 278 OE1 GLU A 20 -5.737 -10.561 7.445 1.00 0.00 O ATOM 279 OE2 GLU A 20 -5.071 -12.595 6.946 1.00 0.00 O ATOM 0 H GLU A 20 -1.735 -12.421 9.522 1.00 0.00 H new ATOM 0 HA GLU A 20 -1.825 -9.669 9.673 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -4.089 -11.666 10.070 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -4.294 -9.975 9.659 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -3.051 -10.352 7.536 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -2.879 -12.047 7.946 1.00 0.00 H new ATOM 286 N GLY A 21 -2.402 -8.823 11.937 1.00 0.00 N ATOM 287 CA GLY A 21 -2.585 -8.349 13.296 1.00 0.00 C ATOM 288 C GLY A 21 -1.542 -8.907 14.246 1.00 0.00 C ATOM 289 O GLY A 21 -1.880 -9.488 15.277 1.00 0.00 O ATOM 0 H GLY A 21 -2.202 -8.095 11.251 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -2.538 -7.260 13.308 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -3.579 -8.629 13.646 1.00 0.00 H new ATOM 293 N VAL A 22 -0.271 -8.734 13.895 1.00 0.00 N ATOM 294 CA VAL A 22 0.823 -9.231 14.722 1.00 0.00 C ATOM 295 C VAL A 22 0.781 -8.609 16.119 1.00 0.00 C ATOM 296 O VAL A 22 0.724 -7.387 16.257 1.00 0.00 O ATOM 297 CB VAL A 22 2.192 -8.927 14.082 1.00 0.00 C ATOM 298 CG1 VAL A 22 3.324 -9.497 14.927 1.00 0.00 C ATOM 299 CG2 VAL A 22 2.250 -9.471 12.662 1.00 0.00 C ATOM 0 H VAL A 22 0.026 -8.254 13.045 1.00 0.00 H new ATOM 0 HA VAL A 22 0.696 -10.311 14.801 1.00 0.00 H new ATOM 0 HB VAL A 22 2.316 -7.845 14.039 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.280 -9.270 14.455 1.00 0.00 H new ATOM 0 HG12 VAL A 22 3.295 -9.052 15.922 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.208 -10.578 15.010 1.00 0.00 H new ATOM 0 HG21 VAL A 22 3.224 -9.247 12.226 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.100 -10.550 12.679 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.468 -9.006 12.062 1.00 0.00 H new ATOM 309 N PRO A 23 0.807 -9.441 17.178 1.00 0.00 N ATOM 310 CA PRO A 23 0.772 -8.954 18.560 1.00 0.00 C ATOM 311 C PRO A 23 1.989 -8.105 18.905 1.00 0.00 C ATOM 312 O PRO A 23 1.863 -7.042 19.513 1.00 0.00 O ATOM 313 CB PRO A 23 0.767 -10.238 19.405 1.00 0.00 C ATOM 314 CG PRO A 23 0.368 -11.325 18.467 1.00 0.00 C ATOM 315 CD PRO A 23 0.870 -10.910 17.115 1.00 0.00 C ATOM 0 HA PRO A 23 -0.091 -8.311 18.736 1.00 0.00 H new ATOM 0 HB2 PRO A 23 1.750 -10.430 19.834 1.00 0.00 H new ATOM 0 HB3 PRO A 23 0.066 -10.159 20.236 1.00 0.00 H new ATOM 0 HG2 PRO A 23 0.801 -12.279 18.768 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -0.714 -11.455 18.458 1.00 0.00 H new ATOM 0 HD2 PRO A 23 1.885 -11.264 16.935 1.00 0.00 H new ATOM 0 HD3 PRO A 23 0.247 -11.307 16.313 1.00 0.00 H new ATOM 323 N LEU A 24 3.167 -8.584 18.517 1.00 0.00 N ATOM 324 CA LEU A 24 4.414 -7.873 18.788 1.00 0.00 C ATOM 325 C LEU A 24 5.521 -8.329 17.842 1.00 0.00 C ATOM 326 O LEU A 24 5.518 -9.466 17.366 1.00 0.00 O ATOM 327 CB LEU A 24 4.856 -8.103 20.238 1.00 0.00 C ATOM 328 CG LEU A 24 3.914 -7.550 21.310 1.00 0.00 C ATOM 329 CD1 LEU A 24 4.422 -7.909 22.699 1.00 0.00 C ATOM 330 CD2 LEU A 24 3.767 -6.040 21.171 1.00 0.00 C ATOM 0 H LEU A 24 3.285 -9.463 18.013 1.00 0.00 H new ATOM 0 HA LEU A 24 4.232 -6.810 18.629 1.00 0.00 H new ATOM 0 HB2 LEU A 24 4.971 -9.175 20.399 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.839 -7.653 20.376 1.00 0.00 H new ATOM 0 HG LEU A 24 2.933 -8.003 21.171 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.741 -7.509 23.450 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.475 -8.993 22.798 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.415 -7.483 22.845 1.00 0.00 H new ATOM 0 HD21 LEU A 24 3.093 -5.667 21.943 1.00 0.00 H new ATOM 0 HD22 LEU A 24 4.743 -5.568 21.283 1.00 0.00 H new ATOM 0 HD23 LEU A 24 3.359 -5.803 20.188 1.00 0.00 H new ATOM 342 N ALA A 25 6.468 -7.433 17.575 1.00 0.00 N ATOM 343 CA ALA A 25 7.592 -7.730 16.690 1.00 0.00 C ATOM 344 C ALA A 25 7.177 -7.699 15.223 1.00 0.00 C ATOM 345 O ALA A 25 6.138 -8.241 14.846 1.00 0.00 O ATOM 346 CB ALA A 25 8.206 -9.080 17.037 1.00 0.00 C ATOM 0 H ALA A 25 6.479 -6.489 17.962 1.00 0.00 H new ATOM 0 HA ALA A 25 8.341 -6.952 16.841 1.00 0.00 H new ATOM 0 HB1 ALA A 25 9.041 -9.283 16.367 1.00 0.00 H new ATOM 0 HB2 ALA A 25 8.563 -9.064 18.067 1.00 0.00 H new ATOM 0 HB3 ALA A 25 7.454 -9.861 16.926 1.00 0.00 H new ATOM 352 N SER A 26 8.005 -7.059 14.402 1.00 0.00 N ATOM 353 CA SER A 26 7.747 -6.944 12.971 1.00 0.00 C ATOM 354 C SER A 26 8.862 -6.155 12.294 1.00 0.00 C ATOM 355 O SER A 26 9.242 -5.081 12.758 1.00 0.00 O ATOM 356 CB SER A 26 6.399 -6.264 12.723 1.00 0.00 C ATOM 357 OG SER A 26 6.374 -4.963 13.285 1.00 0.00 O ATOM 0 H SER A 26 8.868 -6.609 14.708 1.00 0.00 H new ATOM 0 HA SER A 26 7.716 -7.947 12.545 1.00 0.00 H new ATOM 0 HB2 SER A 26 6.210 -6.204 11.651 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.599 -6.866 13.155 1.00 0.00 H new ATOM 0 HG SER A 26 7.292 -4.638 13.398 1.00 0.00 H new ATOM 363 N GLY A 27 9.387 -6.694 11.198 1.00 0.00 N ATOM 364 CA GLY A 27 10.459 -6.022 10.487 1.00 0.00 C ATOM 365 C GLY A 27 10.962 -6.819 9.299 1.00 0.00 C ATOM 366 O GLY A 27 10.998 -8.048 9.338 1.00 0.00 O ATOM 0 H GLY A 27 9.090 -7.581 10.791 1.00 0.00 H new ATOM 0 HA2 GLY A 27 10.108 -5.049 10.144 1.00 0.00 H new ATOM 0 HA3 GLY A 27 11.286 -5.839 11.173 1.00 0.00 H new ATOM 370 N ARG A 28 11.351 -6.114 8.241 1.00 0.00 N ATOM 371 CA ARG A 28 11.856 -6.760 7.032 1.00 0.00 C ATOM 372 C ARG A 28 12.766 -5.816 6.251 1.00 0.00 C ATOM 373 O ARG A 28 13.832 -6.216 5.783 1.00 0.00 O ATOM 374 CB ARG A 28 10.696 -7.217 6.144 1.00 0.00 C ATOM 375 CG ARG A 28 9.850 -8.319 6.763 1.00 0.00 C ATOM 376 CD ARG A 28 10.660 -9.585 6.988 1.00 0.00 C ATOM 377 NE ARG A 28 11.176 -10.135 5.738 1.00 0.00 N ATOM 378 CZ ARG A 28 11.912 -11.241 5.663 1.00 0.00 C ATOM 379 NH1 ARG A 28 12.220 -11.918 6.762 1.00 0.00 N ATOM 380 NH2 ARG A 28 12.341 -11.673 4.484 1.00 0.00 N ATOM 0 H ARG A 28 11.327 -5.095 8.195 1.00 0.00 H new ATOM 0 HA ARG A 28 12.436 -7.632 7.334 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.058 -6.361 5.925 1.00 0.00 H new ATOM 0 HB3 ARG A 28 11.095 -7.568 5.192 1.00 0.00 H new ATOM 0 HG2 ARG A 28 9.441 -7.975 7.713 1.00 0.00 H new ATOM 0 HG3 ARG A 28 9.004 -8.538 6.112 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.491 -9.369 7.659 1.00 0.00 H new ATOM 0 HD3 ARG A 28 10.037 -10.331 7.482 1.00 0.00 H new ATOM 0 HE ARG A 28 10.960 -9.643 4.871 1.00 0.00 H new ATOM 0 HH11 ARG A 28 11.892 -11.591 7.671 1.00 0.00 H new ATOM 0 HH12 ARG A 28 12.785 -12.765 6.698 1.00 0.00 H new ATOM 0 HH21 ARG A 28 12.107 -11.157 3.636 1.00 0.00 H new ATOM 0 HH22 ARG A 28 12.905 -12.521 4.426 1.00 0.00 H new ATOM 394 N GLY A 29 12.342 -4.563 6.115 1.00 0.00 N ATOM 395 CA GLY A 29 13.139 -3.589 5.391 1.00 0.00 C ATOM 396 C GLY A 29 12.525 -2.202 5.401 1.00 0.00 C ATOM 397 O GLY A 29 12.017 -1.748 6.426 1.00 0.00 O ATOM 0 H GLY A 29 11.464 -4.206 6.492 1.00 0.00 H new ATOM 0 HA2 GLY A 29 14.136 -3.543 5.830 1.00 0.00 H new ATOM 0 HA3 GLY A 29 13.260 -3.920 4.360 1.00 0.00 H new ATOM 401 N TYR A 30 12.575 -1.530 4.254 1.00 0.00 N ATOM 402 CA TYR A 30 12.025 -0.185 4.127 1.00 0.00 C ATOM 403 C TYR A 30 12.210 0.346 2.709 1.00 0.00 C ATOM 404 O TYR A 30 13.241 0.112 2.079 1.00 0.00 O ATOM 405 CB TYR A 30 12.685 0.757 5.141 1.00 0.00 C ATOM 406 CG TYR A 30 14.196 0.792 5.053 1.00 0.00 C ATOM 407 CD1 TYR A 30 14.839 1.316 3.938 1.00 0.00 C ATOM 408 CD2 TYR A 30 14.980 0.305 6.094 1.00 0.00 C ATOM 409 CE1 TYR A 30 16.219 1.351 3.861 1.00 0.00 C ATOM 410 CE2 TYR A 30 16.359 0.338 6.024 1.00 0.00 C ATOM 411 CZ TYR A 30 16.974 0.860 4.905 1.00 0.00 C ATOM 412 OH TYR A 30 18.347 0.893 4.833 1.00 0.00 O ATOM 0 H TYR A 30 12.992 -1.896 3.398 1.00 0.00 H new ATOM 0 HA TYR A 30 10.956 -0.231 4.336 1.00 0.00 H new ATOM 0 HB2 TYR A 30 12.299 1.765 4.991 1.00 0.00 H new ATOM 0 HB3 TYR A 30 12.396 0.452 6.147 1.00 0.00 H new ATOM 0 HD1 TYR A 30 14.251 1.702 3.118 1.00 0.00 H new ATOM 0 HD2 TYR A 30 14.502 -0.106 6.971 1.00 0.00 H new ATOM 0 HE1 TYR A 30 16.703 1.761 2.987 1.00 0.00 H new ATOM 0 HE2 TYR A 30 16.953 -0.043 6.842 1.00 0.00 H new ATOM 0 HH TYR A 30 18.727 0.510 5.651 1.00 0.00 H new ATOM 422 N LEU A 31 11.200 1.051 2.208 1.00 0.00 N ATOM 423 CA LEU A 31 11.253 1.607 0.860 1.00 0.00 C ATOM 424 C LEU A 31 11.118 3.126 0.891 1.00 0.00 C ATOM 425 O LEU A 31 10.159 3.660 1.445 1.00 0.00 O ATOM 426 CB LEU A 31 10.134 1.009 0.002 1.00 0.00 C ATOM 427 CG LEU A 31 10.136 -0.517 -0.098 1.00 0.00 C ATOM 428 CD1 LEU A 31 8.942 -1.000 -0.910 1.00 0.00 C ATOM 429 CD2 LEU A 31 11.436 -1.009 -0.717 1.00 0.00 C ATOM 0 H LEU A 31 10.337 1.250 2.714 1.00 0.00 H new ATOM 0 HA LEU A 31 12.220 1.353 0.426 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.175 1.329 0.409 1.00 0.00 H new ATOM 0 HB3 LEU A 31 10.208 1.423 -1.003 1.00 0.00 H new ATOM 0 HG LEU A 31 10.057 -0.928 0.908 1.00 0.00 H new ATOM 0 HD11 LEU A 31 8.960 -2.088 -0.971 1.00 0.00 H new ATOM 0 HD12 LEU A 31 8.019 -0.678 -0.427 1.00 0.00 H new ATOM 0 HD13 LEU A 31 8.991 -0.580 -1.914 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.420 -2.097 -0.780 1.00 0.00 H new ATOM 0 HD22 LEU A 31 11.545 -0.589 -1.717 1.00 0.00 H new ATOM 0 HD23 LEU A 31 12.276 -0.694 -0.098 1.00 0.00 H new ATOM 441 N VAL A 32 12.072 3.818 0.276 1.00 0.00 N ATOM 442 CA VAL A 32 12.044 5.275 0.225 1.00 0.00 C ATOM 443 C VAL A 32 10.949 5.753 -0.722 1.00 0.00 C ATOM 444 O VAL A 32 10.690 5.120 -1.744 1.00 0.00 O ATOM 445 CB VAL A 32 13.398 5.850 -0.237 1.00 0.00 C ATOM 446 CG1 VAL A 32 13.374 7.370 -0.225 1.00 0.00 C ATOM 447 CG2 VAL A 32 14.526 5.321 0.638 1.00 0.00 C ATOM 0 H VAL A 32 12.872 3.394 -0.193 1.00 0.00 H new ATOM 0 HA VAL A 32 11.840 5.631 1.235 1.00 0.00 H new ATOM 0 HB VAL A 32 13.576 5.525 -1.262 1.00 0.00 H new ATOM 0 HG11 VAL A 32 14.340 7.752 -0.555 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.594 7.727 -0.898 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.170 7.723 0.786 1.00 0.00 H new ATOM 0 HG21 VAL A 32 15.475 5.736 0.299 1.00 0.00 H new ATOM 0 HG22 VAL A 32 14.351 5.614 1.673 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.561 4.234 0.569 1.00 0.00 H new ATOM 457 N ARG A 33 10.300 6.865 -0.383 1.00 0.00 N ATOM 458 CA ARG A 33 9.230 7.401 -1.222 1.00 0.00 C ATOM 459 C ARG A 33 9.708 7.627 -2.654 1.00 0.00 C ATOM 460 O ARG A 33 10.881 7.918 -2.892 1.00 0.00 O ATOM 461 CB ARG A 33 8.688 8.713 -0.645 1.00 0.00 C ATOM 462 CG ARG A 33 8.016 8.554 0.708 1.00 0.00 C ATOM 463 CD ARG A 33 7.300 9.831 1.123 1.00 0.00 C ATOM 464 NE ARG A 33 6.230 10.182 0.191 1.00 0.00 N ATOM 465 CZ ARG A 33 5.456 11.257 0.321 1.00 0.00 C ATOM 466 NH1 ARG A 33 5.631 12.089 1.340 1.00 0.00 N ATOM 467 NH2 ARG A 33 4.507 11.502 -0.572 1.00 0.00 N ATOM 0 H ARG A 33 10.494 7.408 0.458 1.00 0.00 H new ATOM 0 HA ARG A 33 8.429 6.662 -1.236 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.508 9.425 -0.552 1.00 0.00 H new ATOM 0 HB3 ARG A 33 7.973 9.141 -1.348 1.00 0.00 H new ATOM 0 HG2 ARG A 33 7.302 7.731 0.668 1.00 0.00 H new ATOM 0 HG3 ARG A 33 8.762 8.292 1.458 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.884 9.706 2.123 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.018 10.649 1.176 1.00 0.00 H new ATOM 0 HE ARG A 33 6.067 9.567 -0.606 1.00 0.00 H new ATOM 0 HH11 ARG A 33 6.361 11.906 2.028 1.00 0.00 H new ATOM 0 HH12 ARG A 33 5.035 12.911 1.435 1.00 0.00 H new ATOM 0 HH21 ARG A 33 4.370 10.867 -1.358 1.00 0.00 H new ATOM 0 HH22 ARG A 33 3.914 12.326 -0.473 1.00 0.00 H new ATOM 481 N LYS A 34 8.787 7.490 -3.603 1.00 0.00 N ATOM 482 CA LYS A 34 9.104 7.677 -5.017 1.00 0.00 C ATOM 483 C LYS A 34 7.870 8.181 -5.770 1.00 0.00 C ATOM 484 O LYS A 34 6.996 8.814 -5.178 1.00 0.00 O ATOM 485 CB LYS A 34 9.585 6.353 -5.619 1.00 0.00 C ATOM 486 CG LYS A 34 10.716 5.701 -4.843 1.00 0.00 C ATOM 487 CD LYS A 34 11.113 4.368 -5.461 1.00 0.00 C ATOM 488 CE LYS A 34 12.173 3.665 -4.630 1.00 0.00 C ATOM 489 NZ LYS A 34 13.415 4.479 -4.500 1.00 0.00 N ATOM 0 H LYS A 34 7.813 7.250 -3.419 1.00 0.00 H new ATOM 0 HA LYS A 34 9.897 8.419 -5.110 1.00 0.00 H new ATOM 0 HB2 LYS A 34 8.745 5.661 -5.668 1.00 0.00 H new ATOM 0 HB3 LYS A 34 9.914 6.529 -6.643 1.00 0.00 H new ATOM 0 HG2 LYS A 34 11.579 6.367 -4.824 1.00 0.00 H new ATOM 0 HG3 LYS A 34 10.409 5.548 -3.808 1.00 0.00 H new ATOM 0 HD2 LYS A 34 10.234 3.729 -5.548 1.00 0.00 H new ATOM 0 HD3 LYS A 34 11.489 4.531 -6.471 1.00 0.00 H new ATOM 0 HE2 LYS A 34 11.774 3.453 -3.638 1.00 0.00 H new ATOM 0 HE3 LYS A 34 12.415 2.706 -5.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 14.162 3.905 -4.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 13.727 4.789 -5.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 13.224 5.312 -3.907 1.00 0.00 H new ATOM 503 N THR A 35 7.791 7.893 -7.070 1.00 0.00 N ATOM 504 CA THR A 35 6.650 8.319 -7.869 1.00 0.00 C ATOM 505 C THR A 35 5.532 7.278 -7.776 1.00 0.00 C ATOM 506 O THR A 35 5.501 6.484 -6.835 1.00 0.00 O ATOM 507 CB THR A 35 7.052 8.534 -9.344 1.00 0.00 C ATOM 508 OG1 THR A 35 8.402 9.010 -9.415 1.00 0.00 O ATOM 509 CG2 THR A 35 6.136 9.548 -10.016 1.00 0.00 C ATOM 0 H THR A 35 8.499 7.371 -7.585 1.00 0.00 H new ATOM 0 HA THR A 35 6.293 9.270 -7.474 1.00 0.00 H new ATOM 0 HB THR A 35 6.963 7.579 -9.861 1.00 0.00 H new ATOM 0 HG1 THR A 35 8.653 9.143 -10.353 1.00 0.00 H new ATOM 0 HG21 THR A 35 6.440 9.681 -11.054 1.00 0.00 H new ATOM 0 HG22 THR A 35 5.108 9.188 -9.983 1.00 0.00 H new ATOM 0 HG23 THR A 35 6.203 10.502 -9.493 1.00 0.00 H new ATOM 517 N LEU A 36 4.620 7.264 -8.743 1.00 0.00 N ATOM 518 CA LEU A 36 3.526 6.298 -8.731 1.00 0.00 C ATOM 519 C LEU A 36 3.981 4.950 -9.281 1.00 0.00 C ATOM 520 O LEU A 36 3.735 3.911 -8.673 1.00 0.00 O ATOM 521 CB LEU A 36 2.315 6.817 -9.526 1.00 0.00 C ATOM 522 CG LEU A 36 2.501 6.941 -11.044 1.00 0.00 C ATOM 523 CD1 LEU A 36 1.160 7.186 -11.719 1.00 0.00 C ATOM 524 CD2 LEU A 36 3.466 8.067 -11.386 1.00 0.00 C ATOM 0 H LEU A 36 4.615 7.904 -9.538 1.00 0.00 H new ATOM 0 HA LEU A 36 3.220 6.163 -7.694 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.472 6.152 -9.338 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.042 7.797 -9.134 1.00 0.00 H new ATOM 0 HG LEU A 36 2.922 6.005 -11.410 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.305 7.272 -12.796 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.489 6.353 -11.509 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.723 8.109 -11.337 1.00 0.00 H new ATOM 0 HD21 LEU A 36 3.580 8.133 -12.468 1.00 0.00 H new ATOM 0 HD22 LEU A 36 3.075 9.010 -11.004 1.00 0.00 H new ATOM 0 HD23 LEU A 36 4.436 7.866 -10.931 1.00 0.00 H new ATOM 536 N GLU A 37 4.644 4.978 -10.431 1.00 0.00 N ATOM 537 CA GLU A 37 5.131 3.758 -11.068 1.00 0.00 C ATOM 538 C GLU A 37 6.232 3.102 -10.241 1.00 0.00 C ATOM 539 O GLU A 37 6.297 1.877 -10.135 1.00 0.00 O ATOM 540 CB GLU A 37 5.652 4.066 -12.473 1.00 0.00 C ATOM 541 CG GLU A 37 6.795 5.068 -12.493 1.00 0.00 C ATOM 542 CD GLU A 37 7.287 5.364 -13.896 1.00 0.00 C ATOM 543 OE1 GLU A 37 7.733 4.419 -14.580 1.00 0.00 O ATOM 544 OE2 GLU A 37 7.224 6.540 -14.312 1.00 0.00 O ATOM 0 H GLU A 37 4.858 5.834 -10.943 1.00 0.00 H new ATOM 0 HA GLU A 37 4.295 3.062 -11.137 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.985 3.139 -12.939 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.832 4.451 -13.079 1.00 0.00 H new ATOM 0 HG2 GLU A 37 6.468 5.996 -12.023 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.622 4.683 -11.896 1.00 0.00 H new ATOM 551 N GLU A 38 7.099 3.925 -9.664 1.00 0.00 N ATOM 552 CA GLU A 38 8.207 3.422 -8.852 1.00 0.00 C ATOM 553 C GLU A 38 7.679 2.632 -7.667 1.00 0.00 C ATOM 554 O GLU A 38 8.042 1.474 -7.462 1.00 0.00 O ATOM 555 CB GLU A 38 9.065 4.574 -8.326 1.00 0.00 C ATOM 556 CG GLU A 38 9.191 5.738 -9.287 1.00 0.00 C ATOM 557 CD GLU A 38 9.725 5.325 -10.647 1.00 0.00 C ATOM 558 OE1 GLU A 38 9.994 4.121 -10.839 1.00 0.00 O ATOM 559 OE2 GLU A 38 9.872 6.207 -11.519 1.00 0.00 O ATOM 0 H GLU A 38 7.059 4.941 -9.741 1.00 0.00 H new ATOM 0 HA GLU A 38 8.815 2.778 -9.487 1.00 0.00 H new ATOM 0 HB2 GLU A 38 8.638 4.934 -7.390 1.00 0.00 H new ATOM 0 HB3 GLU A 38 10.061 4.196 -8.097 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.215 6.207 -9.412 1.00 0.00 H new ATOM 0 HG3 GLU A 38 9.852 6.489 -8.855 1.00 0.00 H new ATOM 566 N ASP A 39 6.821 3.275 -6.884 1.00 0.00 N ATOM 567 CA ASP A 39 6.238 2.640 -5.704 1.00 0.00 C ATOM 568 C ASP A 39 5.606 1.293 -6.048 1.00 0.00 C ATOM 569 O ASP A 39 5.851 0.297 -5.370 1.00 0.00 O ATOM 570 CB ASP A 39 5.203 3.560 -5.056 1.00 0.00 C ATOM 571 CG ASP A 39 5.843 4.729 -4.332 1.00 0.00 C ATOM 572 OD1 ASP A 39 6.625 5.467 -4.967 1.00 0.00 O ATOM 573 OD2 ASP A 39 5.563 4.907 -3.128 1.00 0.00 O ATOM 0 H ASP A 39 6.513 4.234 -7.043 1.00 0.00 H new ATOM 0 HA ASP A 39 7.045 2.460 -4.994 1.00 0.00 H new ATOM 0 HB2 ASP A 39 4.526 3.937 -5.822 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.600 2.986 -4.352 1.00 0.00 H new ATOM 578 N VAL A 40 4.800 1.261 -7.107 1.00 0.00 N ATOM 579 CA VAL A 40 4.153 0.020 -7.528 1.00 0.00 C ATOM 580 C VAL A 40 5.205 -1.015 -7.876 1.00 0.00 C ATOM 581 O VAL A 40 5.215 -2.127 -7.348 1.00 0.00 O ATOM 582 CB VAL A 40 3.270 0.223 -8.775 1.00 0.00 C ATOM 583 CG1 VAL A 40 2.342 -0.965 -8.982 1.00 0.00 C ATOM 584 CG2 VAL A 40 2.492 1.520 -8.687 1.00 0.00 C ATOM 0 H VAL A 40 4.580 2.072 -7.685 1.00 0.00 H new ATOM 0 HA VAL A 40 3.529 -0.310 -6.697 1.00 0.00 H new ATOM 0 HB VAL A 40 3.924 0.290 -9.644 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.729 -0.798 -9.868 1.00 0.00 H new ATOM 0 HG12 VAL A 40 2.934 -1.870 -9.116 1.00 0.00 H new ATOM 0 HG13 VAL A 40 1.697 -1.079 -8.111 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.878 1.637 -9.580 1.00 0.00 H new ATOM 0 HG22 VAL A 40 1.851 1.501 -7.806 1.00 0.00 H new ATOM 0 HG23 VAL A 40 3.187 2.357 -8.612 1.00 0.00 H new ATOM 594 N GLU A 41 6.091 -0.623 -8.780 1.00 0.00 N ATOM 595 CA GLU A 41 7.174 -1.492 -9.233 1.00 0.00 C ATOM 596 C GLU A 41 7.984 -2.022 -8.053 1.00 0.00 C ATOM 597 O GLU A 41 8.295 -3.212 -7.985 1.00 0.00 O ATOM 598 CB GLU A 41 8.089 -0.734 -10.198 1.00 0.00 C ATOM 599 CG GLU A 41 9.259 -1.561 -10.709 1.00 0.00 C ATOM 600 CD GLU A 41 8.819 -2.770 -11.511 1.00 0.00 C ATOM 601 OE1 GLU A 41 7.596 -2.955 -11.690 1.00 0.00 O ATOM 602 OE2 GLU A 41 9.699 -3.533 -11.962 1.00 0.00 O ATOM 0 H GLU A 41 6.083 0.298 -9.219 1.00 0.00 H new ATOM 0 HA GLU A 41 6.731 -2.342 -9.751 1.00 0.00 H new ATOM 0 HB2 GLU A 41 7.500 -0.390 -11.048 1.00 0.00 H new ATOM 0 HB3 GLU A 41 8.475 0.154 -9.697 1.00 0.00 H new ATOM 0 HG2 GLU A 41 9.899 -0.933 -11.329 1.00 0.00 H new ATOM 0 HG3 GLU A 41 9.861 -1.892 -9.863 1.00 0.00 H new ATOM 609 N ALA A 42 8.328 -1.133 -7.125 1.00 0.00 N ATOM 610 CA ALA A 42 9.103 -1.516 -5.950 1.00 0.00 C ATOM 611 C ALA A 42 8.338 -2.516 -5.090 1.00 0.00 C ATOM 612 O ALA A 42 8.889 -3.528 -4.659 1.00 0.00 O ATOM 613 CB ALA A 42 9.467 -0.284 -5.134 1.00 0.00 C ATOM 0 H ALA A 42 8.082 -0.144 -7.164 1.00 0.00 H new ATOM 0 HA ALA A 42 10.020 -1.997 -6.290 1.00 0.00 H new ATOM 0 HB1 ALA A 42 10.045 -0.584 -4.260 1.00 0.00 H new ATOM 0 HB2 ALA A 42 10.060 0.395 -5.746 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.556 0.220 -4.811 1.00 0.00 H new ATOM 619 N LEU A 43 7.066 -2.223 -4.846 1.00 0.00 N ATOM 620 CA LEU A 43 6.220 -3.095 -4.036 1.00 0.00 C ATOM 621 C LEU A 43 6.032 -4.454 -4.699 1.00 0.00 C ATOM 622 O LEU A 43 6.125 -5.491 -4.042 1.00 0.00 O ATOM 623 CB LEU A 43 4.862 -2.436 -3.789 1.00 0.00 C ATOM 624 CG LEU A 43 4.902 -1.190 -2.903 1.00 0.00 C ATOM 625 CD1 LEU A 43 3.533 -0.531 -2.846 1.00 0.00 C ATOM 626 CD2 LEU A 43 5.377 -1.554 -1.506 1.00 0.00 C ATOM 0 H LEU A 43 6.597 -1.388 -5.197 1.00 0.00 H new ATOM 0 HA LEU A 43 6.719 -3.252 -3.080 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.425 -2.166 -4.751 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.197 -3.168 -3.331 1.00 0.00 H new ATOM 0 HG LEU A 43 5.606 -0.479 -3.335 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.581 0.354 -2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 43 3.227 -0.240 -3.851 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.808 -1.233 -2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.401 -0.658 -0.885 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.694 -2.281 -1.067 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.377 -1.984 -1.562 1.00 0.00 H new ATOM 638 N LEU A 44 5.777 -4.447 -6.002 1.00 0.00 N ATOM 639 CA LEU A 44 5.587 -5.690 -6.742 1.00 0.00 C ATOM 640 C LEU A 44 6.840 -6.550 -6.671 1.00 0.00 C ATOM 641 O LEU A 44 6.770 -7.744 -6.383 1.00 0.00 O ATOM 642 CB LEU A 44 5.234 -5.398 -8.200 1.00 0.00 C ATOM 643 CG LEU A 44 3.867 -4.754 -8.411 1.00 0.00 C ATOM 644 CD1 LEU A 44 3.599 -4.544 -9.893 1.00 0.00 C ATOM 645 CD2 LEU A 44 2.780 -5.614 -7.784 1.00 0.00 C ATOM 0 H LEU A 44 5.697 -3.601 -6.566 1.00 0.00 H new ATOM 0 HA LEU A 44 4.761 -6.236 -6.285 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.997 -4.743 -8.620 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.271 -6.331 -8.762 1.00 0.00 H new ATOM 0 HG LEU A 44 3.861 -3.779 -7.924 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.620 -4.084 -10.024 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.365 -3.892 -10.313 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.620 -5.505 -10.406 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.809 -5.144 -7.941 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.785 -6.601 -8.247 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.966 -5.714 -6.715 1.00 0.00 H new ATOM 657 N ASP A 45 7.988 -5.931 -6.923 1.00 0.00 N ATOM 658 CA ASP A 45 9.264 -6.634 -6.879 1.00 0.00 C ATOM 659 C ASP A 45 9.374 -7.477 -5.612 1.00 0.00 C ATOM 660 O ASP A 45 9.844 -8.614 -5.647 1.00 0.00 O ATOM 661 CB ASP A 45 10.417 -5.628 -6.951 1.00 0.00 C ATOM 662 CG ASP A 45 11.778 -6.282 -6.802 1.00 0.00 C ATOM 663 OD1 ASP A 45 12.047 -6.850 -5.724 1.00 0.00 O ATOM 664 OD2 ASP A 45 12.572 -6.225 -7.764 1.00 0.00 O ATOM 0 H ASP A 45 8.061 -4.942 -7.160 1.00 0.00 H new ATOM 0 HA ASP A 45 9.322 -7.303 -7.738 1.00 0.00 H new ATOM 0 HB2 ASP A 45 10.375 -5.101 -7.904 1.00 0.00 H new ATOM 0 HB3 ASP A 45 10.290 -4.881 -6.168 1.00 0.00 H new ATOM 669 N PHE A 46 8.932 -6.906 -4.498 1.00 0.00 N ATOM 670 CA PHE A 46 8.976 -7.596 -3.216 1.00 0.00 C ATOM 671 C PHE A 46 7.891 -8.665 -3.123 1.00 0.00 C ATOM 672 O PHE A 46 8.119 -9.745 -2.583 1.00 0.00 O ATOM 673 CB PHE A 46 8.818 -6.588 -2.074 1.00 0.00 C ATOM 674 CG PHE A 46 8.874 -7.210 -0.706 1.00 0.00 C ATOM 675 CD1 PHE A 46 9.826 -8.172 -0.405 1.00 0.00 C ATOM 676 CD2 PHE A 46 7.975 -6.832 0.278 1.00 0.00 C ATOM 677 CE1 PHE A 46 9.880 -8.742 0.853 1.00 0.00 C ATOM 678 CE2 PHE A 46 8.023 -7.400 1.536 1.00 0.00 C ATOM 679 CZ PHE A 46 8.977 -8.356 1.824 1.00 0.00 C ATOM 0 H PHE A 46 8.539 -5.966 -4.457 1.00 0.00 H new ATOM 0 HA PHE A 46 9.944 -8.090 -3.132 1.00 0.00 H new ATOM 0 HB2 PHE A 46 9.603 -5.836 -2.154 1.00 0.00 H new ATOM 0 HB3 PHE A 46 7.866 -6.069 -2.189 1.00 0.00 H new ATOM 0 HD1 PHE A 46 10.533 -8.479 -1.162 1.00 0.00 H new ATOM 0 HD2 PHE A 46 7.227 -6.084 0.059 1.00 0.00 H new ATOM 0 HE1 PHE A 46 10.628 -9.489 1.076 1.00 0.00 H new ATOM 0 HE2 PHE A 46 7.315 -7.097 2.293 1.00 0.00 H new ATOM 0 HZ PHE A 46 9.017 -8.801 2.807 1.00 0.00 H new ATOM 689 N VAL A 47 6.705 -8.351 -3.630 1.00 0.00 N ATOM 690 CA VAL A 47 5.578 -9.280 -3.580 1.00 0.00 C ATOM 691 C VAL A 47 5.840 -10.565 -4.369 1.00 0.00 C ATOM 692 O VAL A 47 5.692 -11.664 -3.834 1.00 0.00 O ATOM 693 CB VAL A 47 4.289 -8.618 -4.105 1.00 0.00 C ATOM 694 CG1 VAL A 47 3.113 -9.580 -4.025 1.00 0.00 C ATOM 695 CG2 VAL A 47 3.994 -7.343 -3.329 1.00 0.00 C ATOM 0 H VAL A 47 6.497 -7.460 -4.081 1.00 0.00 H new ATOM 0 HA VAL A 47 5.453 -9.546 -2.530 1.00 0.00 H new ATOM 0 HB VAL A 47 4.440 -8.358 -5.153 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.215 -9.089 -4.401 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.324 -10.463 -4.628 1.00 0.00 H new ATOM 0 HG13 VAL A 47 2.956 -9.878 -2.988 1.00 0.00 H new ATOM 0 HG21 VAL A 47 3.081 -6.887 -3.712 1.00 0.00 H new ATOM 0 HG22 VAL A 47 3.866 -7.581 -2.273 1.00 0.00 H new ATOM 0 HG23 VAL A 47 4.824 -6.646 -3.446 1.00 0.00 H new ATOM 705 N ARG A 48 6.207 -10.433 -5.641 1.00 0.00 N ATOM 706 CA ARG A 48 6.456 -11.609 -6.480 1.00 0.00 C ATOM 707 C ARG A 48 7.748 -12.333 -6.110 1.00 0.00 C ATOM 708 O ARG A 48 7.722 -13.497 -5.713 1.00 0.00 O ATOM 709 CB ARG A 48 6.478 -11.255 -7.974 1.00 0.00 C ATOM 710 CG ARG A 48 6.912 -9.835 -8.305 1.00 0.00 C ATOM 711 CD ARG A 48 6.928 -9.609 -9.809 1.00 0.00 C ATOM 712 NE ARG A 48 7.432 -8.286 -10.169 1.00 0.00 N ATOM 713 CZ ARG A 48 8.697 -7.907 -10.010 1.00 0.00 C ATOM 714 NH1 ARG A 48 9.597 -8.754 -9.523 1.00 0.00 N ATOM 715 NH2 ARG A 48 9.069 -6.679 -10.347 1.00 0.00 N ATOM 0 H ARG A 48 6.338 -9.538 -6.111 1.00 0.00 H new ATOM 0 HA ARG A 48 5.621 -12.284 -6.289 1.00 0.00 H new ATOM 0 HB2 ARG A 48 7.147 -11.949 -8.484 1.00 0.00 H new ATOM 0 HB3 ARG A 48 5.480 -11.416 -8.382 1.00 0.00 H new ATOM 0 HG2 ARG A 48 6.234 -9.124 -7.834 1.00 0.00 H new ATOM 0 HG3 ARG A 48 7.904 -9.649 -7.895 1.00 0.00 H new ATOM 0 HD2 ARG A 48 7.547 -10.371 -10.281 1.00 0.00 H new ATOM 0 HD3 ARG A 48 5.919 -9.729 -10.202 1.00 0.00 H new ATOM 0 HE ARG A 48 6.775 -7.614 -10.565 1.00 0.00 H new ATOM 0 HH11 ARG A 48 9.320 -9.702 -9.268 1.00 0.00 H new ATOM 0 HH12 ARG A 48 10.565 -8.456 -9.404 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.385 -6.025 -10.728 1.00 0.00 H new ATOM 0 HH22 ARG A 48 10.039 -6.388 -10.225 1.00 0.00 H new ATOM 729 N ARG A 49 8.875 -11.651 -6.260 1.00 0.00 N ATOM 730 CA ARG A 49 10.176 -12.252 -5.959 1.00 0.00 C ATOM 731 C ARG A 49 10.180 -12.959 -4.602 1.00 0.00 C ATOM 732 O ARG A 49 10.590 -14.115 -4.502 1.00 0.00 O ATOM 733 CB ARG A 49 11.280 -11.193 -6.000 1.00 0.00 C ATOM 734 CG ARG A 49 11.446 -10.547 -7.366 1.00 0.00 C ATOM 735 CD ARG A 49 12.592 -9.544 -7.394 1.00 0.00 C ATOM 736 NE ARG A 49 13.883 -10.160 -7.088 1.00 0.00 N ATOM 737 CZ ARG A 49 14.312 -10.428 -5.857 1.00 0.00 C ATOM 738 NH1 ARG A 49 13.604 -10.053 -4.799 1.00 0.00 N ATOM 739 NH2 ARG A 49 15.469 -11.051 -5.680 1.00 0.00 N ATOM 0 H ARG A 49 8.920 -10.686 -6.586 1.00 0.00 H new ATOM 0 HA ARG A 49 10.369 -13.002 -6.726 1.00 0.00 H new ATOM 0 HB2 ARG A 49 11.059 -10.419 -5.265 1.00 0.00 H new ATOM 0 HB3 ARG A 49 12.224 -11.651 -5.706 1.00 0.00 H new ATOM 0 HG2 ARG A 49 11.625 -11.321 -8.112 1.00 0.00 H new ATOM 0 HG3 ARG A 49 10.519 -10.045 -7.643 1.00 0.00 H new ATOM 0 HD2 ARG A 49 12.639 -9.079 -8.379 1.00 0.00 H new ATOM 0 HD3 ARG A 49 12.393 -8.749 -6.675 1.00 0.00 H new ATOM 0 HE ARG A 49 14.494 -10.400 -7.869 1.00 0.00 H new ATOM 0 HH11 ARG A 49 12.723 -9.555 -4.925 1.00 0.00 H new ATOM 0 HH12 ARG A 49 13.941 -10.263 -3.859 1.00 0.00 H new ATOM 0 HH21 ARG A 49 16.030 -11.325 -6.487 1.00 0.00 H new ATOM 0 HH22 ARG A 49 15.798 -11.257 -4.737 1.00 0.00 H new ATOM 753 N GLU A 50 9.725 -12.265 -3.562 1.00 0.00 N ATOM 754 CA GLU A 50 9.685 -12.847 -2.221 1.00 0.00 C ATOM 755 C GLU A 50 8.531 -13.841 -2.079 1.00 0.00 C ATOM 756 O GLU A 50 8.409 -14.521 -1.059 1.00 0.00 O ATOM 757 CB GLU A 50 9.558 -11.750 -1.162 1.00 0.00 C ATOM 758 CG GLU A 50 9.664 -12.264 0.264 1.00 0.00 C ATOM 759 CD GLU A 50 10.978 -12.970 0.533 1.00 0.00 C ATOM 760 OE1 GLU A 50 12.038 -12.326 0.386 1.00 0.00 O ATOM 761 OE2 GLU A 50 10.947 -14.166 0.889 1.00 0.00 O ATOM 0 H GLU A 50 9.381 -11.306 -3.619 1.00 0.00 H new ATOM 0 HA GLU A 50 10.621 -13.384 -2.068 1.00 0.00 H new ATOM 0 HB2 GLU A 50 10.335 -11.004 -1.329 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.600 -11.246 -1.287 1.00 0.00 H new ATOM 0 HG2 GLU A 50 9.556 -11.429 0.956 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.840 -12.950 0.461 1.00 0.00 H new ATOM 768 N GLY A 51 7.686 -13.925 -3.104 1.00 0.00 N ATOM 769 CA GLY A 51 6.560 -14.840 -3.070 1.00 0.00 C ATOM 770 C GLY A 51 5.620 -14.567 -1.912 1.00 0.00 C ATOM 771 O GLY A 51 5.107 -15.496 -1.290 1.00 0.00 O ATOM 0 H GLY A 51 7.762 -13.374 -3.959 1.00 0.00 H new ATOM 0 HA2 GLY A 51 6.008 -14.765 -4.007 1.00 0.00 H new ATOM 0 HA3 GLY A 51 6.930 -15.863 -2.999 1.00 0.00 H new ATOM 775 N LEU A 52 5.389 -13.290 -1.624 1.00 0.00 N ATOM 776 CA LEU A 52 4.498 -12.905 -0.535 1.00 0.00 C ATOM 777 C LEU A 52 3.045 -13.163 -0.904 1.00 0.00 C ATOM 778 O LEU A 52 2.316 -13.830 -0.169 1.00 0.00 O ATOM 779 CB LEU A 52 4.693 -11.429 -0.181 1.00 0.00 C ATOM 780 CG LEU A 52 6.094 -11.059 0.306 1.00 0.00 C ATOM 781 CD1 LEU A 52 6.169 -9.576 0.639 1.00 0.00 C ATOM 782 CD2 LEU A 52 6.478 -11.903 1.512 1.00 0.00 C ATOM 0 H LEU A 52 5.805 -12.507 -2.128 1.00 0.00 H new ATOM 0 HA LEU A 52 4.747 -13.514 0.334 1.00 0.00 H new ATOM 0 HB2 LEU A 52 4.460 -10.827 -1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 52 3.973 -11.158 0.592 1.00 0.00 H new ATOM 0 HG LEU A 52 6.804 -11.264 -0.495 1.00 0.00 H new ATOM 0 HD11 LEU A 52 7.174 -9.331 0.984 1.00 0.00 H new ATOM 0 HD12 LEU A 52 5.938 -8.991 -0.251 1.00 0.00 H new ATOM 0 HD13 LEU A 52 5.449 -9.342 1.423 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.478 -11.627 1.846 1.00 0.00 H new ATOM 0 HD22 LEU A 52 5.766 -11.730 2.319 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.466 -12.958 1.237 1.00 0.00 H new ATOM 794 N GLY A 53 2.627 -12.630 -2.045 1.00 0.00 N ATOM 795 CA GLY A 53 1.261 -12.814 -2.492 1.00 0.00 C ATOM 796 C GLY A 53 0.248 -12.362 -1.458 1.00 0.00 C ATOM 797 O GLY A 53 -0.755 -13.036 -1.224 1.00 0.00 O ATOM 0 H GLY A 53 3.211 -12.073 -2.669 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.106 -12.257 -3.416 1.00 0.00 H new ATOM 0 HA3 GLY A 53 1.096 -13.866 -2.723 1.00 0.00 H new ATOM 801 N LYS A 54 0.514 -11.217 -0.835 1.00 0.00 N ATOM 802 CA LYS A 54 -0.379 -10.676 0.187 1.00 0.00 C ATOM 803 C LYS A 54 0.149 -9.342 0.697 1.00 0.00 C ATOM 804 O LYS A 54 1.305 -9.245 1.108 1.00 0.00 O ATOM 805 CB LYS A 54 -0.492 -11.658 1.350 1.00 0.00 C ATOM 806 CG LYS A 54 -1.625 -11.343 2.311 1.00 0.00 C ATOM 807 CD LYS A 54 -1.739 -12.402 3.397 1.00 0.00 C ATOM 808 CE LYS A 54 -2.909 -12.127 4.326 1.00 0.00 C ATOM 809 NZ LYS A 54 -3.038 -13.172 5.379 1.00 0.00 N ATOM 0 H LYS A 54 1.339 -10.646 -1.019 1.00 0.00 H new ATOM 0 HA LYS A 54 -1.363 -10.523 -0.256 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -0.634 -12.663 0.952 1.00 0.00 H new ATOM 0 HB3 LYS A 54 0.448 -11.664 1.901 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -1.457 -10.368 2.767 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -2.564 -11.280 1.761 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -1.861 -13.383 2.938 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -0.815 -12.433 3.974 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -2.778 -11.152 4.796 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -3.830 -12.080 3.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -3.930 -13.036 5.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -3.035 -14.113 4.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -2.239 -13.098 6.041 1.00 0.00 H new ATOM 823 N LEU A 55 -0.694 -8.315 0.672 1.00 0.00 N ATOM 824 CA LEU A 55 -0.282 -6.993 1.133 1.00 0.00 C ATOM 825 C LEU A 55 -1.400 -6.284 1.892 1.00 0.00 C ATOM 826 O LEU A 55 -2.555 -6.285 1.469 1.00 0.00 O ATOM 827 CB LEU A 55 0.159 -6.127 -0.053 1.00 0.00 C ATOM 828 CG LEU A 55 1.350 -6.660 -0.860 1.00 0.00 C ATOM 829 CD1 LEU A 55 2.505 -7.029 0.060 1.00 0.00 C ATOM 830 CD2 LEU A 55 0.935 -7.850 -1.715 1.00 0.00 C ATOM 0 H LEU A 55 -1.657 -8.370 0.341 1.00 0.00 H new ATOM 0 HA LEU A 55 0.556 -7.135 1.815 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.689 -6.008 -0.727 1.00 0.00 H new ATOM 0 HB3 LEU A 55 0.411 -5.134 0.320 1.00 0.00 H new ATOM 0 HG LEU A 55 1.690 -5.867 -1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 55 3.338 -7.404 -0.534 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.824 -6.147 0.615 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.181 -7.800 0.759 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.796 -8.211 -2.278 1.00 0.00 H new ATOM 0 HD22 LEU A 55 0.562 -8.647 -1.072 1.00 0.00 H new ATOM 0 HD23 LEU A 55 0.150 -7.545 -2.407 1.00 0.00 H new ATOM 842 N VAL A 56 -1.038 -5.668 3.015 1.00 0.00 N ATOM 843 CA VAL A 56 -1.996 -4.938 3.835 1.00 0.00 C ATOM 844 C VAL A 56 -1.626 -3.457 3.904 1.00 0.00 C ATOM 845 O VAL A 56 -0.497 -3.103 4.258 1.00 0.00 O ATOM 846 CB VAL A 56 -2.076 -5.516 5.263 1.00 0.00 C ATOM 847 CG1 VAL A 56 -0.742 -5.379 5.981 1.00 0.00 C ATOM 848 CG2 VAL A 56 -3.188 -4.842 6.051 1.00 0.00 C ATOM 0 H VAL A 56 -0.084 -5.661 3.377 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.973 -5.046 3.365 1.00 0.00 H new ATOM 0 HB VAL A 56 -2.307 -6.579 5.187 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.825 -5.794 6.986 1.00 0.00 H new ATOM 0 HG12 VAL A 56 0.026 -5.919 5.428 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -0.470 -4.325 6.045 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.229 -5.263 7.056 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -2.992 -3.772 6.114 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -4.141 -5.008 5.549 1.00 0.00 H new ATOM 858 N VAL A 57 -2.577 -2.597 3.552 1.00 0.00 N ATOM 859 CA VAL A 57 -2.346 -1.156 3.560 1.00 0.00 C ATOM 860 C VAL A 57 -2.423 -0.582 4.970 1.00 0.00 C ATOM 861 O VAL A 57 -3.109 -1.120 5.838 1.00 0.00 O ATOM 862 CB VAL A 57 -3.357 -0.412 2.666 1.00 0.00 C ATOM 863 CG1 VAL A 57 -2.980 1.058 2.542 1.00 0.00 C ATOM 864 CG2 VAL A 57 -3.447 -1.067 1.297 1.00 0.00 C ATOM 0 H VAL A 57 -3.514 -2.872 3.258 1.00 0.00 H new ATOM 0 HA VAL A 57 -1.341 -1.007 3.166 1.00 0.00 H new ATOM 0 HB VAL A 57 -4.340 -0.472 3.134 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -3.705 1.567 1.907 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.977 1.518 3.530 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -1.987 1.143 2.100 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -4.166 -0.526 0.682 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.469 -1.043 0.817 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -3.771 -2.102 1.409 1.00 0.00 H new ATOM 874 N GLY A 58 -1.716 0.522 5.179 1.00 0.00 N ATOM 875 CA GLY A 58 -1.711 1.177 6.473 1.00 0.00 C ATOM 876 C GLY A 58 -1.278 2.625 6.363 1.00 0.00 C ATOM 877 O GLY A 58 -0.260 2.925 5.739 1.00 0.00 O ATOM 0 H GLY A 58 -1.142 0.978 4.470 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -2.708 1.127 6.911 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -1.040 0.646 7.148 1.00 0.00 H new ATOM 881 N LEU A 59 -2.055 3.525 6.953 1.00 0.00 N ATOM 882 CA LEU A 59 -1.746 4.949 6.895 1.00 0.00 C ATOM 883 C LEU A 59 -2.318 5.689 8.104 1.00 0.00 C ATOM 884 O LEU A 59 -3.459 5.454 8.501 1.00 0.00 O ATOM 885 CB LEU A 59 -2.315 5.558 5.610 1.00 0.00 C ATOM 886 CG LEU A 59 -1.832 4.913 4.308 1.00 0.00 C ATOM 887 CD1 LEU A 59 -2.568 5.507 3.116 1.00 0.00 C ATOM 888 CD2 LEU A 59 -0.330 5.096 4.145 1.00 0.00 C ATOM 0 H LEU A 59 -2.901 3.296 7.475 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.661 5.056 6.904 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.402 5.492 5.647 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.061 6.618 5.587 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.047 3.845 4.354 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.213 5.038 2.198 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.638 5.330 3.224 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.381 6.580 3.071 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.006 4.631 3.214 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.094 6.160 4.121 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.187 4.629 4.983 1.00 0.00 H new ATOM 900 N PRO A 60 -1.534 6.606 8.700 1.00 0.00 N ATOM 901 CA PRO A 60 -1.974 7.385 9.863 1.00 0.00 C ATOM 902 C PRO A 60 -3.064 8.390 9.502 1.00 0.00 C ATOM 903 O PRO A 60 -3.023 9.006 8.438 1.00 0.00 O ATOM 904 CB PRO A 60 -0.703 8.113 10.308 1.00 0.00 C ATOM 905 CG PRO A 60 0.131 8.203 9.079 1.00 0.00 C ATOM 906 CD PRO A 60 -0.162 6.958 8.287 1.00 0.00 C ATOM 0 HA PRO A 60 -2.410 6.753 10.637 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -0.932 9.102 10.705 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -0.188 7.564 11.097 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -0.114 9.097 8.506 1.00 0.00 H new ATOM 0 HG3 PRO A 60 1.190 8.266 9.330 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -0.099 7.140 7.214 1.00 0.00 H new ATOM 0 HD3 PRO A 60 0.544 6.160 8.517 1.00 0.00 H new ATOM 914 N LEU A 61 -4.039 8.549 10.392 1.00 0.00 N ATOM 915 CA LEU A 61 -5.139 9.479 10.161 1.00 0.00 C ATOM 916 C LEU A 61 -4.618 10.888 9.891 1.00 0.00 C ATOM 917 O LEU A 61 -3.817 11.424 10.657 1.00 0.00 O ATOM 918 CB LEU A 61 -6.081 9.495 11.367 1.00 0.00 C ATOM 919 CG LEU A 61 -7.273 10.447 11.247 1.00 0.00 C ATOM 920 CD1 LEU A 61 -8.134 10.075 10.048 1.00 0.00 C ATOM 921 CD2 LEU A 61 -8.098 10.434 12.524 1.00 0.00 C ATOM 0 H LEU A 61 -4.090 8.047 11.278 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.687 9.141 9.282 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.457 8.485 11.528 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -5.507 9.766 12.253 1.00 0.00 H new ATOM 0 HG LEU A 61 -6.893 11.457 11.096 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -8.977 10.762 9.978 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -7.537 10.139 9.138 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -8.505 9.057 10.168 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -8.941 11.117 12.420 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -8.469 9.426 12.707 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -7.477 10.750 13.362 1.00 0.00 H new ATOM 933 N ARG A 62 -5.079 11.479 8.793 1.00 0.00 N ATOM 934 CA ARG A 62 -4.664 12.826 8.416 1.00 0.00 C ATOM 935 C ARG A 62 -5.293 13.872 9.330 1.00 0.00 C ATOM 936 O ARG A 62 -6.488 13.819 9.620 1.00 0.00 O ATOM 937 CB ARG A 62 -5.041 13.106 6.961 1.00 0.00 C ATOM 938 CG ARG A 62 -4.389 12.155 5.972 1.00 0.00 C ATOM 939 CD ARG A 62 -2.872 12.249 6.027 1.00 0.00 C ATOM 940 NE ARG A 62 -2.397 13.596 5.720 1.00 0.00 N ATOM 941 CZ ARG A 62 -1.112 13.945 5.710 1.00 0.00 C ATOM 942 NH1 ARG A 62 -0.171 13.051 5.987 1.00 0.00 N ATOM 943 NH2 ARG A 62 -0.766 15.192 5.418 1.00 0.00 N ATOM 0 H ARG A 62 -5.740 11.046 8.148 1.00 0.00 H new ATOM 0 HA ARG A 62 -3.581 12.888 8.524 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -6.124 13.041 6.856 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -4.757 14.128 6.711 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -4.700 11.133 6.189 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -4.733 12.385 4.964 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -2.526 11.960 7.019 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -2.439 11.542 5.320 1.00 0.00 H new ATOM 0 HE ARG A 62 -3.090 14.311 5.500 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -0.430 12.090 6.209 1.00 0.00 H new ATOM 0 HH12 ARG A 62 0.811 13.325 5.978 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -1.484 15.883 5.201 1.00 0.00 H new ATOM 0 HH22 ARG A 62 0.218 15.460 5.410 1.00 0.00 H new ATOM 957 N THR A 63 -4.481 14.823 9.781 1.00 0.00 N ATOM 958 CA THR A 63 -4.959 15.882 10.663 1.00 0.00 C ATOM 959 C THR A 63 -5.933 16.806 9.939 1.00 0.00 C ATOM 960 O THR A 63 -5.655 17.275 8.836 1.00 0.00 O ATOM 961 CB THR A 63 -3.792 16.720 11.218 1.00 0.00 C ATOM 962 OG1 THR A 63 -3.065 17.323 10.139 1.00 0.00 O ATOM 963 CG2 THR A 63 -2.853 15.859 12.048 1.00 0.00 C ATOM 0 H THR A 63 -3.489 14.882 9.550 1.00 0.00 H new ATOM 0 HA THR A 63 -5.473 15.394 11.491 1.00 0.00 H new ATOM 0 HB THR A 63 -4.206 17.499 11.858 1.00 0.00 H new ATOM 0 HG1 THR A 63 -3.644 17.389 9.351 1.00 0.00 H new ATOM 0 HG21 THR A 63 -2.037 16.473 12.429 1.00 0.00 H new ATOM 0 HG22 THR A 63 -3.401 15.425 12.884 1.00 0.00 H new ATOM 0 HG23 THR A 63 -2.447 15.061 11.427 1.00 0.00 H new ATOM 971 N ASP A 64 -7.076 17.060 10.574 1.00 0.00 N ATOM 972 CA ASP A 64 -8.108 17.932 10.012 1.00 0.00 C ATOM 973 C ASP A 64 -8.363 17.620 8.536 1.00 0.00 C ATOM 974 O ASP A 64 -7.866 16.626 8.005 1.00 0.00 O ATOM 975 CB ASP A 64 -7.714 19.402 10.178 1.00 0.00 C ATOM 976 CG ASP A 64 -6.447 19.759 9.427 1.00 0.00 C ATOM 977 OD1 ASP A 64 -6.430 19.605 8.188 1.00 0.00 O ATOM 978 OD2 ASP A 64 -5.472 20.192 10.078 1.00 0.00 O ATOM 0 H ASP A 64 -7.313 16.670 11.487 1.00 0.00 H new ATOM 0 HA ASP A 64 -9.032 17.746 10.560 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.530 20.034 9.826 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -7.576 19.619 11.237 1.00 0.00 H new ATOM 983 N LEU A 65 -9.142 18.477 7.881 1.00 0.00 N ATOM 984 CA LEU A 65 -9.464 18.299 6.470 1.00 0.00 C ATOM 985 C LEU A 65 -8.320 18.794 5.590 1.00 0.00 C ATOM 986 O LEU A 65 -7.944 18.143 4.617 1.00 0.00 O ATOM 987 CB LEU A 65 -10.760 19.042 6.129 1.00 0.00 C ATOM 988 CG LEU A 65 -11.324 18.791 4.726 1.00 0.00 C ATOM 989 CD1 LEU A 65 -12.695 19.430 4.583 1.00 0.00 C ATOM 990 CD2 LEU A 65 -10.380 19.327 3.659 1.00 0.00 C ATOM 0 H LEU A 65 -9.562 19.303 8.307 1.00 0.00 H new ATOM 0 HA LEU A 65 -9.606 17.236 6.278 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.519 18.764 6.860 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.584 20.112 6.243 1.00 0.00 H new ATOM 0 HG LEU A 65 -11.423 17.714 4.588 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -13.081 19.242 3.581 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -13.375 19.002 5.320 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -12.614 20.505 4.745 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.801 19.137 2.672 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.247 20.400 3.797 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.415 18.828 3.743 1.00 0.00 H new ATOM 1002 N LYS A 66 -7.776 19.956 5.939 1.00 0.00 N ATOM 1003 CA LYS A 66 -6.678 20.551 5.183 1.00 0.00 C ATOM 1004 C LYS A 66 -5.495 19.592 5.098 1.00 0.00 C ATOM 1005 O LYS A 66 -5.131 18.949 6.084 1.00 0.00 O ATOM 1006 CB LYS A 66 -6.255 21.874 5.833 1.00 0.00 C ATOM 1007 CG LYS A 66 -5.206 22.653 5.047 1.00 0.00 C ATOM 1008 CD LYS A 66 -3.796 22.136 5.300 1.00 0.00 C ATOM 1009 CE LYS A 66 -2.760 22.975 4.569 1.00 0.00 C ATOM 1010 NZ LYS A 66 -2.975 22.962 3.095 1.00 0.00 N ATOM 0 H LYS A 66 -8.079 20.506 6.743 1.00 0.00 H new ATOM 0 HA LYS A 66 -7.021 20.750 4.168 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -7.137 22.501 5.959 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -5.866 21.667 6.830 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -5.430 22.587 3.982 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -5.259 23.707 5.319 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.588 22.149 6.370 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -3.723 21.099 4.974 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.802 24.002 4.933 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -1.763 22.597 4.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -2.145 23.369 2.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -3.113 21.983 2.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -3.818 23.525 2.862 1.00 0.00 H new ATOM 1024 N GLU A 67 -4.901 19.502 3.913 1.00 0.00 N ATOM 1025 CA GLU A 67 -3.757 18.625 3.693 1.00 0.00 C ATOM 1026 C GLU A 67 -2.890 19.144 2.550 1.00 0.00 C ATOM 1027 O GLU A 67 -3.396 19.490 1.483 1.00 0.00 O ATOM 1028 CB GLU A 67 -4.230 17.204 3.375 1.00 0.00 C ATOM 1029 CG GLU A 67 -5.054 16.572 4.485 1.00 0.00 C ATOM 1030 CD GLU A 67 -5.524 15.174 4.132 1.00 0.00 C ATOM 1031 OE1 GLU A 67 -4.664 14.309 3.863 1.00 0.00 O ATOM 1032 OE2 GLU A 67 -6.751 14.945 4.125 1.00 0.00 O ATOM 0 H GLU A 67 -5.194 20.027 3.089 1.00 0.00 H new ATOM 0 HA GLU A 67 -3.162 18.610 4.606 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.823 17.224 2.461 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.361 16.577 3.178 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -4.460 16.533 5.398 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.919 17.201 4.695 1.00 0.00 H new ATOM 1039 N SER A 68 -1.583 19.200 2.781 1.00 0.00 N ATOM 1040 CA SER A 68 -0.650 19.681 1.770 1.00 0.00 C ATOM 1041 C SER A 68 -0.631 18.754 0.559 1.00 0.00 C ATOM 1042 O SER A 68 -0.907 19.177 -0.564 1.00 0.00 O ATOM 1043 CB SER A 68 0.757 19.799 2.358 1.00 0.00 C ATOM 1044 OG SER A 68 1.221 18.544 2.827 1.00 0.00 O ATOM 0 H SER A 68 -1.146 18.918 3.659 1.00 0.00 H new ATOM 0 HA SER A 68 -0.984 20.666 1.445 1.00 0.00 H new ATOM 0 HB2 SER A 68 1.440 20.183 1.600 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.753 20.518 3.177 1.00 0.00 H new ATOM 0 HG SER A 68 2.123 18.646 3.196 1.00 0.00 H new ATOM 1050 N ALA A 69 -0.306 17.487 0.795 1.00 0.00 N ATOM 1051 CA ALA A 69 -0.255 16.501 -0.278 1.00 0.00 C ATOM 1052 C ALA A 69 -1.617 15.850 -0.491 1.00 0.00 C ATOM 1053 O ALA A 69 -2.203 15.298 0.439 1.00 0.00 O ATOM 1054 CB ALA A 69 0.796 15.444 0.027 1.00 0.00 C ATOM 0 H ALA A 69 -0.074 17.120 1.718 1.00 0.00 H new ATOM 0 HA ALA A 69 0.020 17.016 -1.199 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.824 14.714 -0.782 1.00 0.00 H new ATOM 0 HB2 ALA A 69 1.773 15.919 0.121 1.00 0.00 H new ATOM 0 HB3 ALA A 69 0.546 14.941 0.961 1.00 0.00 H new ATOM 1060 N GLN A 70 -2.114 15.914 -1.722 1.00 0.00 N ATOM 1061 CA GLN A 70 -3.406 15.324 -2.053 1.00 0.00 C ATOM 1062 C GLN A 70 -3.270 13.835 -2.318 1.00 0.00 C ATOM 1063 O GLN A 70 -2.459 13.405 -3.139 1.00 0.00 O ATOM 1064 CB GLN A 70 -4.017 16.023 -3.269 1.00 0.00 C ATOM 1065 CG GLN A 70 -4.259 17.508 -3.059 1.00 0.00 C ATOM 1066 CD GLN A 70 -4.867 18.175 -4.277 1.00 0.00 C ATOM 1067 OE1 GLN A 70 -5.955 17.810 -4.722 1.00 0.00 O ATOM 1068 NE2 GLN A 70 -4.165 19.162 -4.823 1.00 0.00 N ATOM 0 H GLN A 70 -1.643 16.367 -2.505 1.00 0.00 H new ATOM 0 HA GLN A 70 -4.069 15.461 -1.199 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -3.356 15.889 -4.125 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -4.962 15.541 -3.518 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -4.921 17.648 -2.204 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -3.315 17.996 -2.815 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -3.267 19.432 -4.421 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -4.524 19.650 -5.644 1.00 0.00 H new ATOM 1077 N ALA A 71 -4.077 13.055 -1.614 1.00 0.00 N ATOM 1078 CA ALA A 71 -4.065 11.610 -1.761 1.00 0.00 C ATOM 1079 C ALA A 71 -2.648 11.049 -1.583 1.00 0.00 C ATOM 1080 O ALA A 71 -1.933 11.441 -0.662 1.00 0.00 O ATOM 1081 CB ALA A 71 -4.660 11.219 -3.107 1.00 0.00 C ATOM 0 H ALA A 71 -4.751 13.403 -0.932 1.00 0.00 H new ATOM 0 HA ALA A 71 -4.682 11.172 -0.977 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -4.647 10.134 -3.209 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -5.688 11.577 -3.168 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -4.072 11.666 -3.908 1.00 0.00 H new ATOM 1087 N GLY A 72 -2.243 10.133 -2.465 1.00 0.00 N ATOM 1088 CA GLY A 72 -0.917 9.551 -2.372 1.00 0.00 C ATOM 1089 C GLY A 72 -0.572 8.713 -3.588 1.00 0.00 C ATOM 1090 O GLY A 72 -0.846 9.112 -4.719 1.00 0.00 O ATOM 0 H GLY A 72 -2.810 9.787 -3.239 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -0.180 10.346 -2.260 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.856 8.932 -1.477 1.00 0.00 H new ATOM 1094 N LYS A 73 0.026 7.547 -3.356 1.00 0.00 N ATOM 1095 CA LYS A 73 0.402 6.653 -4.445 1.00 0.00 C ATOM 1096 C LYS A 73 0.573 5.221 -3.944 1.00 0.00 C ATOM 1097 O LYS A 73 1.386 4.462 -4.469 1.00 0.00 O ATOM 1098 CB LYS A 73 1.701 7.128 -5.105 1.00 0.00 C ATOM 1099 CG LYS A 73 1.605 8.510 -5.729 1.00 0.00 C ATOM 1100 CD LYS A 73 2.905 8.910 -6.409 1.00 0.00 C ATOM 1101 CE LYS A 73 4.061 8.945 -5.422 1.00 0.00 C ATOM 1102 NZ LYS A 73 3.815 9.907 -4.312 1.00 0.00 N ATOM 0 H LYS A 73 0.260 7.201 -2.425 1.00 0.00 H new ATOM 0 HA LYS A 73 -0.401 6.670 -5.182 1.00 0.00 H new ATOM 0 HB2 LYS A 73 2.496 7.131 -4.359 1.00 0.00 H new ATOM 0 HB3 LYS A 73 1.989 6.412 -5.875 1.00 0.00 H new ATOM 0 HG2 LYS A 73 0.794 8.525 -6.457 1.00 0.00 H new ATOM 0 HG3 LYS A 73 1.357 9.241 -4.959 1.00 0.00 H new ATOM 0 HD2 LYS A 73 3.130 8.206 -7.210 1.00 0.00 H new ATOM 0 HD3 LYS A 73 2.789 9.891 -6.870 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.217 7.948 -5.010 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.977 9.221 -5.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 4.696 10.054 -3.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 3.492 10.814 -4.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 3.085 9.525 -3.677 1.00 0.00 H new ATOM 1116 N VAL A 74 -0.207 4.860 -2.930 1.00 0.00 N ATOM 1117 CA VAL A 74 -0.151 3.517 -2.363 1.00 0.00 C ATOM 1118 C VAL A 74 -1.294 2.660 -2.899 1.00 0.00 C ATOM 1119 O VAL A 74 -1.107 1.487 -3.228 1.00 0.00 O ATOM 1120 CB VAL A 74 -0.220 3.551 -0.823 1.00 0.00 C ATOM 1121 CG1 VAL A 74 -0.078 2.150 -0.244 1.00 0.00 C ATOM 1122 CG2 VAL A 74 0.851 4.476 -0.262 1.00 0.00 C ATOM 0 H VAL A 74 -0.885 5.478 -2.484 1.00 0.00 H new ATOM 0 HA VAL A 74 0.803 3.080 -2.660 1.00 0.00 H new ATOM 0 HB VAL A 74 -1.196 3.939 -0.533 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.130 2.199 0.844 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -0.884 1.518 -0.618 1.00 0.00 H new ATOM 0 HG13 VAL A 74 0.882 1.728 -0.543 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.788 4.488 0.826 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.835 4.119 -0.564 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.698 5.485 -0.645 1.00 0.00 H new ATOM 1132 N LEU A 75 -2.479 3.257 -2.981 1.00 0.00 N ATOM 1133 CA LEU A 75 -3.663 2.560 -3.475 1.00 0.00 C ATOM 1134 C LEU A 75 -3.433 1.981 -4.874 1.00 0.00 C ATOM 1135 O LEU A 75 -3.816 0.843 -5.144 1.00 0.00 O ATOM 1136 CB LEU A 75 -4.868 3.503 -3.490 1.00 0.00 C ATOM 1137 CG LEU A 75 -6.169 2.879 -3.994 1.00 0.00 C ATOM 1138 CD1 LEU A 75 -6.570 1.701 -3.119 1.00 0.00 C ATOM 1139 CD2 LEU A 75 -7.279 3.920 -4.030 1.00 0.00 C ATOM 0 H LEU A 75 -2.646 4.226 -2.711 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.864 1.731 -2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.030 3.878 -2.479 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.629 4.364 -4.115 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.006 2.513 -5.008 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.498 1.269 -3.493 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.784 0.946 -3.142 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -6.715 2.042 -2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.198 3.459 -4.391 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -7.441 4.314 -3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.994 4.733 -4.698 1.00 0.00 H new ATOM 1151 N PRO A 76 -2.811 2.751 -5.788 1.00 0.00 N ATOM 1152 CA PRO A 76 -2.549 2.289 -7.155 1.00 0.00 C ATOM 1153 C PRO A 76 -1.957 0.883 -7.190 1.00 0.00 C ATOM 1154 O PRO A 76 -2.317 0.069 -8.040 1.00 0.00 O ATOM 1155 CB PRO A 76 -1.544 3.310 -7.683 1.00 0.00 C ATOM 1156 CG PRO A 76 -1.859 4.560 -6.939 1.00 0.00 C ATOM 1157 CD PRO A 76 -2.317 4.128 -5.571 1.00 0.00 C ATOM 0 HA PRO A 76 -3.461 2.223 -7.748 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -0.518 2.988 -7.502 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -1.649 3.451 -8.759 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.982 5.204 -6.871 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -2.636 5.131 -7.448 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -1.501 4.152 -4.849 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -3.102 4.780 -5.187 1.00 0.00 H new ATOM 1165 N LEU A 77 -1.052 0.603 -6.259 1.00 0.00 N ATOM 1166 CA LEU A 77 -0.421 -0.709 -6.182 1.00 0.00 C ATOM 1167 C LEU A 77 -1.413 -1.753 -5.685 1.00 0.00 C ATOM 1168 O LEU A 77 -1.424 -2.888 -6.160 1.00 0.00 O ATOM 1169 CB LEU A 77 0.814 -0.660 -5.273 1.00 0.00 C ATOM 1170 CG LEU A 77 1.516 -2.003 -5.027 1.00 0.00 C ATOM 1171 CD1 LEU A 77 0.713 -2.870 -4.068 1.00 0.00 C ATOM 1172 CD2 LEU A 77 1.747 -2.740 -6.340 1.00 0.00 C ATOM 0 H LEU A 77 -0.740 1.265 -5.549 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.098 -0.994 -7.183 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.535 0.031 -5.709 1.00 0.00 H new ATOM 0 HB3 LEU A 77 0.517 -0.245 -4.310 1.00 0.00 H new ATOM 0 HG LEU A 77 2.484 -1.795 -4.571 1.00 0.00 H new ATOM 0 HD11 LEU A 77 1.232 -3.815 -3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 77 0.604 -2.353 -3.115 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.273 -3.063 -4.491 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.246 -3.689 -6.142 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.789 -2.928 -6.825 1.00 0.00 H new ATOM 0 HD23 LEU A 77 2.372 -2.131 -6.994 1.00 0.00 H new ATOM 1184 N VAL A 78 -2.250 -1.358 -4.733 1.00 0.00 N ATOM 1185 CA VAL A 78 -3.253 -2.259 -4.178 1.00 0.00 C ATOM 1186 C VAL A 78 -4.125 -2.838 -5.287 1.00 0.00 C ATOM 1187 O VAL A 78 -4.533 -3.998 -5.230 1.00 0.00 O ATOM 1188 CB VAL A 78 -4.148 -1.538 -3.150 1.00 0.00 C ATOM 1189 CG1 VAL A 78 -5.168 -2.499 -2.555 1.00 0.00 C ATOM 1190 CG2 VAL A 78 -3.302 -0.902 -2.058 1.00 0.00 C ATOM 0 H VAL A 78 -2.254 -0.421 -4.330 1.00 0.00 H new ATOM 0 HA VAL A 78 -2.722 -3.066 -3.673 1.00 0.00 H new ATOM 0 HB VAL A 78 -4.691 -0.746 -3.665 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -5.789 -1.969 -1.832 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -5.798 -2.899 -3.350 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -4.649 -3.318 -2.056 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -3.951 -0.398 -1.342 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -2.728 -1.674 -1.546 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.620 -0.177 -2.502 1.00 0.00 H new ATOM 1200 N GLU A 79 -4.405 -2.019 -6.296 1.00 0.00 N ATOM 1201 CA GLU A 79 -5.224 -2.443 -7.424 1.00 0.00 C ATOM 1202 C GLU A 79 -4.508 -3.510 -8.245 1.00 0.00 C ATOM 1203 O GLU A 79 -5.122 -4.472 -8.706 1.00 0.00 O ATOM 1204 CB GLU A 79 -5.570 -1.245 -8.311 1.00 0.00 C ATOM 1205 CG GLU A 79 -6.433 -1.601 -9.510 1.00 0.00 C ATOM 1206 CD GLU A 79 -7.790 -2.153 -9.115 1.00 0.00 C ATOM 1207 OE1 GLU A 79 -8.071 -2.235 -7.901 1.00 0.00 O ATOM 1208 OE2 GLU A 79 -8.576 -2.501 -10.024 1.00 0.00 O ATOM 0 H GLU A 79 -4.075 -1.056 -6.355 1.00 0.00 H new ATOM 0 HA GLU A 79 -6.146 -2.871 -7.030 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -6.089 -0.498 -7.711 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.646 -0.786 -8.663 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -6.573 -0.714 -10.128 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.911 -2.336 -10.122 1.00 0.00 H new ATOM 1215 N ALA A 80 -3.203 -3.330 -8.425 1.00 0.00 N ATOM 1216 CA ALA A 80 -2.398 -4.275 -9.188 1.00 0.00 C ATOM 1217 C ALA A 80 -2.458 -5.668 -8.575 1.00 0.00 C ATOM 1218 O ALA A 80 -2.598 -6.665 -9.282 1.00 0.00 O ATOM 1219 CB ALA A 80 -0.954 -3.797 -9.260 1.00 0.00 C ATOM 0 H ALA A 80 -2.681 -2.537 -8.052 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.807 -4.330 -10.197 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -0.362 -4.511 -9.833 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -0.917 -2.823 -9.747 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -0.547 -3.715 -8.252 1.00 0.00 H new ATOM 1225 N LEU A 81 -2.338 -5.726 -7.254 1.00 0.00 N ATOM 1226 CA LEU A 81 -2.364 -6.991 -6.533 1.00 0.00 C ATOM 1227 C LEU A 81 -3.678 -7.731 -6.763 1.00 0.00 C ATOM 1228 O LEU A 81 -3.685 -8.926 -7.061 1.00 0.00 O ATOM 1229 CB LEU A 81 -2.165 -6.740 -5.039 1.00 0.00 C ATOM 1230 CG LEU A 81 -1.004 -5.806 -4.692 1.00 0.00 C ATOM 1231 CD1 LEU A 81 -0.823 -5.714 -3.185 1.00 0.00 C ATOM 1232 CD2 LEU A 81 0.278 -6.275 -5.363 1.00 0.00 C ATOM 0 H LEU A 81 -2.221 -4.906 -6.658 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.553 -7.614 -6.910 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -3.084 -6.321 -4.630 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -2.003 -7.697 -4.543 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.240 -4.810 -5.067 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.007 -5.045 -2.958 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.735 -5.326 -2.732 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.611 -6.705 -2.783 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.093 -5.598 -5.105 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.520 -7.281 -5.022 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.141 -6.282 -6.444 1.00 0.00 H new ATOM 1244 N ARG A 82 -4.790 -7.017 -6.618 1.00 0.00 N ATOM 1245 CA ARG A 82 -6.110 -7.608 -6.808 1.00 0.00 C ATOM 1246 C ARG A 82 -6.238 -8.225 -8.197 1.00 0.00 C ATOM 1247 O ARG A 82 -6.798 -9.309 -8.355 1.00 0.00 O ATOM 1248 CB ARG A 82 -7.200 -6.556 -6.599 1.00 0.00 C ATOM 1249 CG ARG A 82 -7.187 -5.934 -5.212 1.00 0.00 C ATOM 1250 CD ARG A 82 -8.305 -4.916 -5.048 1.00 0.00 C ATOM 1251 NE ARG A 82 -9.627 -5.523 -5.197 1.00 0.00 N ATOM 1252 CZ ARG A 82 -10.137 -6.413 -4.350 1.00 0.00 C ATOM 1253 NH1 ARG A 82 -9.461 -6.771 -3.265 1.00 0.00 N ATOM 1254 NH2 ARG A 82 -11.333 -6.938 -4.580 1.00 0.00 N ATOM 0 H ARG A 82 -4.803 -6.028 -6.369 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.234 -8.399 -6.068 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.080 -5.768 -7.343 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -8.174 -7.014 -6.774 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.292 -6.716 -4.460 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -6.225 -5.451 -5.037 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.229 -4.450 -4.066 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -8.185 -4.124 -5.787 1.00 0.00 H new ATOM 0 HE ARG A 82 -10.193 -5.247 -6.000 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.545 -6.363 -3.077 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -9.857 -7.454 -2.619 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -11.862 -6.659 -5.406 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -11.724 -7.620 -3.930 1.00 0.00 H new ATOM 1268 N ALA A 83 -5.713 -7.526 -9.198 1.00 0.00 N ATOM 1269 CA ALA A 83 -5.767 -8.006 -10.574 1.00 0.00 C ATOM 1270 C ALA A 83 -5.135 -9.388 -10.701 1.00 0.00 C ATOM 1271 O ALA A 83 -5.651 -10.254 -11.407 1.00 0.00 O ATOM 1272 CB ALA A 83 -5.075 -7.019 -11.502 1.00 0.00 C ATOM 0 H ALA A 83 -5.246 -6.627 -9.082 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.815 -8.089 -10.863 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.122 -7.388 -12.526 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.574 -6.052 -11.442 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -4.032 -6.909 -11.204 1.00 0.00 H new ATOM 1278 N ARG A 84 -4.014 -9.589 -10.013 1.00 0.00 N ATOM 1279 CA ARG A 84 -3.313 -10.868 -10.051 1.00 0.00 C ATOM 1280 C ARG A 84 -3.887 -11.859 -9.037 1.00 0.00 C ATOM 1281 O ARG A 84 -3.259 -12.872 -8.728 1.00 0.00 O ATOM 1282 CB ARG A 84 -1.821 -10.658 -9.783 1.00 0.00 C ATOM 1283 CG ARG A 84 -1.149 -9.730 -10.781 1.00 0.00 C ATOM 1284 CD ARG A 84 0.327 -9.550 -10.467 1.00 0.00 C ATOM 1285 NE ARG A 84 1.061 -10.812 -10.532 1.00 0.00 N ATOM 1286 CZ ARG A 84 1.252 -11.504 -11.655 1.00 0.00 C ATOM 1287 NH1 ARG A 84 0.806 -11.038 -12.815 1.00 0.00 N ATOM 1288 NH2 ARG A 84 1.903 -12.659 -11.619 1.00 0.00 N ATOM 0 H ARG A 84 -3.573 -8.883 -9.423 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.450 -11.290 -11.047 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -1.694 -10.252 -8.779 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.317 -11.624 -9.802 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.262 -10.133 -11.787 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -1.646 -8.760 -10.769 1.00 0.00 H new ATOM 0 HD2 ARG A 84 0.763 -8.841 -11.171 1.00 0.00 H new ATOM 0 HD3 ARG A 84 0.435 -9.119 -9.472 1.00 0.00 H new ATOM 0 HE ARG A 84 1.450 -11.186 -9.666 1.00 0.00 H new ATOM 0 HH11 ARG A 84 0.314 -10.145 -12.851 1.00 0.00 H new ATOM 0 HH12 ARG A 84 0.956 -11.573 -13.671 1.00 0.00 H new ATOM 0 HH21 ARG A 84 2.257 -13.017 -10.732 1.00 0.00 H new ATOM 0 HH22 ARG A 84 2.049 -13.189 -12.478 1.00 0.00 H new ATOM 1302 N GLY A 85 -5.079 -11.567 -8.519 1.00 0.00 N ATOM 1303 CA GLY A 85 -5.701 -12.449 -7.550 1.00 0.00 C ATOM 1304 C GLY A 85 -4.895 -12.554 -6.274 1.00 0.00 C ATOM 1305 O GLY A 85 -4.786 -13.627 -5.683 1.00 0.00 O ATOM 0 H GLY A 85 -5.622 -10.736 -8.754 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.701 -12.083 -7.317 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.818 -13.441 -7.987 1.00 0.00 H new ATOM 1309 N VAL A 86 -4.331 -11.429 -5.849 1.00 0.00 N ATOM 1310 CA VAL A 86 -3.529 -11.387 -4.632 1.00 0.00 C ATOM 1311 C VAL A 86 -4.333 -10.820 -3.465 1.00 0.00 C ATOM 1312 O VAL A 86 -5.015 -9.804 -3.607 1.00 0.00 O ATOM 1313 CB VAL A 86 -2.255 -10.542 -4.830 1.00 0.00 C ATOM 1314 CG1 VAL A 86 -1.398 -10.555 -3.572 1.00 0.00 C ATOM 1315 CG2 VAL A 86 -1.462 -11.045 -6.027 1.00 0.00 C ATOM 0 H VAL A 86 -4.414 -10.533 -6.330 1.00 0.00 H new ATOM 0 HA VAL A 86 -3.241 -12.413 -4.403 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.554 -9.512 -5.025 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -0.504 -9.952 -3.734 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -1.968 -10.142 -2.739 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -1.108 -11.580 -3.340 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -0.566 -10.437 -6.152 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.175 -12.084 -5.863 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -2.076 -10.975 -6.925 1.00 0.00 H new ATOM 1325 N GLU A 87 -4.243 -11.475 -2.312 1.00 0.00 N ATOM 1326 CA GLU A 87 -4.960 -11.028 -1.123 1.00 0.00 C ATOM 1327 C GLU A 87 -4.462 -9.657 -0.678 1.00 0.00 C ATOM 1328 O GLU A 87 -3.260 -9.442 -0.528 1.00 0.00 O ATOM 1329 CB GLU A 87 -4.784 -12.037 0.013 1.00 0.00 C ATOM 1330 CG GLU A 87 -5.263 -13.438 -0.334 1.00 0.00 C ATOM 1331 CD GLU A 87 -6.742 -13.487 -0.666 1.00 0.00 C ATOM 1332 OE1 GLU A 87 -7.155 -12.826 -1.642 1.00 0.00 O ATOM 1333 OE2 GLU A 87 -7.489 -14.188 0.049 1.00 0.00 O ATOM 0 H GLU A 87 -3.682 -12.316 -2.176 1.00 0.00 H new ATOM 0 HA GLU A 87 -6.018 -10.952 -1.372 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.730 -12.081 0.288 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -5.328 -11.683 0.889 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -4.692 -13.813 -1.183 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.061 -14.104 0.505 1.00 0.00 H new ATOM 1340 N VAL A 88 -5.393 -8.730 -0.471 1.00 0.00 N ATOM 1341 CA VAL A 88 -5.046 -7.377 -0.048 1.00 0.00 C ATOM 1342 C VAL A 88 -6.227 -6.695 0.638 1.00 0.00 C ATOM 1343 O VAL A 88 -7.380 -6.906 0.267 1.00 0.00 O ATOM 1344 CB VAL A 88 -4.591 -6.513 -1.244 1.00 0.00 C ATOM 1345 CG1 VAL A 88 -4.219 -5.108 -0.792 1.00 0.00 C ATOM 1346 CG2 VAL A 88 -3.424 -7.166 -1.966 1.00 0.00 C ATOM 0 H VAL A 88 -6.393 -8.891 -0.589 1.00 0.00 H new ATOM 0 HA VAL A 88 -4.222 -7.468 0.659 1.00 0.00 H new ATOM 0 HB VAL A 88 -5.427 -6.436 -1.939 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -3.902 -4.521 -1.654 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.084 -4.634 -0.328 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -3.404 -5.162 -0.070 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -3.119 -6.541 -2.805 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -2.588 -7.281 -1.276 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -3.727 -8.146 -2.335 1.00 0.00 H new ATOM 1356 N GLU A 89 -5.926 -5.877 1.641 1.00 0.00 N ATOM 1357 CA GLU A 89 -6.963 -5.164 2.379 1.00 0.00 C ATOM 1358 C GLU A 89 -6.364 -4.080 3.272 1.00 0.00 C ATOM 1359 O GLU A 89 -5.413 -4.326 4.015 1.00 0.00 O ATOM 1360 CB GLU A 89 -7.779 -6.143 3.225 1.00 0.00 C ATOM 1361 CG GLU A 89 -6.945 -6.915 4.235 1.00 0.00 C ATOM 1362 CD GLU A 89 -7.776 -7.869 5.070 1.00 0.00 C ATOM 1363 OE1 GLU A 89 -8.694 -7.397 5.773 1.00 0.00 O ATOM 1364 OE2 GLU A 89 -7.508 -9.088 5.020 1.00 0.00 O ATOM 0 H GLU A 89 -4.975 -5.691 1.961 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.618 -4.683 1.653 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.557 -5.592 3.754 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.281 -6.850 2.565 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.173 -7.476 3.709 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -6.435 -6.211 4.893 1.00 0.00 H new ATOM 1371 N LEU A 90 -6.930 -2.881 3.189 1.00 0.00 N ATOM 1372 CA LEU A 90 -6.460 -1.752 3.984 1.00 0.00 C ATOM 1373 C LEU A 90 -7.040 -1.787 5.396 1.00 0.00 C ATOM 1374 O LEU A 90 -8.196 -2.157 5.598 1.00 0.00 O ATOM 1375 CB LEU A 90 -6.808 -0.427 3.292 1.00 0.00 C ATOM 1376 CG LEU A 90 -8.292 -0.209 2.972 1.00 0.00 C ATOM 1377 CD1 LEU A 90 -9.098 -0.003 4.247 1.00 0.00 C ATOM 1378 CD2 LEU A 90 -8.461 0.979 2.036 1.00 0.00 C ATOM 0 H LEU A 90 -7.717 -2.665 2.577 1.00 0.00 H new ATOM 0 HA LEU A 90 -5.376 -1.829 4.067 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -6.469 0.392 3.926 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -6.243 -0.365 2.362 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.670 -1.102 2.474 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -10.147 0.149 3.994 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -9.003 -0.882 4.884 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.722 0.872 4.778 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -9.519 1.122 1.817 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.064 1.876 2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.921 0.791 1.108 1.00 0.00 H new ATOM 1390 N TRP A 91 -6.225 -1.396 6.371 1.00 0.00 N ATOM 1391 CA TRP A 91 -6.651 -1.374 7.768 1.00 0.00 C ATOM 1392 C TRP A 91 -6.773 0.057 8.279 1.00 0.00 C ATOM 1393 O TRP A 91 -5.920 0.902 8.000 1.00 0.00 O ATOM 1394 CB TRP A 91 -5.670 -2.156 8.643 1.00 0.00 C ATOM 1395 CG TRP A 91 -5.741 -3.639 8.441 1.00 0.00 C ATOM 1396 CD1 TRP A 91 -5.867 -4.304 7.257 1.00 0.00 C ATOM 1397 CD2 TRP A 91 -5.691 -4.644 9.462 1.00 0.00 C ATOM 1398 NE1 TRP A 91 -5.897 -5.660 7.476 1.00 0.00 N ATOM 1399 CE2 TRP A 91 -5.790 -5.893 8.823 1.00 0.00 C ATOM 1400 CE3 TRP A 91 -5.570 -4.607 10.854 1.00 0.00 C ATOM 1401 CZ2 TRP A 91 -5.772 -7.094 9.527 1.00 0.00 C ATOM 1402 CZ3 TRP A 91 -5.553 -5.800 11.553 1.00 0.00 C ATOM 1403 CH2 TRP A 91 -5.654 -7.029 10.888 1.00 0.00 C ATOM 0 H TRP A 91 -5.264 -1.089 6.220 1.00 0.00 H new ATOM 0 HA TRP A 91 -7.631 -1.848 7.824 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -4.656 -1.816 8.431 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -5.870 -1.930 9.690 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -5.934 -3.833 6.287 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -5.985 -6.376 6.755 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -5.491 -3.664 11.374 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -5.848 -8.043 9.017 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -5.460 -5.784 12.629 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -5.638 -7.944 11.462 1.00 0.00 H new ATOM 1414 N ASP A 92 -7.835 0.321 9.031 1.00 0.00 N ATOM 1415 CA ASP A 92 -8.068 1.650 9.588 1.00 0.00 C ATOM 1416 C ASP A 92 -9.276 1.639 10.519 1.00 0.00 C ATOM 1417 O ASP A 92 -10.040 2.603 10.579 1.00 0.00 O ATOM 1418 CB ASP A 92 -8.276 2.666 8.463 1.00 0.00 C ATOM 1419 CG ASP A 92 -8.449 4.081 8.982 1.00 0.00 C ATOM 1420 OD1 ASP A 92 -7.519 4.586 9.646 1.00 0.00 O ATOM 1421 OD2 ASP A 92 -9.512 4.683 8.724 1.00 0.00 O ATOM 0 H ASP A 92 -8.549 -0.367 9.270 1.00 0.00 H new ATOM 0 HA ASP A 92 -7.191 1.940 10.166 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -7.423 2.633 7.786 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -9.155 2.385 7.882 1.00 0.00 H new ATOM 1426 N GLU A 93 -9.440 0.540 11.248 1.00 0.00 N ATOM 1427 CA GLU A 93 -10.550 0.396 12.182 1.00 0.00 C ATOM 1428 C GLU A 93 -10.212 1.005 13.527 1.00 0.00 C ATOM 1429 O GLU A 93 -9.146 0.751 14.089 1.00 0.00 O ATOM 1430 CB GLU A 93 -10.923 -1.078 12.350 1.00 0.00 C ATOM 1431 CG GLU A 93 -9.789 -1.936 12.885 1.00 0.00 C ATOM 1432 CD GLU A 93 -10.184 -3.392 13.043 1.00 0.00 C ATOM 1433 OE1 GLU A 93 -10.553 -4.020 12.028 1.00 0.00 O ATOM 1434 OE2 GLU A 93 -10.123 -3.903 14.180 1.00 0.00 O ATOM 0 H GLU A 93 -8.816 -0.266 11.209 1.00 0.00 H new ATOM 0 HA GLU A 93 -11.406 0.931 11.769 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -11.775 -1.154 13.026 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -11.244 -1.475 11.387 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.936 -1.866 12.210 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -9.466 -1.544 13.849 1.00 0.00 H new ATOM 1441 N ARG A 94 -11.133 1.803 14.046 1.00 0.00 N ATOM 1442 CA ARG A 94 -10.934 2.440 15.331 1.00 0.00 C ATOM 1443 C ARG A 94 -12.268 2.809 15.972 1.00 0.00 C ATOM 1444 O ARG A 94 -12.389 3.849 16.619 1.00 0.00 O ATOM 1445 CB ARG A 94 -10.059 3.688 15.186 1.00 0.00 C ATOM 1446 CG ARG A 94 -8.683 3.405 14.606 1.00 0.00 C ATOM 1447 CD ARG A 94 -7.839 4.670 14.539 1.00 0.00 C ATOM 1448 NE ARG A 94 -7.606 5.247 15.861 1.00 0.00 N ATOM 1449 CZ ARG A 94 -6.884 4.660 16.813 1.00 0.00 C ATOM 1450 NH1 ARG A 94 -6.282 3.500 16.581 1.00 0.00 N ATOM 1451 NH2 ARG A 94 -6.751 5.242 17.997 1.00 0.00 N ATOM 0 H ARG A 94 -12.022 2.022 13.596 1.00 0.00 H new ATOM 0 HA ARG A 94 -10.425 1.727 15.980 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -10.571 4.408 14.548 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -9.942 4.155 16.164 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -8.175 2.659 15.217 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -8.787 2.982 13.607 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -6.882 4.442 14.070 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -8.337 5.404 13.906 1.00 0.00 H new ATOM 0 HE ARG A 94 -8.022 6.155 16.067 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -6.371 3.053 15.669 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -5.730 3.056 17.315 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -7.202 6.139 18.178 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -6.198 4.793 18.727 1.00 0.00 H new ATOM 1465 N PHE A 95 -13.263 1.945 15.792 1.00 0.00 N ATOM 1466 CA PHE A 95 -14.591 2.168 16.354 1.00 0.00 C ATOM 1467 C PHE A 95 -15.207 3.458 15.820 1.00 0.00 C ATOM 1468 O PHE A 95 -14.571 4.512 15.820 1.00 0.00 O ATOM 1469 CB PHE A 95 -14.524 2.217 17.882 1.00 0.00 C ATOM 1470 CG PHE A 95 -14.093 0.923 18.515 1.00 0.00 C ATOM 1471 CD1 PHE A 95 -12.885 0.332 18.176 1.00 0.00 C ATOM 1472 CD2 PHE A 95 -14.901 0.293 19.448 1.00 0.00 C ATOM 1473 CE1 PHE A 95 -12.493 -0.859 18.756 1.00 0.00 C ATOM 1474 CE2 PHE A 95 -14.513 -0.898 20.032 1.00 0.00 C ATOM 1475 CZ PHE A 95 -13.308 -1.475 19.686 1.00 0.00 C ATOM 0 H PHE A 95 -13.174 1.080 15.259 1.00 0.00 H new ATOM 0 HA PHE A 95 -15.224 1.334 16.051 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -13.832 3.004 18.180 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -15.505 2.491 18.270 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -12.243 0.809 17.450 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -15.846 0.738 19.722 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -11.550 -1.308 18.482 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -15.152 -1.377 20.759 1.00 0.00 H new ATOM 0 HZ PHE A 95 -13.003 -2.406 20.141 1.00 0.00 H new ATOM 1485 N THR A 96 -16.454 3.369 15.370 1.00 0.00 N ATOM 1486 CA THR A 96 -17.157 4.531 14.839 1.00 0.00 C ATOM 1487 C THR A 96 -17.456 5.539 15.943 1.00 0.00 C ATOM 1488 O THR A 96 -17.960 5.175 17.006 1.00 0.00 O ATOM 1489 CB THR A 96 -18.477 4.126 14.156 1.00 0.00 C ATOM 1490 OG1 THR A 96 -19.143 5.289 13.649 1.00 0.00 O ATOM 1491 CG2 THR A 96 -19.391 3.398 15.131 1.00 0.00 C ATOM 0 H THR A 96 -16.998 2.506 15.362 1.00 0.00 H new ATOM 0 HA THR A 96 -16.501 4.989 14.098 1.00 0.00 H new ATOM 0 HB THR A 96 -18.242 3.453 13.332 1.00 0.00 H new ATOM 0 HG1 THR A 96 -19.980 5.023 13.215 1.00 0.00 H new ATOM 0 HG21 THR A 96 -20.316 3.122 14.625 1.00 0.00 H new ATOM 0 HG22 THR A 96 -18.894 2.498 15.493 1.00 0.00 H new ATOM 0 HG23 THR A 96 -19.618 4.051 15.973 1.00 0.00 H new ATOM 1499 N THR A 97 -17.137 6.807 15.683 1.00 0.00 N ATOM 1500 CA THR A 97 -17.368 7.879 16.650 1.00 0.00 C ATOM 1501 C THR A 97 -16.939 7.469 18.057 1.00 0.00 C ATOM 1502 O THR A 97 -17.655 7.704 19.032 1.00 0.00 O ATOM 1503 CB THR A 97 -18.849 8.312 16.676 1.00 0.00 C ATOM 1504 OG1 THR A 97 -19.027 9.384 17.610 1.00 0.00 O ATOM 1505 CG2 THR A 97 -19.753 7.150 17.058 1.00 0.00 C ATOM 0 H THR A 97 -16.716 7.117 14.807 1.00 0.00 H new ATOM 0 HA THR A 97 -16.759 8.723 16.326 1.00 0.00 H new ATOM 0 HB THR A 97 -19.121 8.647 15.675 1.00 0.00 H new ATOM 0 HG1 THR A 97 -18.812 9.070 18.513 1.00 0.00 H new ATOM 0 HG21 THR A 97 -20.790 7.484 17.068 1.00 0.00 H new ATOM 0 HG22 THR A 97 -19.638 6.346 16.332 1.00 0.00 H new ATOM 0 HG23 THR A 97 -19.479 6.786 18.048 1.00 0.00 H new ATOM 1513 N LYS A 98 -15.767 6.851 18.157 1.00 0.00 N ATOM 1514 CA LYS A 98 -15.242 6.406 19.442 1.00 0.00 C ATOM 1515 C LYS A 98 -16.175 5.386 20.087 1.00 0.00 C ATOM 1516 O LYS A 98 -15.751 4.573 20.907 1.00 0.00 O ATOM 1517 CB LYS A 98 -15.048 7.601 20.379 1.00 0.00 C ATOM 1518 CG LYS A 98 -14.500 7.221 21.746 1.00 0.00 C ATOM 1519 CD LYS A 98 -14.329 8.440 22.637 1.00 0.00 C ATOM 1520 CE LYS A 98 -13.788 8.059 24.006 1.00 0.00 C ATOM 1521 NZ LYS A 98 -12.459 7.394 23.911 1.00 0.00 N ATOM 0 H LYS A 98 -15.162 6.647 17.362 1.00 0.00 H new ATOM 0 HA LYS A 98 -14.277 5.930 19.267 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -14.369 8.313 19.910 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -16.004 8.109 20.508 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -15.174 6.511 22.225 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -13.540 6.718 21.627 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -13.650 9.148 22.161 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -15.288 8.946 22.751 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -13.704 8.952 24.625 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -14.493 7.392 24.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -12.025 7.348 24.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -12.579 6.431 23.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.843 7.938 23.273 1.00 0.00 H new TER 1535 LYS A 98