USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 703 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -154:sc= 1.21 (180deg=0.435) USER MOD Single : A 2 SER OG : rot -47:sc= 1.22 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot -48:sc= 0.906 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -164:sc= 0.896 USER MOD Single : A 19 HIS : no HD1:sc= -0.223 X(o=-0.22,f=-0.0041) USER MOD Single : A 20 ASN : amide:sc= 0.154 X(o=0.15,f=-0.2) USER MOD Single : A 21 THR OG1 : rot 54:sc= 1.28 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -163:sc= 1.17 (180deg=0.825) USER MOD Single : A 31 SER OG : rot 180:sc= 0.0224 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -174:sc= 1.15 (180deg=1.05) USER MOD Single : A 55 SER OG : rot 98:sc= 1.05 USER MOD Single : A 59 TYR OH : rot -7:sc= 1.01 USER MOD Single : A 64 SER OG : rot -101:sc= 0.977 USER MOD Single : A 79 TYR OH : rot 133:sc= 1.88 USER MOD Single : A 81 SER OG : rot -86:sc= 0.0405 USER MOD Single : A 84 SER OG : rot 21:sc= 0.99 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.656 4.819 -19.094 1.00 10.00 N ATOM 2 CA MET A 1 -11.778 5.205 -17.967 1.00 10.00 C ATOM 3 C MET A 1 -12.542 6.079 -16.974 1.00 10.00 C ATOM 4 O MET A 1 -13.544 6.665 -17.371 1.00 10.00 O ATOM 5 CB MET A 1 -10.490 5.897 -18.460 1.00 10.00 C ATOM 6 CG MET A 1 -10.677 7.331 -18.982 1.00 10.00 C ATOM 7 SD MET A 1 -11.740 7.501 -20.441 1.00 10.00 S ATOM 8 CE MET A 1 -11.782 9.308 -20.571 1.00 10.00 C ATOM 0 H1 MET A 1 -12.320 3.925 -19.505 1.00 10.00 H new ATOM 0 H2 MET A 1 -13.630 4.698 -18.750 1.00 10.00 H new ATOM 0 H3 MET A 1 -12.636 5.563 -19.820 1.00 10.00 H new ATOM 0 HA MET A 1 -11.468 4.296 -17.451 1.00 10.00 H new ATOM 0 HB2 MET A 1 -9.771 5.916 -17.641 1.00 10.00 H new ATOM 0 HB3 MET A 1 -10.053 5.292 -19.254 1.00 10.00 H new ATOM 0 HG2 MET A 1 -11.093 7.940 -18.179 1.00 10.00 H new ATOM 0 HG3 MET A 1 -9.696 7.743 -19.219 1.00 10.00 H new ATOM 0 HE1 MET A 1 -12.397 9.597 -21.423 1.00 10.00 H new ATOM 0 HE2 MET A 1 -12.205 9.729 -19.659 1.00 10.00 H new ATOM 0 HE3 MET A 1 -10.769 9.686 -20.710 1.00 10.00 H new ATOM 18 N SER A 2 -12.085 6.182 -15.716 1.00 10.00 N ATOM 19 CA SER A 2 -12.742 7.039 -14.700 1.00 10.00 C ATOM 20 C SER A 2 -11.801 7.723 -13.682 1.00 10.00 C ATOM 21 O SER A 2 -12.287 8.297 -12.705 1.00 10.00 O ATOM 22 CB SER A 2 -13.835 6.232 -13.983 1.00 10.00 C ATOM 23 OG SER A 2 -14.553 7.073 -13.107 1.00 10.00 O ATOM 0 H SER A 2 -11.263 5.685 -15.372 1.00 10.00 H new ATOM 0 HA SER A 2 -13.171 7.873 -15.255 1.00 10.00 H new ATOM 0 HB2 SER A 2 -14.512 5.790 -14.714 1.00 10.00 H new ATOM 0 HB3 SER A 2 -13.386 5.410 -13.426 1.00 10.00 H new ATOM 0 HG SER A 2 -13.925 7.609 -12.580 1.00 10.00 H new ATOM 29 N LEU A 3 -10.481 7.670 -13.893 1.00 10.00 N ATOM 30 CA LEU A 3 -9.486 8.450 -13.148 1.00 10.00 C ATOM 31 C LEU A 3 -9.421 9.914 -13.647 1.00 10.00 C ATOM 32 O LEU A 3 -10.185 10.306 -14.533 1.00 10.00 O ATOM 33 CB LEU A 3 -8.113 7.744 -13.215 1.00 10.00 C ATOM 34 CG LEU A 3 -7.491 7.629 -14.626 1.00 10.00 C ATOM 35 CD1 LEU A 3 -5.969 7.654 -14.539 1.00 10.00 C ATOM 36 CD2 LEU A 3 -7.871 6.329 -15.335 1.00 10.00 C ATOM 0 H LEU A 3 -10.065 7.069 -14.604 1.00 10.00 H new ATOM 0 HA LEU A 3 -9.788 8.501 -12.102 1.00 10.00 H new ATOM 0 HB2 LEU A 3 -7.416 8.282 -12.573 1.00 10.00 H new ATOM 0 HB3 LEU A 3 -8.219 6.741 -12.801 1.00 10.00 H new ATOM 0 HG LEU A 3 -7.879 8.477 -15.191 1.00 10.00 H new ATOM 0 HD11 LEU A 3 -5.546 7.572 -15.540 1.00 10.00 H new ATOM 0 HD12 LEU A 3 -5.646 8.590 -14.084 1.00 10.00 H new ATOM 0 HD13 LEU A 3 -5.626 6.817 -13.931 1.00 10.00 H new ATOM 0 HD21 LEU A 3 -7.406 6.303 -16.321 1.00 10.00 H new ATOM 0 HD22 LEU A 3 -7.524 5.479 -14.747 1.00 10.00 H new ATOM 0 HD23 LEU A 3 -8.954 6.277 -15.443 1.00 10.00 H new ATOM 48 N ARG A 4 -8.484 10.718 -13.119 1.00 10.00 N ATOM 49 CA ARG A 4 -8.206 12.084 -13.587 1.00 10.00 C ATOM 50 C ARG A 4 -6.775 12.177 -14.143 1.00 10.00 C ATOM 51 O ARG A 4 -6.141 11.163 -14.435 1.00 10.00 O ATOM 52 CB ARG A 4 -8.508 13.086 -12.448 1.00 10.00 C ATOM 53 CG ARG A 4 -9.984 13.123 -12.014 1.00 10.00 C ATOM 54 CD ARG A 4 -10.908 13.612 -13.138 1.00 10.00 C ATOM 55 NE ARG A 4 -12.294 13.778 -12.664 1.00 10.00 N ATOM 56 CZ ARG A 4 -13.240 14.516 -13.234 1.00 10.00 C ATOM 57 NH1 ARG A 4 -13.022 15.202 -14.333 1.00 10.00 N ATOM 58 NH2 ARG A 4 -14.438 14.578 -12.703 1.00 10.00 N ATOM 0 H ARG A 4 -7.889 10.431 -12.342 1.00 10.00 H new ATOM 0 HA ARG A 4 -8.860 12.348 -14.418 1.00 10.00 H new ATOM 0 HB2 ARG A 4 -7.893 12.833 -11.584 1.00 10.00 H new ATOM 0 HB3 ARG A 4 -8.210 14.084 -12.769 1.00 10.00 H new ATOM 0 HG2 ARG A 4 -10.293 12.126 -11.700 1.00 10.00 H new ATOM 0 HG3 ARG A 4 -10.090 13.777 -11.149 1.00 10.00 H new ATOM 0 HD2 ARG A 4 -10.539 14.561 -13.527 1.00 10.00 H new ATOM 0 HD3 ARG A 4 -10.887 12.900 -13.963 1.00 10.00 H new ATOM 0 HE ARG A 4 -12.552 13.276 -11.814 1.00 10.00 H new ATOM 0 HH11 ARG A 4 -12.103 15.178 -14.775 1.00 10.00 H new ATOM 0 HH12 ARG A 4 -13.772 15.758 -14.744 1.00 10.00 H new ATOM 0 HH21 ARG A 4 -14.645 14.059 -11.850 1.00 10.00 H new ATOM 0 HH22 ARG A 4 -15.162 15.146 -13.143 1.00 10.00 H new ATOM 72 N LYS A 5 -6.296 13.401 -14.402 1.00 10.00 N ATOM 73 CA LYS A 5 -4.932 13.655 -14.879 1.00 10.00 C ATOM 74 C LYS A 5 -3.934 13.173 -13.826 1.00 10.00 C ATOM 75 O LYS A 5 -3.871 13.738 -12.737 1.00 10.00 O ATOM 76 CB LYS A 5 -4.731 15.156 -15.161 1.00 10.00 C ATOM 77 CG LYS A 5 -5.300 15.622 -16.512 1.00 10.00 C ATOM 78 CD LYS A 5 -4.432 15.159 -17.693 1.00 10.00 C ATOM 79 CE LYS A 5 -4.955 15.749 -19.007 1.00 10.00 C ATOM 80 NZ LYS A 5 -4.082 15.382 -20.147 1.00 10.00 N ATOM 0 H LYS A 5 -6.850 14.249 -14.285 1.00 10.00 H new ATOM 0 HA LYS A 5 -4.768 13.111 -15.809 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -5.201 15.731 -14.363 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -3.665 15.381 -15.131 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -6.312 15.235 -16.632 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -5.372 16.710 -16.519 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -3.398 15.467 -17.535 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -4.435 14.070 -17.750 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -5.968 15.390 -19.192 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -5.011 16.834 -18.924 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -4.462 15.796 -21.022 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -3.122 15.746 -19.980 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -4.049 14.347 -20.240 1.00 10.00 H new ATOM 94 N LEU A 6 -3.125 12.169 -14.175 1.00 10.00 N ATOM 95 CA LEU A 6 -2.170 11.601 -13.233 1.00 10.00 C ATOM 96 C LEU A 6 -1.006 12.584 -13.071 1.00 10.00 C ATOM 97 O LEU A 6 -0.156 12.742 -13.945 1.00 10.00 O ATOM 98 CB LEU A 6 -1.694 10.216 -13.707 1.00 10.00 C ATOM 99 CG LEU A 6 -2.780 9.124 -13.705 1.00 10.00 C ATOM 100 CD1 LEU A 6 -2.156 7.777 -14.079 1.00 10.00 C ATOM 101 CD2 LEU A 6 -3.481 8.971 -12.348 1.00 10.00 C ATOM 0 H LEU A 6 -3.115 11.738 -15.099 1.00 10.00 H new ATOM 0 HA LEU A 6 -2.643 11.450 -12.262 1.00 10.00 H new ATOM 0 HB2 LEU A 6 -1.296 10.310 -14.717 1.00 10.00 H new ATOM 0 HB3 LEU A 6 -0.872 9.892 -13.069 1.00 10.00 H new ATOM 0 HG LEU A 6 -3.529 9.433 -14.434 1.00 10.00 H new ATOM 0 HD11 LEU A 6 -2.926 7.006 -14.077 1.00 10.00 H new ATOM 0 HD12 LEU A 6 -1.713 7.845 -15.073 1.00 10.00 H new ATOM 0 HD13 LEU A 6 -1.384 7.520 -13.354 1.00 10.00 H new ATOM 0 HD21 LEU A 6 -4.234 8.186 -12.414 1.00 10.00 H new ATOM 0 HD22 LEU A 6 -2.747 8.706 -11.587 1.00 10.00 H new ATOM 0 HD23 LEU A 6 -3.960 9.912 -12.078 1.00 10.00 H new ATOM 113 N THR A 7 -1.018 13.245 -11.915 1.00 10.00 N ATOM 114 CA THR A 7 -0.068 14.247 -11.437 1.00 10.00 C ATOM 115 C THR A 7 -0.103 14.184 -9.902 1.00 10.00 C ATOM 116 O THR A 7 -0.781 13.322 -9.337 1.00 10.00 O ATOM 117 CB THR A 7 -0.432 15.625 -12.043 1.00 10.00 C ATOM 118 OG1 THR A 7 0.718 16.398 -12.312 1.00 10.00 O ATOM 119 CG2 THR A 7 -1.459 16.458 -11.269 1.00 10.00 C ATOM 0 H THR A 7 -1.756 13.079 -11.231 1.00 10.00 H new ATOM 0 HA THR A 7 0.958 14.063 -11.754 1.00 10.00 H new ATOM 0 HB THR A 7 -0.933 15.359 -12.974 1.00 10.00 H new ATOM 0 HG1 THR A 7 1.308 16.390 -11.530 1.00 10.00 H new ATOM 0 HG21 THR A 7 -1.631 17.399 -11.791 1.00 10.00 H new ATOM 0 HG22 THR A 7 -2.396 15.906 -11.198 1.00 10.00 H new ATOM 0 HG23 THR A 7 -1.081 16.662 -10.267 1.00 10.00 H new ATOM 127 N GLU A 8 0.610 15.075 -9.217 1.00 10.00 N ATOM 128 CA GLU A 8 0.832 15.095 -7.770 1.00 10.00 C ATOM 129 C GLU A 8 -0.424 14.804 -6.934 1.00 10.00 C ATOM 130 O GLU A 8 -0.330 14.045 -5.978 1.00 10.00 O ATOM 131 CB GLU A 8 1.453 16.440 -7.340 1.00 10.00 C ATOM 132 CG GLU A 8 2.693 16.887 -8.139 1.00 10.00 C ATOM 133 CD GLU A 8 2.327 17.777 -9.340 1.00 10.00 C ATOM 134 OE1 GLU A 8 1.769 17.225 -10.322 1.00 10.00 O ATOM 135 OE2 GLU A 8 2.575 18.999 -9.264 1.00 10.00 O ATOM 0 H GLU A 8 1.078 15.851 -9.685 1.00 10.00 H new ATOM 0 HA GLU A 8 1.524 14.278 -7.568 1.00 10.00 H new ATOM 0 HB2 GLU A 8 0.691 17.215 -7.423 1.00 10.00 H new ATOM 0 HB3 GLU A 8 1.726 16.373 -6.287 1.00 10.00 H new ATOM 0 HG2 GLU A 8 3.370 17.431 -7.480 1.00 10.00 H new ATOM 0 HG3 GLU A 8 3.231 16.007 -8.493 1.00 10.00 H new ATOM 142 N GLY A 9 -1.596 15.334 -7.310 1.00 10.00 N ATOM 143 CA GLY A 9 -2.859 15.081 -6.609 1.00 10.00 C ATOM 144 C GLY A 9 -3.320 13.620 -6.677 1.00 10.00 C ATOM 145 O GLY A 9 -3.480 12.975 -5.641 1.00 10.00 O ATOM 0 H GLY A 9 -1.693 15.954 -8.114 1.00 10.00 H new ATOM 0 HA2 GLY A 9 -2.748 15.369 -5.564 1.00 10.00 H new ATOM 0 HA3 GLY A 9 -3.635 15.718 -7.035 1.00 10.00 H new ATOM 149 N ASP A 10 -3.497 13.083 -7.891 1.00 10.00 N ATOM 150 CA ASP A 10 -3.887 11.684 -8.102 1.00 10.00 C ATOM 151 C ASP A 10 -2.821 10.725 -7.542 1.00 10.00 C ATOM 152 O ASP A 10 -3.158 9.736 -6.894 1.00 10.00 O ATOM 153 CB ASP A 10 -4.106 11.404 -9.604 1.00 10.00 C ATOM 154 CG ASP A 10 -5.441 11.915 -10.175 1.00 10.00 C ATOM 155 OD1 ASP A 10 -5.774 13.094 -9.923 1.00 10.00 O ATOM 156 OD2 ASP A 10 -6.109 11.124 -10.886 1.00 10.00 O ATOM 0 H ASP A 10 -3.373 13.608 -8.756 1.00 10.00 H new ATOM 0 HA ASP A 10 -4.822 11.513 -7.569 1.00 10.00 H new ATOM 0 HB2 ASP A 10 -3.290 11.860 -10.165 1.00 10.00 H new ATOM 0 HB3 ASP A 10 -4.045 10.328 -9.770 1.00 10.00 H new ATOM 161 N LEU A 11 -1.535 11.035 -7.754 1.00 10.00 N ATOM 162 CA LEU A 11 -0.408 10.266 -7.224 1.00 10.00 C ATOM 163 C LEU A 11 -0.330 10.272 -5.691 1.00 10.00 C ATOM 164 O LEU A 11 -0.135 9.206 -5.107 1.00 10.00 O ATOM 165 CB LEU A 11 0.902 10.750 -7.874 1.00 10.00 C ATOM 166 CG LEU A 11 1.191 10.188 -9.286 1.00 10.00 C ATOM 167 CD1 LEU A 11 0.023 10.090 -10.270 1.00 10.00 C ATOM 168 CD2 LEU A 11 2.317 10.987 -9.946 1.00 10.00 C ATOM 0 H LEU A 11 -1.247 11.841 -8.308 1.00 10.00 H new ATOM 0 HA LEU A 11 -0.571 9.221 -7.490 1.00 10.00 H new ATOM 0 HB2 LEU A 11 0.878 11.838 -7.933 1.00 10.00 H new ATOM 0 HB3 LEU A 11 1.732 10.485 -7.219 1.00 10.00 H new ATOM 0 HG LEU A 11 1.461 9.152 -9.082 1.00 10.00 H new ATOM 0 HD11 LEU A 11 0.377 9.679 -11.215 1.00 10.00 H new ATOM 0 HD12 LEU A 11 -0.747 9.438 -9.857 1.00 10.00 H new ATOM 0 HD13 LEU A 11 -0.394 11.083 -10.439 1.00 10.00 H new ATOM 0 HD21 LEU A 11 2.514 10.585 -10.940 1.00 10.00 H new ATOM 0 HD22 LEU A 11 2.020 12.033 -10.030 1.00 10.00 H new ATOM 0 HD23 LEU A 11 3.219 10.913 -9.339 1.00 10.00 H new ATOM 180 N ASP A 12 -0.513 11.423 -5.032 1.00 10.00 N ATOM 181 CA ASP A 12 -0.562 11.484 -3.573 1.00 10.00 C ATOM 182 C ASP A 12 -1.800 10.763 -3.022 1.00 10.00 C ATOM 183 O ASP A 12 -1.665 10.026 -2.053 1.00 10.00 O ATOM 184 CB ASP A 12 -0.493 12.933 -3.076 1.00 10.00 C ATOM 185 CG ASP A 12 -0.295 13.003 -1.558 1.00 10.00 C ATOM 186 OD1 ASP A 12 0.722 12.439 -1.093 1.00 10.00 O ATOM 187 OD2 ASP A 12 -1.142 13.637 -0.891 1.00 10.00 O ATOM 0 H ASP A 12 -0.630 12.326 -5.492 1.00 10.00 H new ATOM 0 HA ASP A 12 0.316 10.961 -3.193 1.00 10.00 H new ATOM 0 HB2 ASP A 12 0.327 13.450 -3.574 1.00 10.00 H new ATOM 0 HB3 ASP A 12 -1.411 13.455 -3.348 1.00 10.00 H new ATOM 192 N GLU A 13 -2.978 10.879 -3.657 1.00 10.00 N ATOM 193 CA GLU A 13 -4.144 10.107 -3.216 1.00 10.00 C ATOM 194 C GLU A 13 -3.961 8.591 -3.426 1.00 10.00 C ATOM 195 O GLU A 13 -4.342 7.804 -2.564 1.00 10.00 O ATOM 196 CB GLU A 13 -5.457 10.625 -3.831 1.00 10.00 C ATOM 197 CG GLU A 13 -6.701 10.041 -3.134 1.00 10.00 C ATOM 198 CD GLU A 13 -6.825 10.446 -1.647 1.00 10.00 C ATOM 199 OE1 GLU A 13 -6.160 9.813 -0.789 1.00 10.00 O ATOM 200 OE2 GLU A 13 -7.596 11.392 -1.385 1.00 10.00 O ATOM 0 H GLU A 13 -3.144 11.487 -4.459 1.00 10.00 H new ATOM 0 HA GLU A 13 -4.223 10.262 -2.140 1.00 10.00 H new ATOM 0 HB2 GLU A 13 -5.483 11.713 -3.763 1.00 10.00 H new ATOM 0 HB3 GLU A 13 -5.484 10.371 -4.891 1.00 10.00 H new ATOM 0 HG2 GLU A 13 -7.593 10.369 -3.667 1.00 10.00 H new ATOM 0 HG3 GLU A 13 -6.670 8.954 -3.204 1.00 10.00 H new ATOM 207 N ILE A 14 -3.317 8.153 -4.516 1.00 10.00 N ATOM 208 CA ILE A 14 -2.968 6.737 -4.702 1.00 10.00 C ATOM 209 C ILE A 14 -1.941 6.289 -3.644 1.00 10.00 C ATOM 210 O ILE A 14 -2.119 5.229 -3.038 1.00 10.00 O ATOM 211 CB ILE A 14 -2.488 6.498 -6.154 1.00 10.00 C ATOM 212 CG1 ILE A 14 -3.714 6.528 -7.103 1.00 10.00 C ATOM 213 CG2 ILE A 14 -1.733 5.164 -6.306 1.00 10.00 C ATOM 214 CD1 ILE A 14 -3.367 6.584 -8.598 1.00 10.00 C ATOM 0 H ILE A 14 -3.027 8.759 -5.283 1.00 10.00 H new ATOM 0 HA ILE A 14 -3.852 6.117 -4.552 1.00 10.00 H new ATOM 0 HB ILE A 14 -1.788 7.292 -6.415 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -4.321 5.642 -6.918 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -4.328 7.393 -6.854 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.416 5.041 -7.342 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -0.858 5.165 -5.657 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -2.390 4.340 -6.027 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -4.286 6.602 -9.184 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -2.788 7.484 -8.804 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -2.781 5.706 -8.869 1.00 10.00 H new ATOM 226 N SER A 15 -0.926 7.106 -3.338 1.00 10.00 N ATOM 227 CA SER A 15 0.008 6.845 -2.233 1.00 10.00 C ATOM 228 C SER A 15 -0.726 6.733 -0.888 1.00 10.00 C ATOM 229 O SER A 15 -0.533 5.760 -0.156 1.00 10.00 O ATOM 230 CB SER A 15 1.056 7.962 -2.195 1.00 10.00 C ATOM 231 OG SER A 15 1.952 7.784 -1.122 1.00 10.00 O ATOM 0 H SER A 15 -0.728 7.967 -3.848 1.00 10.00 H new ATOM 0 HA SER A 15 0.501 5.888 -2.404 1.00 10.00 H new ATOM 0 HB2 SER A 15 1.608 7.978 -3.135 1.00 10.00 H new ATOM 0 HB3 SER A 15 0.559 8.928 -2.101 1.00 10.00 H new ATOM 0 HG SER A 15 2.611 8.510 -1.122 1.00 10.00 H new ATOM 237 N SER A 16 -1.647 7.667 -0.622 1.00 10.00 N ATOM 238 CA SER A 16 -2.551 7.680 0.536 1.00 10.00 C ATOM 239 C SER A 16 -3.396 6.402 0.610 1.00 10.00 C ATOM 240 O SER A 16 -3.444 5.755 1.660 1.00 10.00 O ATOM 241 CB SER A 16 -3.433 8.939 0.419 1.00 10.00 C ATOM 242 OG SER A 16 -4.770 8.788 0.870 1.00 10.00 O ATOM 0 H SER A 16 -1.789 8.470 -1.235 1.00 10.00 H new ATOM 0 HA SER A 16 -1.975 7.709 1.461 1.00 10.00 H new ATOM 0 HB2 SER A 16 -2.965 9.744 0.985 1.00 10.00 H new ATOM 0 HB3 SER A 16 -3.452 9.253 -0.625 1.00 10.00 H new ATOM 0 HG SER A 16 -5.315 9.530 0.533 1.00 10.00 H new ATOM 248 N PHE A 17 -3.954 5.952 -0.520 1.00 10.00 N ATOM 249 CA PHE A 17 -4.816 4.773 -0.572 1.00 10.00 C ATOM 250 C PHE A 17 -4.046 3.480 -0.288 1.00 10.00 C ATOM 251 O PHE A 17 -4.535 2.644 0.480 1.00 10.00 O ATOM 252 CB PHE A 17 -5.505 4.718 -1.946 1.00 10.00 C ATOM 253 CG PHE A 17 -6.297 3.449 -2.206 1.00 10.00 C ATOM 254 CD1 PHE A 17 -7.334 3.071 -1.332 1.00 10.00 C ATOM 255 CD2 PHE A 17 -5.982 2.627 -3.306 1.00 10.00 C ATOM 256 CE1 PHE A 17 -8.038 1.874 -1.546 1.00 10.00 C ATOM 257 CE2 PHE A 17 -6.679 1.424 -3.512 1.00 10.00 C ATOM 258 CZ PHE A 17 -7.710 1.047 -2.635 1.00 10.00 C ATOM 0 H PHE A 17 -3.818 6.400 -1.426 1.00 10.00 H new ATOM 0 HA PHE A 17 -5.568 4.859 0.212 1.00 10.00 H new ATOM 0 HB2 PHE A 17 -6.175 5.573 -2.036 1.00 10.00 H new ATOM 0 HB3 PHE A 17 -4.747 4.823 -2.722 1.00 10.00 H new ATOM 0 HD1 PHE A 17 -7.589 3.703 -0.494 1.00 10.00 H new ATOM 0 HD2 PHE A 17 -5.203 2.922 -3.993 1.00 10.00 H new ATOM 0 HE1 PHE A 17 -8.833 1.588 -0.873 1.00 10.00 H new ATOM 0 HE2 PHE A 17 -6.422 0.788 -4.346 1.00 10.00 H new ATOM 0 HZ PHE A 17 -8.249 0.125 -2.797 1.00 10.00 H new ATOM 268 N LEU A 18 -2.845 3.301 -0.858 1.00 10.00 N ATOM 269 CA LEU A 18 -2.048 2.104 -0.580 1.00 10.00 C ATOM 270 C LEU A 18 -1.355 2.131 0.782 1.00 10.00 C ATOM 271 O LEU A 18 -1.345 1.102 1.448 1.00 10.00 O ATOM 272 CB LEU A 18 -1.100 1.750 -1.739 1.00 10.00 C ATOM 273 CG LEU A 18 -1.778 1.175 -3.010 1.00 10.00 C ATOM 274 CD1 LEU A 18 -2.976 0.250 -2.745 1.00 10.00 C ATOM 275 CD2 LEU A 18 -2.237 2.274 -3.960 1.00 10.00 C ATOM 0 H LEU A 18 -2.412 3.961 -1.504 1.00 10.00 H new ATOM 0 HA LEU A 18 -2.761 1.283 -0.509 1.00 10.00 H new ATOM 0 HB2 LEU A 18 -0.547 2.647 -2.019 1.00 10.00 H new ATOM 0 HB3 LEU A 18 -0.370 1.025 -1.379 1.00 10.00 H new ATOM 0 HG LEU A 18 -0.989 0.574 -3.462 1.00 10.00 H new ATOM 0 HD11 LEU A 18 -3.382 -0.101 -3.694 1.00 10.00 H new ATOM 0 HD12 LEU A 18 -2.652 -0.604 -2.151 1.00 10.00 H new ATOM 0 HD13 LEU A 18 -3.746 0.798 -2.202 1.00 10.00 H new ATOM 0 HD21 LEU A 18 -2.706 1.825 -4.836 1.00 10.00 H new ATOM 0 HD22 LEU A 18 -2.956 2.917 -3.452 1.00 10.00 H new ATOM 0 HD23 LEU A 18 -1.378 2.867 -4.272 1.00 10.00 H new ATOM 287 N HIS A 19 -0.865 3.285 1.250 1.00 10.00 N ATOM 288 CA HIS A 19 -0.364 3.407 2.622 1.00 10.00 C ATOM 289 C HIS A 19 -1.484 3.068 3.630 1.00 10.00 C ATOM 290 O HIS A 19 -1.279 2.230 4.510 1.00 10.00 O ATOM 291 CB HIS A 19 0.202 4.814 2.849 1.00 10.00 C ATOM 292 CG HIS A 19 0.761 5.075 4.231 1.00 10.00 C ATOM 293 ND1 HIS A 19 1.004 6.317 4.771 1.00 10.00 N ATOM 294 CD2 HIS A 19 1.134 4.152 5.176 1.00 10.00 C ATOM 295 CE1 HIS A 19 1.503 6.143 6.006 1.00 10.00 C ATOM 296 NE2 HIS A 19 1.598 4.838 6.300 1.00 10.00 N ATOM 0 H HIS A 19 -0.805 4.143 0.701 1.00 10.00 H new ATOM 0 HA HIS A 19 0.445 2.694 2.779 1.00 10.00 H new ATOM 0 HB2 HIS A 19 0.990 4.992 2.117 1.00 10.00 H new ATOM 0 HB3 HIS A 19 -0.586 5.540 2.652 1.00 10.00 H new ATOM 0 HD2 HIS A 19 1.078 3.079 5.068 1.00 10.00 H new ATOM 0 HE1 HIS A 19 1.789 6.944 6.671 1.00 10.00 H new ATOM 0 HE2 HIS A 19 1.940 4.429 7.169 1.00 10.00 H new ATOM 304 N ASN A 20 -2.687 3.632 3.452 1.00 10.00 N ATOM 305 CA ASN A 20 -3.840 3.269 4.244 1.00 10.00 C ATOM 306 C ASN A 20 -4.199 1.778 4.108 1.00 10.00 C ATOM 307 O ASN A 20 -4.486 1.139 5.112 1.00 10.00 O ATOM 308 CB ASN A 20 -5.035 4.178 3.906 1.00 10.00 C ATOM 309 CG ASN A 20 -6.180 3.875 4.857 1.00 10.00 C ATOM 310 OD1 ASN A 20 -6.218 4.360 5.976 1.00 10.00 O ATOM 311 ND2 ASN A 20 -7.073 2.992 4.461 1.00 10.00 N ATOM 0 H ASN A 20 -2.874 4.350 2.752 1.00 10.00 H new ATOM 0 HA ASN A 20 -3.581 3.424 5.291 1.00 10.00 H new ATOM 0 HB2 ASN A 20 -4.745 5.225 3.989 1.00 10.00 H new ATOM 0 HB3 ASN A 20 -5.350 4.016 2.875 1.00 10.00 H new ATOM 0 HD21 ASN A 20 -7.817 2.700 5.095 1.00 10.00 H new ATOM 0 HD22 ASN A 20 -7.021 2.600 3.521 1.00 10.00 H new ATOM 318 N THR A 21 -4.134 1.205 2.895 1.00 10.00 N ATOM 319 CA THR A 21 -4.465 -0.215 2.655 1.00 10.00 C ATOM 320 C THR A 21 -3.541 -1.148 3.440 1.00 10.00 C ATOM 321 O THR A 21 -4.028 -2.061 4.110 1.00 10.00 O ATOM 322 CB THR A 21 -4.401 -0.557 1.151 1.00 10.00 C ATOM 323 OG1 THR A 21 -5.337 0.209 0.421 1.00 10.00 O ATOM 324 CG2 THR A 21 -4.714 -2.023 0.848 1.00 10.00 C ATOM 0 H THR A 21 -3.852 1.708 2.054 1.00 10.00 H new ATOM 0 HA THR A 21 -5.486 -0.367 3.006 1.00 10.00 H new ATOM 0 HB THR A 21 -3.374 -0.337 0.858 1.00 10.00 H new ATOM 0 HG1 THR A 21 -5.205 1.160 0.617 1.00 10.00 H new ATOM 0 HG21 THR A 21 -4.651 -2.194 -0.227 1.00 10.00 H new ATOM 0 HG22 THR A 21 -3.994 -2.662 1.360 1.00 10.00 H new ATOM 0 HG23 THR A 21 -5.720 -2.259 1.195 1.00 10.00 H new ATOM 332 N ILE A 22 -2.220 -0.901 3.425 1.00 10.00 N ATOM 333 CA ILE A 22 -1.262 -1.679 4.225 1.00 10.00 C ATOM 334 C ILE A 22 -1.487 -1.449 5.726 1.00 10.00 C ATOM 335 O ILE A 22 -1.495 -2.417 6.487 1.00 10.00 O ATOM 336 CB ILE A 22 0.189 -1.365 3.804 1.00 10.00 C ATOM 337 CG1 ILE A 22 0.389 -1.734 2.327 1.00 10.00 C ATOM 338 CG2 ILE A 22 1.223 -2.130 4.655 1.00 10.00 C ATOM 339 CD1 ILE A 22 1.807 -1.529 1.805 1.00 10.00 C ATOM 0 H ILE A 22 -1.791 -0.165 2.864 1.00 10.00 H new ATOM 0 HA ILE A 22 -1.433 -2.738 4.032 1.00 10.00 H new ATOM 0 HB ILE A 22 0.348 -0.298 3.960 1.00 10.00 H new ATOM 0 HG12 ILE A 22 0.113 -2.779 2.187 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -0.296 -1.139 1.722 1.00 10.00 H new ATOM 0 HG21 ILE A 22 2.229 -1.876 4.321 1.00 10.00 H new ATOM 0 HG22 ILE A 22 1.108 -1.853 5.703 1.00 10.00 H new ATOM 0 HG23 ILE A 22 1.064 -3.203 4.544 1.00 10.00 H new ATOM 0 HD11 ILE A 22 1.853 -1.816 0.754 1.00 10.00 H new ATOM 0 HD12 ILE A 22 2.084 -0.480 1.907 1.00 10.00 H new ATOM 0 HD13 ILE A 22 2.499 -2.145 2.380 1.00 10.00 H new ATOM 351 N SER A 23 -1.716 -0.196 6.147 1.00 10.00 N ATOM 352 CA SER A 23 -2.021 0.122 7.546 1.00 10.00 C ATOM 353 C SER A 23 -3.266 -0.629 8.041 1.00 10.00 C ATOM 354 O SER A 23 -3.185 -1.349 9.038 1.00 10.00 O ATOM 355 CB SER A 23 -2.188 1.637 7.703 1.00 10.00 C ATOM 356 OG SER A 23 -2.481 1.962 9.047 1.00 10.00 O ATOM 0 H SER A 23 -1.695 0.617 5.532 1.00 10.00 H new ATOM 0 HA SER A 23 -1.188 -0.209 8.166 1.00 10.00 H new ATOM 0 HB2 SER A 23 -1.276 2.145 7.390 1.00 10.00 H new ATOM 0 HB3 SER A 23 -2.989 1.991 7.053 1.00 10.00 H new ATOM 0 HG SER A 23 -2.584 2.933 9.134 1.00 10.00 H new ATOM 362 N ASP A 24 -4.388 -0.561 7.305 1.00 10.00 N ATOM 363 CA ASP A 24 -5.574 -1.374 7.578 1.00 10.00 C ATOM 364 C ASP A 24 -5.333 -2.879 7.535 1.00 10.00 C ATOM 365 O ASP A 24 -5.880 -3.564 8.398 1.00 10.00 O ATOM 366 CB ASP A 24 -6.746 -1.013 6.641 1.00 10.00 C ATOM 367 CG ASP A 24 -7.512 0.233 7.080 1.00 10.00 C ATOM 368 OD1 ASP A 24 -7.991 0.172 8.239 1.00 10.00 O ATOM 369 OD2 ASP A 24 -7.730 1.149 6.262 1.00 10.00 O ATOM 0 H ASP A 24 -4.493 0.062 6.504 1.00 10.00 H new ATOM 0 HA ASP A 24 -5.836 -1.127 8.607 1.00 10.00 H new ATOM 0 HB2 ASP A 24 -6.361 -0.857 5.633 1.00 10.00 H new ATOM 0 HB3 ASP A 24 -7.435 -1.856 6.592 1.00 10.00 H new ATOM 374 N PHE A 25 -4.513 -3.403 6.615 1.00 10.00 N ATOM 375 CA PHE A 25 -4.227 -4.838 6.603 1.00 10.00 C ATOM 376 C PHE A 25 -3.468 -5.241 7.871 1.00 10.00 C ATOM 377 O PHE A 25 -3.883 -6.180 8.550 1.00 10.00 O ATOM 378 CB PHE A 25 -3.428 -5.210 5.343 1.00 10.00 C ATOM 379 CG PHE A 25 -3.185 -6.703 5.159 1.00 10.00 C ATOM 380 CD1 PHE A 25 -2.229 -7.380 5.946 1.00 10.00 C ATOM 381 CD2 PHE A 25 -3.898 -7.418 4.176 1.00 10.00 C ATOM 382 CE1 PHE A 25 -1.996 -8.754 5.762 1.00 10.00 C ATOM 383 CE2 PHE A 25 -3.673 -8.795 3.997 1.00 10.00 C ATOM 384 CZ PHE A 25 -2.727 -9.464 4.794 1.00 10.00 C ATOM 0 H PHE A 25 -4.046 -2.866 5.885 1.00 10.00 H new ATOM 0 HA PHE A 25 -5.170 -5.385 6.584 1.00 10.00 H new ATOM 0 HB2 PHE A 25 -3.958 -4.832 4.469 1.00 10.00 H new ATOM 0 HB3 PHE A 25 -2.465 -4.701 5.377 1.00 10.00 H new ATOM 0 HD1 PHE A 25 -1.672 -6.838 6.696 1.00 10.00 H new ATOM 0 HD2 PHE A 25 -4.620 -6.906 3.557 1.00 10.00 H new ATOM 0 HE1 PHE A 25 -1.257 -9.263 6.363 1.00 10.00 H new ATOM 0 HE2 PHE A 25 -4.227 -9.339 3.247 1.00 10.00 H new ATOM 0 HZ PHE A 25 -2.562 -10.523 4.662 1.00 10.00 H new ATOM 394 N ILE A 26 -2.432 -4.484 8.268 1.00 10.00 N ATOM 395 CA ILE A 26 -1.640 -4.780 9.454 1.00 10.00 C ATOM 396 C ILE A 26 -2.521 -4.678 10.700 1.00 10.00 C ATOM 397 O ILE A 26 -2.580 -5.640 11.465 1.00 10.00 O ATOM 398 CB ILE A 26 -0.395 -3.861 9.460 1.00 10.00 C ATOM 399 CG1 ILE A 26 0.588 -4.317 8.352 1.00 10.00 C ATOM 400 CG2 ILE A 26 0.284 -3.887 10.831 1.00 10.00 C ATOM 401 CD1 ILE A 26 1.822 -3.421 8.179 1.00 10.00 C ATOM 0 H ILE A 26 -2.126 -3.649 7.768 1.00 10.00 H new ATOM 0 HA ILE A 26 -1.266 -5.804 9.449 1.00 10.00 H new ATOM 0 HB ILE A 26 -0.705 -2.835 9.259 1.00 10.00 H new ATOM 0 HG12 ILE A 26 0.921 -5.331 8.575 1.00 10.00 H new ATOM 0 HG13 ILE A 26 0.051 -4.359 7.404 1.00 10.00 H new ATOM 0 HG21 ILE A 26 1.158 -3.235 10.817 1.00 10.00 H new ATOM 0 HG22 ILE A 26 -0.416 -3.539 11.590 1.00 10.00 H new ATOM 0 HG23 ILE A 26 0.595 -4.905 11.064 1.00 10.00 H new ATOM 0 HD11 ILE A 26 2.451 -3.818 7.382 1.00 10.00 H new ATOM 0 HD12 ILE A 26 1.505 -2.411 7.921 1.00 10.00 H new ATOM 0 HD13 ILE A 26 2.388 -3.397 9.110 1.00 10.00 H new ATOM 413 N LEU A 27 -3.285 -3.587 10.852 1.00 10.00 N ATOM 414 CA LEU A 27 -4.225 -3.375 11.968 1.00 10.00 C ATOM 415 C LEU A 27 -5.408 -4.366 11.995 1.00 10.00 C ATOM 416 O LEU A 27 -6.150 -4.389 12.978 1.00 10.00 O ATOM 417 CB LEU A 27 -4.720 -1.913 11.941 1.00 10.00 C ATOM 418 CG LEU A 27 -3.835 -0.913 12.715 1.00 10.00 C ATOM 419 CD1 LEU A 27 -2.346 -0.925 12.351 1.00 10.00 C ATOM 420 CD2 LEU A 27 -4.372 0.505 12.505 1.00 10.00 C ATOM 0 H LEU A 27 -3.268 -2.810 10.191 1.00 10.00 H new ATOM 0 HA LEU A 27 -3.677 -3.571 12.890 1.00 10.00 H new ATOM 0 HB2 LEU A 27 -4.789 -1.587 10.903 1.00 10.00 H new ATOM 0 HB3 LEU A 27 -5.728 -1.878 12.354 1.00 10.00 H new ATOM 0 HG LEU A 27 -3.891 -1.234 13.755 1.00 10.00 H new ATOM 0 HD11 LEU A 27 -1.818 -0.186 12.953 1.00 10.00 H new ATOM 0 HD12 LEU A 27 -1.932 -1.914 12.546 1.00 10.00 H new ATOM 0 HD13 LEU A 27 -2.228 -0.684 11.295 1.00 10.00 H new ATOM 0 HD21 LEU A 27 -3.749 1.214 13.050 1.00 10.00 H new ATOM 0 HD22 LEU A 27 -4.353 0.748 11.443 1.00 10.00 H new ATOM 0 HD23 LEU A 27 -5.396 0.564 12.872 1.00 10.00 H new ATOM 432 N LYS A 28 -5.593 -5.185 10.946 1.00 10.00 N ATOM 433 CA LYS A 28 -6.567 -6.290 10.902 1.00 10.00 C ATOM 434 C LYS A 28 -5.910 -7.678 10.803 1.00 10.00 C ATOM 435 O LYS A 28 -6.626 -8.675 10.694 1.00 10.00 O ATOM 436 CB LYS A 28 -7.612 -6.017 9.803 1.00 10.00 C ATOM 437 CG LYS A 28 -8.623 -4.958 10.282 1.00 10.00 C ATOM 438 CD LYS A 28 -9.573 -4.471 9.174 1.00 10.00 C ATOM 439 CE LYS A 28 -9.048 -3.236 8.427 1.00 10.00 C ATOM 440 NZ LYS A 28 -8.983 -2.044 9.309 1.00 10.00 N ATOM 0 H LYS A 28 -5.056 -5.095 10.083 1.00 10.00 H new ATOM 0 HA LYS A 28 -7.091 -6.322 11.857 1.00 10.00 H new ATOM 0 HB2 LYS A 28 -7.115 -5.672 8.896 1.00 10.00 H new ATOM 0 HB3 LYS A 28 -8.134 -6.940 9.549 1.00 10.00 H new ATOM 0 HG2 LYS A 28 -9.213 -5.374 11.099 1.00 10.00 H new ATOM 0 HG3 LYS A 28 -8.079 -4.104 10.685 1.00 10.00 H new ATOM 0 HD2 LYS A 28 -9.733 -5.279 8.460 1.00 10.00 H new ATOM 0 HD3 LYS A 28 -10.543 -4.237 9.613 1.00 10.00 H new ATOM 0 HE2 LYS A 28 -8.056 -3.447 8.028 1.00 10.00 H new ATOM 0 HE3 LYS A 28 -9.695 -3.024 7.576 1.00 10.00 H new ATOM 0 HZ1 LYS A 28 -8.907 -1.185 8.727 1.00 10.00 H new ATOM 0 HZ2 LYS A 28 -9.845 -1.994 9.889 1.00 10.00 H new ATOM 0 HZ3 LYS A 28 -8.151 -2.116 9.929 1.00 10.00 H new ATOM 454 N ARG A 29 -4.575 -7.765 10.935 1.00 10.00 N ATOM 455 CA ARG A 29 -3.837 -9.034 11.046 1.00 10.00 C ATOM 456 C ARG A 29 -3.043 -9.167 12.355 1.00 10.00 C ATOM 457 O ARG A 29 -2.937 -10.286 12.852 1.00 10.00 O ATOM 458 CB ARG A 29 -2.953 -9.247 9.798 1.00 10.00 C ATOM 459 CG ARG A 29 -3.114 -10.600 9.075 1.00 10.00 C ATOM 460 CD ARG A 29 -3.032 -11.879 9.932 1.00 10.00 C ATOM 461 NE ARG A 29 -4.330 -12.260 10.514 1.00 10.00 N ATOM 462 CZ ARG A 29 -5.334 -12.849 9.877 1.00 10.00 C ATOM 463 NH1 ARG A 29 -5.237 -13.225 8.620 1.00 10.00 N ATOM 464 NH2 ARG A 29 -6.468 -13.070 10.498 1.00 10.00 N ATOM 0 H ARG A 29 -3.971 -6.944 10.968 1.00 10.00 H new ATOM 0 HA ARG A 29 -4.575 -9.835 11.086 1.00 10.00 H new ATOM 0 HB2 ARG A 29 -3.167 -8.450 9.086 1.00 10.00 H new ATOM 0 HB3 ARG A 29 -1.910 -9.138 10.094 1.00 10.00 H new ATOM 0 HG2 ARG A 29 -4.078 -10.597 8.567 1.00 10.00 H new ATOM 0 HG3 ARG A 29 -2.347 -10.662 8.303 1.00 10.00 H new ATOM 0 HD2 ARG A 29 -2.660 -12.699 9.318 1.00 10.00 H new ATOM 0 HD3 ARG A 29 -2.310 -11.728 10.734 1.00 10.00 H new ATOM 0 HE ARG A 29 -4.471 -12.051 11.502 1.00 10.00 H new ATOM 0 HH11 ARG A 29 -4.371 -13.066 8.106 1.00 10.00 H new ATOM 0 HH12 ARG A 29 -6.028 -13.675 8.160 1.00 10.00 H new ATOM 0 HH21 ARG A 29 -6.579 -12.789 11.472 1.00 10.00 H new ATOM 0 HH22 ARG A 29 -7.239 -13.523 10.007 1.00 10.00 H new ATOM 478 N VAL A 30 -2.575 -8.056 12.945 1.00 10.00 N ATOM 479 CA VAL A 30 -1.907 -7.971 14.263 1.00 10.00 C ATOM 480 C VAL A 30 -2.519 -6.806 15.069 1.00 10.00 C ATOM 481 O VAL A 30 -3.001 -5.842 14.475 1.00 10.00 O ATOM 482 CB VAL A 30 -0.384 -7.756 14.087 1.00 10.00 C ATOM 483 CG1 VAL A 30 0.350 -7.849 15.430 1.00 10.00 C ATOM 484 CG2 VAL A 30 0.253 -8.780 13.137 1.00 10.00 C ATOM 0 H VAL A 30 -2.654 -7.143 12.497 1.00 10.00 H new ATOM 0 HA VAL A 30 -2.059 -8.906 14.802 1.00 10.00 H new ATOM 0 HB VAL A 30 -0.280 -6.758 13.660 1.00 10.00 H new ATOM 0 HG11 VAL A 30 1.417 -7.694 15.273 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -0.032 -7.085 16.107 1.00 10.00 H new ATOM 0 HG13 VAL A 30 0.187 -8.835 15.866 1.00 10.00 H new ATOM 0 HG21 VAL A 30 1.321 -8.581 13.051 1.00 10.00 H new ATOM 0 HG22 VAL A 30 0.101 -9.785 13.531 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -0.211 -8.702 12.154 1.00 10.00 H new ATOM 494 N SER A 31 -2.529 -6.860 16.410 1.00 10.00 N ATOM 495 CA SER A 31 -3.132 -5.790 17.206 1.00 10.00 C ATOM 496 C SER A 31 -2.221 -4.571 17.302 1.00 10.00 C ATOM 497 O SER A 31 -1.053 -4.691 17.658 1.00 10.00 O ATOM 498 CB SER A 31 -3.447 -6.272 18.625 1.00 10.00 C ATOM 499 OG SER A 31 -4.136 -5.265 19.345 1.00 10.00 O ATOM 0 H SER A 31 -2.131 -7.624 16.956 1.00 10.00 H new ATOM 0 HA SER A 31 -4.053 -5.508 16.695 1.00 10.00 H new ATOM 0 HB2 SER A 31 -4.053 -7.177 18.583 1.00 10.00 H new ATOM 0 HB3 SER A 31 -2.523 -6.531 19.142 1.00 10.00 H new ATOM 0 HG SER A 31 -4.333 -5.586 20.250 1.00 10.00 H new ATOM 505 N ALA A 32 -2.791 -3.369 17.141 1.00 10.00 N ATOM 506 CA ALA A 32 -2.146 -2.091 17.419 1.00 10.00 C ATOM 507 C ALA A 32 -1.500 -2.025 18.820 1.00 10.00 C ATOM 508 O ALA A 32 -0.562 -1.259 19.020 1.00 10.00 O ATOM 509 CB ALA A 32 -3.169 -0.968 17.220 1.00 10.00 C ATOM 0 H ALA A 32 -3.747 -3.263 16.802 1.00 10.00 H new ATOM 0 HA ALA A 32 -1.320 -1.971 16.718 1.00 10.00 H new ATOM 0 HB1 ALA A 32 -2.698 -0.006 17.425 1.00 10.00 H new ATOM 0 HB2 ALA A 32 -3.530 -0.983 16.192 1.00 10.00 H new ATOM 0 HB3 ALA A 32 -4.007 -1.114 17.901 1.00 10.00 H new ATOM 515 N LYS A 33 -1.979 -2.828 19.790 1.00 10.00 N ATOM 516 CA LYS A 33 -1.351 -2.998 21.110 1.00 10.00 C ATOM 517 C LYS A 33 0.081 -3.569 21.061 1.00 10.00 C ATOM 518 O LYS A 33 0.832 -3.394 22.013 1.00 10.00 O ATOM 519 CB LYS A 33 -2.260 -3.899 21.974 1.00 10.00 C ATOM 520 CG LYS A 33 -2.105 -3.650 23.483 1.00 10.00 C ATOM 521 CD LYS A 33 -2.723 -2.310 23.927 1.00 10.00 C ATOM 522 CE LYS A 33 -4.071 -2.470 24.644 1.00 10.00 C ATOM 523 NZ LYS A 33 -5.109 -3.058 23.765 1.00 10.00 N ATOM 0 H LYS A 33 -2.826 -3.384 19.674 1.00 10.00 H new ATOM 0 HA LYS A 33 -1.248 -2.005 21.547 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -3.299 -3.733 21.690 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -2.034 -4.944 21.760 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -2.578 -4.464 24.033 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -1.047 -3.662 23.743 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -2.025 -1.798 24.590 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -2.858 -1.673 23.053 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -3.940 -3.103 25.522 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -4.408 -1.497 25.000 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -6.001 -3.147 24.292 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -5.255 -2.442 22.940 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -4.801 -3.998 23.445 1.00 10.00 H new ATOM 537 N GLU A 34 0.443 -4.249 19.972 1.00 10.00 N ATOM 538 CA GLU A 34 1.715 -4.958 19.773 1.00 10.00 C ATOM 539 C GLU A 34 2.640 -4.214 18.796 1.00 10.00 C ATOM 540 O GLU A 34 3.859 -4.398 18.815 1.00 10.00 O ATOM 541 CB GLU A 34 1.419 -6.339 19.165 1.00 10.00 C ATOM 542 CG GLU A 34 0.328 -7.150 19.881 1.00 10.00 C ATOM 543 CD GLU A 34 -0.012 -8.394 19.061 1.00 10.00 C ATOM 544 OE1 GLU A 34 0.787 -9.356 19.173 1.00 10.00 O ATOM 545 OE2 GLU A 34 -1.034 -8.361 18.331 1.00 10.00 O ATOM 0 H GLU A 34 -0.172 -4.326 19.162 1.00 10.00 H new ATOM 0 HA GLU A 34 2.209 -5.032 20.742 1.00 10.00 H new ATOM 0 HB2 GLU A 34 1.125 -6.204 18.124 1.00 10.00 H new ATOM 0 HB3 GLU A 34 2.340 -6.922 19.163 1.00 10.00 H new ATOM 0 HG2 GLU A 34 0.670 -7.440 20.874 1.00 10.00 H new ATOM 0 HG3 GLU A 34 -0.563 -6.538 20.017 1.00 10.00 H new ATOM 552 N ILE A 35 2.033 -3.383 17.941 1.00 10.00 N ATOM 553 CA ILE A 35 2.661 -2.530 16.936 1.00 10.00 C ATOM 554 C ILE A 35 3.390 -1.391 17.658 1.00 10.00 C ATOM 555 O ILE A 35 2.753 -0.491 18.205 1.00 10.00 O ATOM 556 CB ILE A 35 1.560 -1.992 15.983 1.00 10.00 C ATOM 557 CG1 ILE A 35 0.785 -3.104 15.231 1.00 10.00 C ATOM 558 CG2 ILE A 35 2.094 -0.966 14.972 1.00 10.00 C ATOM 559 CD1 ILE A 35 1.584 -3.873 14.184 1.00 10.00 C ATOM 0 H ILE A 35 1.018 -3.285 17.936 1.00 10.00 H new ATOM 0 HA ILE A 35 3.387 -3.083 16.340 1.00 10.00 H new ATOM 0 HB ILE A 35 0.858 -1.493 16.651 1.00 10.00 H new ATOM 0 HG12 ILE A 35 0.403 -3.814 15.964 1.00 10.00 H new ATOM 0 HG13 ILE A 35 -0.079 -2.653 14.743 1.00 10.00 H new ATOM 0 HG21 ILE A 35 1.279 -0.626 14.333 1.00 10.00 H new ATOM 0 HG22 ILE A 35 2.516 -0.114 15.506 1.00 10.00 H new ATOM 0 HG23 ILE A 35 2.867 -1.428 14.358 1.00 10.00 H new ATOM 0 HD11 ILE A 35 0.946 -4.625 13.720 1.00 10.00 H new ATOM 0 HD12 ILE A 35 1.944 -3.182 13.422 1.00 10.00 H new ATOM 0 HD13 ILE A 35 2.433 -4.362 14.661 1.00 10.00 H new ATOM 571 N VAL A 36 4.727 -1.427 17.662 1.00 10.00 N ATOM 572 CA VAL A 36 5.548 -0.297 18.112 1.00 10.00 C ATOM 573 C VAL A 36 5.491 0.801 17.051 1.00 10.00 C ATOM 574 O VAL A 36 5.187 1.942 17.387 1.00 10.00 O ATOM 575 CB VAL A 36 6.993 -0.751 18.410 1.00 10.00 C ATOM 576 CG1 VAL A 36 7.982 0.416 18.501 1.00 10.00 C ATOM 577 CG2 VAL A 36 7.023 -1.528 19.730 1.00 10.00 C ATOM 0 H VAL A 36 5.268 -2.235 17.355 1.00 10.00 H new ATOM 0 HA VAL A 36 5.155 0.103 19.047 1.00 10.00 H new ATOM 0 HB VAL A 36 7.304 -1.380 17.576 1.00 10.00 H new ATOM 0 HG11 VAL A 36 8.980 0.032 18.712 1.00 10.00 H new ATOM 0 HG12 VAL A 36 7.994 0.957 17.555 1.00 10.00 H new ATOM 0 HG13 VAL A 36 7.676 1.091 19.301 1.00 10.00 H new ATOM 0 HG21 VAL A 36 8.043 -1.849 19.940 1.00 10.00 H new ATOM 0 HG22 VAL A 36 6.670 -0.887 20.538 1.00 10.00 H new ATOM 0 HG23 VAL A 36 6.377 -2.402 19.652 1.00 10.00 H new ATOM 587 N ASP A 37 5.728 0.447 15.780 1.00 10.00 N ATOM 588 CA ASP A 37 5.488 1.335 14.637 1.00 10.00 C ATOM 589 C ASP A 37 5.439 0.577 13.292 1.00 10.00 C ATOM 590 O ASP A 37 5.707 -0.627 13.222 1.00 10.00 O ATOM 591 CB ASP A 37 6.542 2.468 14.595 1.00 10.00 C ATOM 592 CG ASP A 37 5.917 3.816 14.208 1.00 10.00 C ATOM 593 OD1 ASP A 37 4.946 3.788 13.415 1.00 10.00 O ATOM 594 OD2 ASP A 37 6.398 4.849 14.724 1.00 10.00 O ATOM 0 H ASP A 37 6.093 -0.468 15.516 1.00 10.00 H new ATOM 0 HA ASP A 37 4.502 1.777 14.781 1.00 10.00 H new ATOM 0 HB2 ASP A 37 7.020 2.556 15.571 1.00 10.00 H new ATOM 0 HB3 ASP A 37 7.323 2.211 13.880 1.00 10.00 H new ATOM 599 N ILE A 38 5.130 1.308 12.216 1.00 10.00 N ATOM 600 CA ILE A 38 5.194 0.849 10.823 1.00 10.00 C ATOM 601 C ILE A 38 5.777 1.954 9.936 1.00 10.00 C ATOM 602 O ILE A 38 5.400 3.119 10.048 1.00 10.00 O ATOM 603 CB ILE A 38 3.808 0.400 10.285 1.00 10.00 C ATOM 604 CG1 ILE A 38 2.667 1.410 10.564 1.00 10.00 C ATOM 605 CG2 ILE A 38 3.461 -0.996 10.825 1.00 10.00 C ATOM 606 CD1 ILE A 38 1.327 1.049 9.904 1.00 10.00 C ATOM 0 H ILE A 38 4.816 2.275 12.294 1.00 10.00 H new ATOM 0 HA ILE A 38 5.846 -0.024 10.795 1.00 10.00 H new ATOM 0 HB ILE A 38 3.895 0.360 9.199 1.00 10.00 H new ATOM 0 HG12 ILE A 38 2.519 1.485 11.641 1.00 10.00 H new ATOM 0 HG13 ILE A 38 2.977 2.395 10.215 1.00 10.00 H new ATOM 0 HG21 ILE A 38 2.487 -1.302 10.442 1.00 10.00 H new ATOM 0 HG22 ILE A 38 4.219 -1.710 10.502 1.00 10.00 H new ATOM 0 HG23 ILE A 38 3.430 -0.967 11.914 1.00 10.00 H new ATOM 0 HD11 ILE A 38 0.584 1.808 10.150 1.00 10.00 H new ATOM 0 HD12 ILE A 38 1.455 1.004 8.822 1.00 10.00 H new ATOM 0 HD13 ILE A 38 0.990 0.079 10.271 1.00 10.00 H new ATOM 618 N ASP A 39 6.639 1.569 8.993 1.00 10.00 N ATOM 619 CA ASP A 39 7.256 2.477 8.025 1.00 10.00 C ATOM 620 C ASP A 39 6.974 1.982 6.611 1.00 10.00 C ATOM 621 O ASP A 39 7.366 0.880 6.229 1.00 10.00 O ATOM 622 CB ASP A 39 8.759 2.637 8.289 1.00 10.00 C ATOM 623 CG ASP A 39 9.028 3.629 9.423 1.00 10.00 C ATOM 624 OD1 ASP A 39 9.155 4.829 9.089 1.00 10.00 O ATOM 625 OD2 ASP A 39 9.114 3.188 10.589 1.00 10.00 O ATOM 0 H ASP A 39 6.933 0.599 8.879 1.00 10.00 H new ATOM 0 HA ASP A 39 6.816 3.468 8.136 1.00 10.00 H new ATOM 0 HB2 ASP A 39 9.190 1.668 8.542 1.00 10.00 H new ATOM 0 HB3 ASP A 39 9.255 2.979 7.380 1.00 10.00 H new ATOM 630 N ILE A 40 6.244 2.794 5.844 1.00 10.00 N ATOM 631 CA ILE A 40 5.742 2.450 4.515 1.00 10.00 C ATOM 632 C ILE A 40 6.078 3.587 3.559 1.00 10.00 C ATOM 633 O ILE A 40 5.751 4.745 3.806 1.00 10.00 O ATOM 634 CB ILE A 40 4.227 2.161 4.571 1.00 10.00 C ATOM 635 CG1 ILE A 40 3.980 0.822 5.292 1.00 10.00 C ATOM 636 CG2 ILE A 40 3.618 2.079 3.156 1.00 10.00 C ATOM 637 CD1 ILE A 40 2.586 0.683 5.883 1.00 10.00 C ATOM 0 H ILE A 40 5.979 3.734 6.139 1.00 10.00 H new ATOM 0 HA ILE A 40 6.220 1.540 4.151 1.00 10.00 H new ATOM 0 HB ILE A 40 3.752 2.980 5.112 1.00 10.00 H new ATOM 0 HG12 ILE A 40 4.148 0.007 4.588 1.00 10.00 H new ATOM 0 HG13 ILE A 40 4.714 0.711 6.090 1.00 10.00 H new ATOM 0 HG21 ILE A 40 2.550 1.874 3.231 1.00 10.00 H new ATOM 0 HG22 ILE A 40 3.771 3.026 2.639 1.00 10.00 H new ATOM 0 HG23 ILE A 40 4.102 1.278 2.597 1.00 10.00 H new ATOM 0 HD11 ILE A 40 2.493 -0.286 6.372 1.00 10.00 H new ATOM 0 HD12 ILE A 40 2.420 1.475 6.613 1.00 10.00 H new ATOM 0 HD13 ILE A 40 1.844 0.760 5.088 1.00 10.00 H new ATOM 649 N THR A 41 6.723 3.228 2.450 1.00 10.00 N ATOM 650 CA THR A 41 7.058 4.133 1.357 1.00 10.00 C ATOM 651 C THR A 41 6.383 3.634 0.087 1.00 10.00 C ATOM 652 O THR A 41 6.672 2.533 -0.382 1.00 10.00 O ATOM 653 CB THR A 41 8.582 4.214 1.171 1.00 10.00 C ATOM 654 OG1 THR A 41 9.189 4.605 2.380 1.00 10.00 O ATOM 655 CG2 THR A 41 8.981 5.252 0.123 1.00 10.00 C ATOM 0 H THR A 41 7.035 2.271 2.285 1.00 10.00 H new ATOM 0 HA THR A 41 6.701 5.137 1.587 1.00 10.00 H new ATOM 0 HB THR A 41 8.909 3.225 0.850 1.00 10.00 H new ATOM 0 HG1 THR A 41 10.160 4.654 2.258 1.00 10.00 H new ATOM 0 HG21 THR A 41 10.067 5.273 0.027 1.00 10.00 H new ATOM 0 HG22 THR A 41 8.536 4.989 -0.837 1.00 10.00 H new ATOM 0 HG23 THR A 41 8.625 6.235 0.431 1.00 10.00 H new ATOM 663 N VAL A 42 5.488 4.455 -0.467 1.00 10.00 N ATOM 664 CA VAL A 42 4.946 4.263 -1.814 1.00 10.00 C ATOM 665 C VAL A 42 5.734 5.210 -2.720 1.00 10.00 C ATOM 666 O VAL A 42 5.845 6.401 -2.424 1.00 10.00 O ATOM 667 CB VAL A 42 3.440 4.581 -1.900 1.00 10.00 C ATOM 668 CG1 VAL A 42 2.927 4.369 -3.335 1.00 10.00 C ATOM 669 CG2 VAL A 42 2.587 3.719 -0.956 1.00 10.00 C ATOM 0 H VAL A 42 5.117 5.277 0.009 1.00 10.00 H new ATOM 0 HA VAL A 42 5.046 3.219 -2.110 1.00 10.00 H new ATOM 0 HB VAL A 42 3.338 5.623 -1.598 1.00 10.00 H new ATOM 0 HG11 VAL A 42 1.862 4.598 -3.378 1.00 10.00 H new ATOM 0 HG12 VAL A 42 3.467 5.027 -4.016 1.00 10.00 H new ATOM 0 HG13 VAL A 42 3.087 3.332 -3.629 1.00 10.00 H new ATOM 0 HG21 VAL A 42 1.537 3.991 -1.064 1.00 10.00 H new ATOM 0 HG22 VAL A 42 2.717 2.666 -1.208 1.00 10.00 H new ATOM 0 HG23 VAL A 42 2.901 3.887 0.074 1.00 10.00 H new ATOM 679 N LEU A 43 6.259 4.690 -3.825 1.00 10.00 N ATOM 680 CA LEU A 43 6.895 5.474 -4.875 1.00 10.00 C ATOM 681 C LEU A 43 6.090 5.288 -6.152 1.00 10.00 C ATOM 682 O LEU A 43 5.644 4.186 -6.462 1.00 10.00 O ATOM 683 CB LEU A 43 8.354 5.032 -5.091 1.00 10.00 C ATOM 684 CG LEU A 43 9.246 5.117 -3.841 1.00 10.00 C ATOM 685 CD1 LEU A 43 10.623 4.519 -4.140 1.00 10.00 C ATOM 686 CD2 LEU A 43 9.429 6.558 -3.353 1.00 10.00 C ATOM 0 H LEU A 43 6.253 3.689 -4.019 1.00 10.00 H new ATOM 0 HA LEU A 43 6.915 6.525 -4.588 1.00 10.00 H new ATOM 0 HB2 LEU A 43 8.357 4.004 -5.453 1.00 10.00 H new ATOM 0 HB3 LEU A 43 8.793 5.648 -5.876 1.00 10.00 H new ATOM 0 HG LEU A 43 8.745 4.553 -3.054 1.00 10.00 H new ATOM 0 HD11 LEU A 43 11.249 4.583 -3.250 1.00 10.00 H new ATOM 0 HD12 LEU A 43 10.511 3.474 -4.430 1.00 10.00 H new ATOM 0 HD13 LEU A 43 11.092 5.073 -4.953 1.00 10.00 H new ATOM 0 HD21 LEU A 43 10.066 6.565 -2.469 1.00 10.00 H new ATOM 0 HD22 LEU A 43 9.894 7.152 -4.140 1.00 10.00 H new ATOM 0 HD23 LEU A 43 8.457 6.984 -3.103 1.00 10.00 H new ATOM 698 N VAL A 44 5.909 6.380 -6.884 1.00 10.00 N ATOM 699 CA VAL A 44 5.188 6.413 -8.152 1.00 10.00 C ATOM 700 C VAL A 44 5.929 7.336 -9.123 1.00 10.00 C ATOM 701 O VAL A 44 6.318 8.442 -8.760 1.00 10.00 O ATOM 702 CB VAL A 44 3.702 6.781 -7.939 1.00 10.00 C ATOM 703 CG1 VAL A 44 3.483 8.127 -7.231 1.00 10.00 C ATOM 704 CG2 VAL A 44 2.940 6.763 -9.269 1.00 10.00 C ATOM 0 H VAL A 44 6.269 7.293 -6.605 1.00 10.00 H new ATOM 0 HA VAL A 44 5.168 5.421 -8.604 1.00 10.00 H new ATOM 0 HB VAL A 44 3.308 6.014 -7.272 1.00 10.00 H new ATOM 0 HG11 VAL A 44 2.414 8.310 -7.120 1.00 10.00 H new ATOM 0 HG12 VAL A 44 3.950 8.101 -6.247 1.00 10.00 H new ATOM 0 HG13 VAL A 44 3.929 8.926 -7.823 1.00 10.00 H new ATOM 0 HG21 VAL A 44 1.897 7.025 -9.094 1.00 10.00 H new ATOM 0 HG22 VAL A 44 3.386 7.485 -9.953 1.00 10.00 H new ATOM 0 HG23 VAL A 44 2.995 5.766 -9.707 1.00 10.00 H new ATOM 714 N GLU A 45 6.143 6.859 -10.351 1.00 10.00 N ATOM 715 CA GLU A 45 6.925 7.537 -11.383 1.00 10.00 C ATOM 716 C GLU A 45 6.341 7.209 -12.766 1.00 10.00 C ATOM 717 O GLU A 45 5.632 6.214 -12.939 1.00 10.00 O ATOM 718 CB GLU A 45 8.399 7.090 -11.277 1.00 10.00 C ATOM 719 CG GLU A 45 9.379 8.046 -11.974 1.00 10.00 C ATOM 720 CD GLU A 45 10.795 7.461 -12.011 1.00 10.00 C ATOM 721 OE1 GLU A 45 11.473 7.514 -10.961 1.00 10.00 O ATOM 722 OE2 GLU A 45 11.177 6.968 -13.096 1.00 10.00 O ATOM 0 H GLU A 45 5.765 5.964 -10.662 1.00 10.00 H new ATOM 0 HA GLU A 45 6.881 8.617 -11.243 1.00 10.00 H new ATOM 0 HB2 GLU A 45 8.671 7.007 -10.225 1.00 10.00 H new ATOM 0 HB3 GLU A 45 8.502 6.096 -11.712 1.00 10.00 H new ATOM 0 HG2 GLU A 45 9.038 8.243 -12.990 1.00 10.00 H new ATOM 0 HG3 GLU A 45 9.392 9.002 -11.451 1.00 10.00 H new ATOM 729 N TYR A 46 6.645 8.036 -13.771 1.00 10.00 N ATOM 730 CA TYR A 46 6.205 7.800 -15.139 1.00 10.00 C ATOM 731 C TYR A 46 7.367 8.179 -16.065 1.00 10.00 C ATOM 732 O TYR A 46 7.669 9.358 -16.247 1.00 10.00 O ATOM 733 CB TYR A 46 4.916 8.600 -15.398 1.00 10.00 C ATOM 734 CG TYR A 46 4.084 8.102 -16.567 1.00 10.00 C ATOM 735 CD1 TYR A 46 4.637 7.909 -17.848 1.00 10.00 C ATOM 736 CD2 TYR A 46 2.734 7.769 -16.334 1.00 10.00 C ATOM 737 CE1 TYR A 46 3.863 7.336 -18.873 1.00 10.00 C ATOM 738 CE2 TYR A 46 1.952 7.204 -17.355 1.00 10.00 C ATOM 739 CZ TYR A 46 2.524 6.963 -18.624 1.00 10.00 C ATOM 740 OH TYR A 46 1.791 6.369 -19.603 1.00 10.00 O ATOM 0 H TYR A 46 7.201 8.883 -13.654 1.00 10.00 H new ATOM 0 HA TYR A 46 5.955 6.756 -15.327 1.00 10.00 H new ATOM 0 HB2 TYR A 46 4.303 8.576 -14.497 1.00 10.00 H new ATOM 0 HB3 TYR A 46 5.181 9.642 -15.576 1.00 10.00 H new ATOM 0 HD1 TYR A 46 5.658 8.202 -18.044 1.00 10.00 H new ATOM 0 HD2 TYR A 46 2.298 7.950 -15.363 1.00 10.00 H new ATOM 0 HE1 TYR A 46 4.293 7.181 -19.851 1.00 10.00 H new ATOM 0 HE2 TYR A 46 0.917 6.955 -17.171 1.00 10.00 H new ATOM 0 HH TYR A 46 0.891 6.176 -19.266 1.00 10.00 H new ATOM 750 N THR A 47 8.035 7.171 -16.628 1.00 10.00 N ATOM 751 CA THR A 47 9.212 7.325 -17.492 1.00 10.00 C ATOM 752 C THR A 47 8.987 6.481 -18.749 1.00 10.00 C ATOM 753 O THR A 47 9.425 5.338 -18.852 1.00 10.00 O ATOM 754 CB THR A 47 10.502 7.042 -16.696 1.00 10.00 C ATOM 755 OG1 THR A 47 11.624 7.269 -17.514 1.00 10.00 O ATOM 756 CG2 THR A 47 10.634 5.650 -16.067 1.00 10.00 C ATOM 0 H THR A 47 7.766 6.196 -16.493 1.00 10.00 H new ATOM 0 HA THR A 47 9.349 8.350 -17.838 1.00 10.00 H new ATOM 0 HB THR A 47 10.444 7.732 -15.854 1.00 10.00 H new ATOM 0 HG1 THR A 47 12.442 7.090 -17.005 1.00 10.00 H new ATOM 0 HG21 THR A 47 11.583 5.579 -15.536 1.00 10.00 H new ATOM 0 HG22 THR A 47 9.814 5.488 -15.367 1.00 10.00 H new ATOM 0 HG23 THR A 47 10.598 4.892 -16.850 1.00 10.00 H new ATOM 764 N ASP A 48 8.208 7.052 -19.682 1.00 10.00 N ATOM 765 CA ASP A 48 7.582 6.409 -20.858 1.00 10.00 C ATOM 766 C ASP A 48 6.567 5.304 -20.477 1.00 10.00 C ATOM 767 O ASP A 48 5.451 5.272 -20.993 1.00 10.00 O ATOM 768 CB ASP A 48 8.645 5.933 -21.862 1.00 10.00 C ATOM 769 CG ASP A 48 8.038 5.662 -23.240 1.00 10.00 C ATOM 770 OD1 ASP A 48 7.542 6.642 -23.841 1.00 10.00 O ATOM 771 OD2 ASP A 48 8.093 4.493 -23.680 1.00 10.00 O ATOM 0 H ASP A 48 7.981 8.045 -19.635 1.00 10.00 H new ATOM 0 HA ASP A 48 6.988 7.172 -21.361 1.00 10.00 H new ATOM 0 HB2 ASP A 48 9.427 6.688 -21.950 1.00 10.00 H new ATOM 0 HB3 ASP A 48 9.119 5.026 -21.488 1.00 10.00 H new ATOM 776 N GLU A 49 6.909 4.483 -19.482 1.00 10.00 N ATOM 777 CA GLU A 49 6.060 3.519 -18.792 1.00 10.00 C ATOM 778 C GLU A 49 5.690 4.053 -17.390 1.00 10.00 C ATOM 779 O GLU A 49 6.442 4.814 -16.774 1.00 10.00 O ATOM 780 CB GLU A 49 6.840 2.192 -18.715 1.00 10.00 C ATOM 781 CG GLU A 49 6.028 1.024 -18.142 1.00 10.00 C ATOM 782 CD GLU A 49 6.820 -0.287 -18.178 1.00 10.00 C ATOM 783 OE1 GLU A 49 7.815 -0.380 -17.420 1.00 10.00 O ATOM 784 OE2 GLU A 49 6.401 -1.211 -18.906 1.00 10.00 O ATOM 0 H GLU A 49 7.860 4.477 -19.112 1.00 10.00 H new ATOM 0 HA GLU A 49 5.123 3.358 -19.326 1.00 10.00 H new ATOM 0 HB2 GLU A 49 7.184 1.926 -19.714 1.00 10.00 H new ATOM 0 HB3 GLU A 49 7.728 2.340 -18.101 1.00 10.00 H new ATOM 0 HG2 GLU A 49 5.742 1.249 -17.114 1.00 10.00 H new ATOM 0 HG3 GLU A 49 5.106 0.908 -18.711 1.00 10.00 H new ATOM 791 N LEU A 50 4.543 3.609 -16.862 1.00 10.00 N ATOM 792 CA LEU A 50 4.061 3.930 -15.516 1.00 10.00 C ATOM 793 C LEU A 50 4.682 2.950 -14.511 1.00 10.00 C ATOM 794 O LEU A 50 4.609 1.735 -14.701 1.00 10.00 O ATOM 795 CB LEU A 50 2.523 3.808 -15.521 1.00 10.00 C ATOM 796 CG LEU A 50 1.835 3.948 -14.145 1.00 10.00 C ATOM 797 CD1 LEU A 50 2.026 5.333 -13.522 1.00 10.00 C ATOM 798 CD2 LEU A 50 0.333 3.691 -14.295 1.00 10.00 C ATOM 0 H LEU A 50 3.907 2.999 -17.376 1.00 10.00 H new ATOM 0 HA LEU A 50 4.346 4.942 -15.227 1.00 10.00 H new ATOM 0 HB2 LEU A 50 2.119 4.570 -16.188 1.00 10.00 H new ATOM 0 HB3 LEU A 50 2.255 2.840 -15.944 1.00 10.00 H new ATOM 0 HG LEU A 50 2.301 3.215 -13.486 1.00 10.00 H new ATOM 0 HD11 LEU A 50 1.521 5.371 -12.557 1.00 10.00 H new ATOM 0 HD12 LEU A 50 3.090 5.526 -13.382 1.00 10.00 H new ATOM 0 HD13 LEU A 50 1.604 6.090 -14.183 1.00 10.00 H new ATOM 0 HD21 LEU A 50 -0.152 3.790 -13.324 1.00 10.00 H new ATOM 0 HD22 LEU A 50 -0.093 4.416 -14.989 1.00 10.00 H new ATOM 0 HD23 LEU A 50 0.173 2.684 -14.680 1.00 10.00 H new ATOM 810 N LYS A 51 5.277 3.471 -13.432 1.00 10.00 N ATOM 811 CA LYS A 51 6.028 2.688 -12.447 1.00 10.00 C ATOM 812 C LYS A 51 5.532 2.997 -11.033 1.00 10.00 C ATOM 813 O LYS A 51 5.328 4.157 -10.680 1.00 10.00 O ATOM 814 CB LYS A 51 7.534 3.010 -12.567 1.00 10.00 C ATOM 815 CG LYS A 51 8.187 2.799 -13.950 1.00 10.00 C ATOM 816 CD LYS A 51 8.618 1.364 -14.288 1.00 10.00 C ATOM 817 CE LYS A 51 7.475 0.348 -14.236 1.00 10.00 C ATOM 818 NZ LYS A 51 7.865 -0.937 -14.852 1.00 10.00 N ATOM 0 H LYS A 51 5.249 4.467 -13.216 1.00 10.00 H new ATOM 0 HA LYS A 51 5.873 1.627 -12.643 1.00 10.00 H new ATOM 0 HB2 LYS A 51 7.682 4.050 -12.277 1.00 10.00 H new ATOM 0 HB3 LYS A 51 8.070 2.398 -11.842 1.00 10.00 H new ATOM 0 HG2 LYS A 51 7.486 3.134 -14.714 1.00 10.00 H new ATOM 0 HG3 LYS A 51 9.063 3.444 -14.016 1.00 10.00 H new ATOM 0 HD2 LYS A 51 9.057 1.352 -15.285 1.00 10.00 H new ATOM 0 HD3 LYS A 51 9.398 1.055 -13.592 1.00 10.00 H new ATOM 0 HE2 LYS A 51 7.181 0.182 -13.200 1.00 10.00 H new ATOM 0 HE3 LYS A 51 6.604 0.751 -14.753 1.00 10.00 H new ATOM 0 HZ1 LYS A 51 7.039 -1.568 -14.892 1.00 10.00 H new ATOM 0 HZ2 LYS A 51 8.218 -0.767 -15.815 1.00 10.00 H new ATOM 0 HZ3 LYS A 51 8.613 -1.382 -14.283 1.00 10.00 H new ATOM 832 N VAL A 52 5.363 1.944 -10.227 1.00 10.00 N ATOM 833 CA VAL A 52 5.027 2.025 -8.803 1.00 10.00 C ATOM 834 C VAL A 52 5.891 1.033 -8.028 1.00 10.00 C ATOM 835 O VAL A 52 6.130 -0.078 -8.498 1.00 10.00 O ATOM 836 CB VAL A 52 3.522 1.742 -8.553 1.00 10.00 C ATOM 837 CG1 VAL A 52 3.151 1.642 -7.058 1.00 10.00 C ATOM 838 CG2 VAL A 52 2.650 2.851 -9.158 1.00 10.00 C ATOM 0 H VAL A 52 5.459 0.984 -10.558 1.00 10.00 H new ATOM 0 HA VAL A 52 5.227 3.039 -8.457 1.00 10.00 H new ATOM 0 HB VAL A 52 3.337 0.778 -9.027 1.00 10.00 H new ATOM 0 HG11 VAL A 52 2.084 1.443 -6.960 1.00 10.00 H new ATOM 0 HG12 VAL A 52 3.715 0.831 -6.597 1.00 10.00 H new ATOM 0 HG13 VAL A 52 3.392 2.581 -6.560 1.00 10.00 H new ATOM 0 HG21 VAL A 52 1.599 2.631 -8.970 1.00 10.00 H new ATOM 0 HG22 VAL A 52 2.908 3.807 -8.701 1.00 10.00 H new ATOM 0 HG23 VAL A 52 2.823 2.904 -10.233 1.00 10.00 H new ATOM 848 N ASP A 53 6.299 1.432 -6.824 1.00 10.00 N ATOM 849 CA ASP A 53 6.879 0.562 -5.805 1.00 10.00 C ATOM 850 C ASP A 53 6.123 0.833 -4.507 1.00 10.00 C ATOM 851 O ASP A 53 5.747 1.971 -4.215 1.00 10.00 O ATOM 852 CB ASP A 53 8.383 0.809 -5.590 1.00 10.00 C ATOM 853 CG ASP A 53 8.962 -0.155 -4.541 1.00 10.00 C ATOM 854 OD1 ASP A 53 9.313 -1.279 -4.951 1.00 10.00 O ATOM 855 OD2 ASP A 53 9.012 0.208 -3.337 1.00 10.00 O ATOM 0 H ASP A 53 6.232 2.404 -6.522 1.00 10.00 H new ATOM 0 HA ASP A 53 6.785 -0.474 -6.129 1.00 10.00 H new ATOM 0 HB2 ASP A 53 8.913 0.684 -6.534 1.00 10.00 H new ATOM 0 HB3 ASP A 53 8.543 1.838 -5.269 1.00 10.00 H new ATOM 860 N ILE A 54 5.924 -0.218 -3.721 1.00 10.00 N ATOM 861 CA ILE A 54 5.448 -0.113 -2.357 1.00 10.00 C ATOM 862 C ILE A 54 6.394 -0.961 -1.518 1.00 10.00 C ATOM 863 O ILE A 54 6.531 -2.167 -1.743 1.00 10.00 O ATOM 864 CB ILE A 54 3.981 -0.553 -2.200 1.00 10.00 C ATOM 865 CG1 ILE A 54 3.025 0.029 -3.262 1.00 10.00 C ATOM 866 CG2 ILE A 54 3.548 -0.111 -0.789 1.00 10.00 C ATOM 867 CD1 ILE A 54 1.659 -0.666 -3.272 1.00 10.00 C ATOM 0 H ILE A 54 6.092 -1.178 -4.022 1.00 10.00 H new ATOM 0 HA ILE A 54 5.451 0.927 -2.029 1.00 10.00 H new ATOM 0 HB ILE A 54 3.922 -1.632 -2.343 1.00 10.00 H new ATOM 0 HG12 ILE A 54 2.885 1.094 -3.075 1.00 10.00 H new ATOM 0 HG13 ILE A 54 3.483 -0.064 -4.247 1.00 10.00 H new ATOM 0 HG21 ILE A 54 2.510 -0.398 -0.620 1.00 10.00 H new ATOM 0 HG22 ILE A 54 4.183 -0.593 -0.046 1.00 10.00 H new ATOM 0 HG23 ILE A 54 3.644 0.971 -0.701 1.00 10.00 H new ATOM 0 HD11 ILE A 54 1.027 -0.216 -4.038 1.00 10.00 H new ATOM 0 HD12 ILE A 54 1.792 -1.726 -3.488 1.00 10.00 H new ATOM 0 HD13 ILE A 54 1.185 -0.551 -2.297 1.00 10.00 H new ATOM 879 N SER A 55 7.037 -0.307 -0.556 1.00 10.00 N ATOM 880 CA SER A 55 8.058 -0.898 0.295 1.00 10.00 C ATOM 881 C SER A 55 7.677 -0.603 1.745 1.00 10.00 C ATOM 882 O SER A 55 7.502 0.557 2.118 1.00 10.00 O ATOM 883 CB SER A 55 9.417 -0.295 -0.089 1.00 10.00 C ATOM 884 OG SER A 55 9.888 -0.828 -1.316 1.00 10.00 O ATOM 0 H SER A 55 6.856 0.674 -0.343 1.00 10.00 H new ATOM 0 HA SER A 55 8.130 -1.979 0.171 1.00 10.00 H new ATOM 0 HB2 SER A 55 9.327 0.788 -0.171 1.00 10.00 H new ATOM 0 HB3 SER A 55 10.142 -0.495 0.700 1.00 10.00 H new ATOM 0 HG SER A 55 9.674 -0.209 -2.045 1.00 10.00 H new ATOM 890 N ALA A 56 7.511 -1.656 2.554 1.00 10.00 N ATOM 891 CA ALA A 56 6.990 -1.571 3.918 1.00 10.00 C ATOM 892 C ALA A 56 7.866 -2.338 4.911 1.00 10.00 C ATOM 893 O ALA A 56 8.384 -3.408 4.592 1.00 10.00 O ATOM 894 CB ALA A 56 5.553 -2.113 3.941 1.00 10.00 C ATOM 0 H ALA A 56 7.740 -2.609 2.271 1.00 10.00 H new ATOM 0 HA ALA A 56 6.998 -0.525 4.226 1.00 10.00 H new ATOM 0 HB1 ALA A 56 5.158 -2.053 4.955 1.00 10.00 H new ATOM 0 HB2 ALA A 56 4.929 -1.519 3.273 1.00 10.00 H new ATOM 0 HB3 ALA A 56 5.551 -3.152 3.612 1.00 10.00 H new ATOM 900 N GLU A 57 7.947 -1.830 6.141 1.00 10.00 N ATOM 901 CA GLU A 57 8.596 -2.490 7.271 1.00 10.00 C ATOM 902 C GLU A 57 7.767 -2.298 8.553 1.00 10.00 C ATOM 903 O GLU A 57 7.070 -1.294 8.731 1.00 10.00 O ATOM 904 CB GLU A 57 10.056 -2.014 7.399 1.00 10.00 C ATOM 905 CG GLU A 57 10.910 -3.019 8.188 1.00 10.00 C ATOM 906 CD GLU A 57 12.411 -2.732 8.046 1.00 10.00 C ATOM 907 OE1 GLU A 57 12.913 -1.899 8.840 1.00 10.00 O ATOM 908 OE2 GLU A 57 13.042 -3.343 7.156 1.00 10.00 O ATOM 0 H GLU A 57 7.551 -0.922 6.384 1.00 10.00 H new ATOM 0 HA GLU A 57 8.639 -3.565 7.098 1.00 10.00 H new ATOM 0 HB2 GLU A 57 10.482 -1.874 6.406 1.00 10.00 H new ATOM 0 HB3 GLU A 57 10.081 -1.044 7.896 1.00 10.00 H new ATOM 0 HG2 GLU A 57 10.632 -2.983 9.241 1.00 10.00 H new ATOM 0 HG3 GLU A 57 10.699 -4.029 7.837 1.00 10.00 H new ATOM 915 N LEU A 58 7.817 -3.307 9.428 1.00 10.00 N ATOM 916 CA LEU A 58 6.957 -3.468 10.595 1.00 10.00 C ATOM 917 C LEU A 58 7.810 -3.622 11.856 1.00 10.00 C ATOM 918 O LEU A 58 8.664 -4.508 11.916 1.00 10.00 O ATOM 919 CB LEU A 58 6.081 -4.716 10.341 1.00 10.00 C ATOM 920 CG LEU A 58 5.316 -5.263 11.563 1.00 10.00 C ATOM 921 CD1 LEU A 58 4.310 -4.260 12.115 1.00 10.00 C ATOM 922 CD2 LEU A 58 4.560 -6.544 11.200 1.00 10.00 C ATOM 0 H LEU A 58 8.491 -4.067 9.334 1.00 10.00 H new ATOM 0 HA LEU A 58 6.322 -2.595 10.749 1.00 10.00 H new ATOM 0 HB2 LEU A 58 5.358 -4.476 9.562 1.00 10.00 H new ATOM 0 HB3 LEU A 58 6.718 -5.510 9.951 1.00 10.00 H new ATOM 0 HG LEU A 58 6.068 -5.464 12.326 1.00 10.00 H new ATOM 0 HD11 LEU A 58 3.798 -4.693 12.974 1.00 10.00 H new ATOM 0 HD12 LEU A 58 4.831 -3.354 12.423 1.00 10.00 H new ATOM 0 HD13 LEU A 58 3.580 -4.015 11.344 1.00 10.00 H new ATOM 0 HD21 LEU A 58 4.027 -6.913 12.077 1.00 10.00 H new ATOM 0 HD22 LEU A 58 3.846 -6.332 10.404 1.00 10.00 H new ATOM 0 HD23 LEU A 58 5.268 -7.300 10.861 1.00 10.00 H new ATOM 934 N TYR A 59 7.523 -2.813 12.880 1.00 10.00 N ATOM 935 CA TYR A 59 8.183 -2.888 14.177 1.00 10.00 C ATOM 936 C TYR A 59 7.178 -3.315 15.251 1.00 10.00 C ATOM 937 O TYR A 59 6.280 -2.566 15.638 1.00 10.00 O ATOM 938 CB TYR A 59 8.909 -1.563 14.471 1.00 10.00 C ATOM 939 CG TYR A 59 9.880 -1.129 13.378 1.00 10.00 C ATOM 940 CD1 TYR A 59 10.751 -2.064 12.774 1.00 10.00 C ATOM 941 CD2 TYR A 59 9.864 0.202 12.912 1.00 10.00 C ATOM 942 CE1 TYR A 59 11.553 -1.688 11.681 1.00 10.00 C ATOM 943 CE2 TYR A 59 10.691 0.589 11.841 1.00 10.00 C ATOM 944 CZ TYR A 59 11.517 -0.359 11.204 1.00 10.00 C ATOM 945 OH TYR A 59 12.268 0.010 10.132 1.00 10.00 O ATOM 0 H TYR A 59 6.816 -2.080 12.826 1.00 10.00 H new ATOM 0 HA TYR A 59 8.956 -3.656 14.174 1.00 10.00 H new ATOM 0 HB2 TYR A 59 8.166 -0.778 14.615 1.00 10.00 H new ATOM 0 HB3 TYR A 59 9.455 -1.661 15.409 1.00 10.00 H new ATOM 0 HD1 TYR A 59 10.801 -3.074 13.154 1.00 10.00 H new ATOM 0 HD2 TYR A 59 9.214 0.927 13.379 1.00 10.00 H new ATOM 0 HE1 TYR A 59 12.196 -2.415 11.207 1.00 10.00 H new ATOM 0 HE2 TYR A 59 10.693 1.616 11.506 1.00 10.00 H new ATOM 0 HH TYR A 59 12.861 -0.728 9.878 1.00 10.00 H new ATOM 955 N LEU A 60 7.336 -4.559 15.709 1.00 10.00 N ATOM 956 CA LEU A 60 6.595 -5.164 16.814 1.00 10.00 C ATOM 957 C LEU A 60 7.382 -5.066 18.116 1.00 10.00 C ATOM 958 O LEU A 60 8.613 -5.017 18.106 1.00 10.00 O ATOM 959 CB LEU A 60 6.296 -6.642 16.499 1.00 10.00 C ATOM 960 CG LEU A 60 5.156 -6.826 15.488 1.00 10.00 C ATOM 961 CD1 LEU A 60 5.055 -8.294 15.071 1.00 10.00 C ATOM 962 CD2 LEU A 60 3.813 -6.413 16.092 1.00 10.00 C ATOM 0 H LEU A 60 8.016 -5.200 15.300 1.00 10.00 H new ATOM 0 HA LEU A 60 5.658 -4.620 16.934 1.00 10.00 H new ATOM 0 HB2 LEU A 60 7.198 -7.113 16.109 1.00 10.00 H new ATOM 0 HB3 LEU A 60 6.040 -7.159 17.424 1.00 10.00 H new ATOM 0 HG LEU A 60 5.378 -6.197 14.626 1.00 10.00 H new ATOM 0 HD11 LEU A 60 4.243 -8.413 14.354 1.00 10.00 H new ATOM 0 HD12 LEU A 60 5.993 -8.607 14.613 1.00 10.00 H new ATOM 0 HD13 LEU A 60 4.857 -8.909 15.949 1.00 10.00 H new ATOM 0 HD21 LEU A 60 3.023 -6.554 15.354 1.00 10.00 H new ATOM 0 HD22 LEU A 60 3.604 -7.027 16.968 1.00 10.00 H new ATOM 0 HD23 LEU A 60 3.853 -5.364 16.385 1.00 10.00 H new ATOM 974 N ASP A 61 6.657 -5.029 19.235 1.00 10.00 N ATOM 975 CA ASP A 61 7.288 -5.155 20.549 1.00 10.00 C ATOM 976 C ASP A 61 7.998 -6.515 20.706 1.00 10.00 C ATOM 977 O ASP A 61 7.520 -7.541 20.216 1.00 10.00 O ATOM 978 CB ASP A 61 6.265 -4.919 21.671 1.00 10.00 C ATOM 979 CG ASP A 61 6.927 -4.839 23.055 1.00 10.00 C ATOM 980 OD1 ASP A 61 8.131 -4.492 23.110 1.00 10.00 O ATOM 981 OD2 ASP A 61 6.223 -5.140 24.042 1.00 10.00 O ATOM 0 H ASP A 61 5.644 -4.914 19.259 1.00 10.00 H new ATOM 0 HA ASP A 61 8.053 -4.383 20.628 1.00 10.00 H new ATOM 0 HB2 ASP A 61 5.722 -3.994 21.476 1.00 10.00 H new ATOM 0 HB3 ASP A 61 5.532 -5.726 21.667 1.00 10.00 H new ATOM 986 N GLU A 62 9.104 -6.531 21.461 1.00 10.00 N ATOM 987 CA GLU A 62 9.981 -7.687 21.752 1.00 10.00 C ATOM 988 C GLU A 62 9.295 -8.782 22.609 1.00 10.00 C ATOM 989 O GLU A 62 9.953 -9.595 23.258 1.00 10.00 O ATOM 990 CB GLU A 62 11.266 -7.163 22.431 1.00 10.00 C ATOM 991 CG GLU A 62 12.188 -6.355 21.500 1.00 10.00 C ATOM 992 CD GLU A 62 13.074 -7.259 20.631 1.00 10.00 C ATOM 993 OE1 GLU A 62 12.508 -7.992 19.789 1.00 10.00 O ATOM 994 OE2 GLU A 62 14.310 -7.216 20.826 1.00 10.00 O ATOM 0 H GLU A 62 9.438 -5.683 21.918 1.00 10.00 H new ATOM 0 HA GLU A 62 10.222 -8.178 20.809 1.00 10.00 H new ATOM 0 HB2 GLU A 62 10.986 -6.538 23.279 1.00 10.00 H new ATOM 0 HB3 GLU A 62 11.824 -8.010 22.830 1.00 10.00 H new ATOM 0 HG2 GLU A 62 11.582 -5.717 20.857 1.00 10.00 H new ATOM 0 HG3 GLU A 62 12.819 -5.698 22.098 1.00 10.00 H new ATOM 1001 N LEU A 63 7.959 -8.785 22.626 1.00 10.00 N ATOM 1002 CA LEU A 63 7.067 -9.613 23.432 1.00 10.00 C ATOM 1003 C LEU A 63 5.876 -10.161 22.613 1.00 10.00 C ATOM 1004 O LEU A 63 5.019 -10.830 23.188 1.00 10.00 O ATOM 1005 CB LEU A 63 6.581 -8.775 24.635 1.00 10.00 C ATOM 1006 CG LEU A 63 7.681 -8.338 25.627 1.00 10.00 C ATOM 1007 CD1 LEU A 63 7.083 -7.420 26.697 1.00 10.00 C ATOM 1008 CD2 LEU A 63 8.321 -9.534 26.344 1.00 10.00 C ATOM 0 H LEU A 63 7.432 -8.153 22.023 1.00 10.00 H new ATOM 0 HA LEU A 63 7.616 -10.487 23.783 1.00 10.00 H new ATOM 0 HB2 LEU A 63 6.082 -7.883 24.256 1.00 10.00 H new ATOM 0 HB3 LEU A 63 5.833 -9.352 25.179 1.00 10.00 H new ATOM 0 HG LEU A 63 8.444 -7.823 25.044 1.00 10.00 H new ATOM 0 HD11 LEU A 63 7.864 -7.116 27.393 1.00 10.00 H new ATOM 0 HD12 LEU A 63 6.656 -6.537 26.222 1.00 10.00 H new ATOM 0 HD13 LEU A 63 6.302 -7.953 27.239 1.00 10.00 H new ATOM 0 HD21 LEU A 63 9.089 -9.178 27.031 1.00 10.00 H new ATOM 0 HD22 LEU A 63 7.557 -10.075 26.902 1.00 10.00 H new ATOM 0 HD23 LEU A 63 8.773 -10.200 25.609 1.00 10.00 H new ATOM 1020 N SER A 64 5.838 -9.926 21.290 1.00 10.00 N ATOM 1021 CA SER A 64 4.821 -10.459 20.369 1.00 10.00 C ATOM 1022 C SER A 64 5.464 -11.087 19.131 1.00 10.00 C ATOM 1023 O SER A 64 6.439 -10.567 18.591 1.00 10.00 O ATOM 1024 CB SER A 64 3.853 -9.352 19.920 1.00 10.00 C ATOM 1025 OG SER A 64 2.655 -9.432 20.664 1.00 10.00 O ATOM 0 H SER A 64 6.532 -9.345 20.820 1.00 10.00 H new ATOM 0 HA SER A 64 4.270 -11.227 20.913 1.00 10.00 H new ATOM 0 HB2 SER A 64 4.314 -8.374 20.060 1.00 10.00 H new ATOM 0 HB3 SER A 64 3.638 -9.454 18.856 1.00 10.00 H new ATOM 0 HG SER A 64 1.963 -9.867 20.124 1.00 10.00 H new ATOM 1031 N ASP A 65 4.872 -12.180 18.643 1.00 10.00 N ATOM 1032 CA ASP A 65 5.371 -13.003 17.554 1.00 10.00 C ATOM 1033 C ASP A 65 4.227 -13.284 16.571 1.00 10.00 C ATOM 1034 O ASP A 65 3.452 -14.231 16.682 1.00 10.00 O ATOM 1035 CB ASP A 65 6.017 -14.284 18.126 1.00 10.00 C ATOM 1036 CG ASP A 65 5.114 -15.168 19.012 1.00 10.00 C ATOM 1037 OD1 ASP A 65 4.326 -14.612 19.816 1.00 10.00 O ATOM 1038 OD2 ASP A 65 5.281 -16.406 18.925 1.00 10.00 O ATOM 0 H ASP A 65 3.989 -12.526 19.019 1.00 10.00 H new ATOM 0 HA ASP A 65 6.151 -12.484 16.997 1.00 10.00 H new ATOM 0 HB2 ASP A 65 6.375 -14.888 17.292 1.00 10.00 H new ATOM 0 HB3 ASP A 65 6.891 -13.995 18.709 1.00 10.00 H new ATOM 1043 N ALA A 66 4.182 -12.424 15.558 1.00 10.00 N ATOM 1044 CA ALA A 66 3.308 -12.520 14.392 1.00 10.00 C ATOM 1045 C ALA A 66 3.864 -13.481 13.316 1.00 10.00 C ATOM 1046 O ALA A 66 4.930 -14.078 13.479 1.00 10.00 O ATOM 1047 CB ALA A 66 3.114 -11.098 13.851 1.00 10.00 C ATOM 0 H ALA A 66 4.783 -11.601 15.526 1.00 10.00 H new ATOM 0 HA ALA A 66 2.348 -12.949 14.681 1.00 10.00 H new ATOM 0 HB1 ALA A 66 2.464 -11.127 12.976 1.00 10.00 H new ATOM 0 HB2 ALA A 66 2.658 -10.475 14.621 1.00 10.00 H new ATOM 0 HB3 ALA A 66 4.081 -10.680 13.571 1.00 10.00 H new ATOM 1053 N ASP A 67 3.179 -13.589 12.172 1.00 10.00 N ATOM 1054 CA ASP A 67 3.466 -14.632 11.185 1.00 10.00 C ATOM 1055 C ASP A 67 4.603 -14.216 10.222 1.00 10.00 C ATOM 1056 O ASP A 67 4.667 -13.050 9.808 1.00 10.00 O ATOM 1057 CB ASP A 67 2.194 -14.898 10.362 1.00 10.00 C ATOM 1058 CG ASP A 67 0.973 -15.194 11.238 1.00 10.00 C ATOM 1059 OD1 ASP A 67 0.439 -14.215 11.809 1.00 10.00 O ATOM 1060 OD2 ASP A 67 0.602 -16.384 11.324 1.00 10.00 O ATOM 0 H ASP A 67 2.419 -12.963 11.908 1.00 10.00 H new ATOM 0 HA ASP A 67 3.785 -15.527 11.720 1.00 10.00 H new ATOM 0 HB2 ASP A 67 1.984 -14.031 9.735 1.00 10.00 H new ATOM 0 HB3 ASP A 67 2.369 -15.741 9.693 1.00 10.00 H new ATOM 1065 N PRO A 68 5.496 -15.159 9.832 1.00 10.00 N ATOM 1066 CA PRO A 68 6.735 -14.916 9.074 1.00 10.00 C ATOM 1067 C PRO A 68 6.484 -14.596 7.585 1.00 10.00 C ATOM 1068 O PRO A 68 6.939 -15.290 6.679 1.00 10.00 O ATOM 1069 CB PRO A 68 7.596 -16.167 9.305 1.00 10.00 C ATOM 1070 CG PRO A 68 6.554 -17.272 9.439 1.00 10.00 C ATOM 1071 CD PRO A 68 5.436 -16.570 10.206 1.00 10.00 C ATOM 0 HA PRO A 68 7.250 -14.020 9.422 1.00 10.00 H new ATOM 0 HB2 PRO A 68 8.275 -16.350 8.473 1.00 10.00 H new ATOM 0 HB3 PRO A 68 8.208 -16.077 10.202 1.00 10.00 H new ATOM 0 HG2 PRO A 68 6.217 -17.633 8.468 1.00 10.00 H new ATOM 0 HG3 PRO A 68 6.942 -18.134 9.982 1.00 10.00 H new ATOM 0 HD2 PRO A 68 4.465 -16.997 9.953 1.00 10.00 H new ATOM 0 HD3 PRO A 68 5.568 -16.692 11.281 1.00 10.00 H new ATOM 1079 N GLY A 69 5.714 -13.534 7.356 1.00 10.00 N ATOM 1080 CA GLY A 69 5.262 -13.046 6.053 1.00 10.00 C ATOM 1081 C GLY A 69 4.185 -11.952 6.121 1.00 10.00 C ATOM 1082 O GLY A 69 3.849 -11.382 5.089 1.00 10.00 O ATOM 0 H GLY A 69 5.368 -12.956 8.121 1.00 10.00 H new ATOM 0 HA2 GLY A 69 6.122 -12.658 5.506 1.00 10.00 H new ATOM 0 HA3 GLY A 69 4.872 -13.887 5.479 1.00 10.00 H new ATOM 1086 N ILE A 70 3.650 -11.629 7.310 1.00 10.00 N ATOM 1087 CA ILE A 70 2.493 -10.742 7.498 1.00 10.00 C ATOM 1088 C ILE A 70 2.638 -9.338 6.885 1.00 10.00 C ATOM 1089 O ILE A 70 1.645 -8.743 6.470 1.00 10.00 O ATOM 1090 CB ILE A 70 2.179 -10.703 9.009 1.00 10.00 C ATOM 1091 CG1 ILE A 70 0.710 -10.357 9.297 1.00 10.00 C ATOM 1092 CG2 ILE A 70 3.102 -9.764 9.813 1.00 10.00 C ATOM 1093 CD1 ILE A 70 0.268 -11.082 10.571 1.00 10.00 C ATOM 0 H ILE A 70 4.021 -11.988 8.190 1.00 10.00 H new ATOM 0 HA ILE A 70 1.654 -11.156 6.938 1.00 10.00 H new ATOM 0 HB ILE A 70 2.373 -11.720 9.349 1.00 10.00 H new ATOM 0 HG12 ILE A 70 0.593 -9.280 9.417 1.00 10.00 H new ATOM 0 HG13 ILE A 70 0.082 -10.654 8.457 1.00 10.00 H new ATOM 0 HG21 ILE A 70 2.820 -9.790 10.866 1.00 10.00 H new ATOM 0 HG22 ILE A 70 4.136 -10.091 9.706 1.00 10.00 H new ATOM 0 HG23 ILE A 70 3.003 -8.746 9.436 1.00 10.00 H new ATOM 0 HD11 ILE A 70 -0.774 -10.842 10.783 1.00 10.00 H new ATOM 0 HD12 ILE A 70 0.372 -12.158 10.432 1.00 10.00 H new ATOM 0 HD13 ILE A 70 0.891 -10.763 11.406 1.00 10.00 H new ATOM 1105 N VAL A 71 3.873 -8.822 6.797 1.00 10.00 N ATOM 1106 CA VAL A 71 4.191 -7.554 6.124 1.00 10.00 C ATOM 1107 C VAL A 71 4.069 -7.722 4.614 1.00 10.00 C ATOM 1108 O VAL A 71 3.360 -6.963 3.964 1.00 10.00 O ATOM 1109 CB VAL A 71 5.627 -7.066 6.421 1.00 10.00 C ATOM 1110 CG1 VAL A 71 5.703 -5.542 6.288 1.00 10.00 C ATOM 1111 CG2 VAL A 71 6.164 -7.503 7.785 1.00 10.00 C ATOM 0 H VAL A 71 4.691 -9.281 7.197 1.00 10.00 H new ATOM 0 HA VAL A 71 3.483 -6.819 6.505 1.00 10.00 H new ATOM 0 HB VAL A 71 6.267 -7.543 5.679 1.00 10.00 H new ATOM 0 HG11 VAL A 71 6.719 -5.209 6.499 1.00 10.00 H new ATOM 0 HG12 VAL A 71 5.429 -5.251 5.274 1.00 10.00 H new ATOM 0 HG13 VAL A 71 5.015 -5.080 6.996 1.00 10.00 H new ATOM 0 HG21 VAL A 71 7.176 -7.121 7.917 1.00 10.00 H new ATOM 0 HG22 VAL A 71 5.522 -7.109 8.572 1.00 10.00 H new ATOM 0 HG23 VAL A 71 6.177 -8.592 7.839 1.00 10.00 H new ATOM 1121 N ASP A 72 4.745 -8.740 4.073 1.00 10.00 N ATOM 1122 CA ASP A 72 4.748 -9.072 2.648 1.00 10.00 C ATOM 1123 C ASP A 72 3.329 -9.351 2.135 1.00 10.00 C ATOM 1124 O ASP A 72 2.955 -8.841 1.080 1.00 10.00 O ATOM 1125 CB ASP A 72 5.693 -10.257 2.405 1.00 10.00 C ATOM 1126 CG ASP A 72 5.960 -10.485 0.915 1.00 10.00 C ATOM 1127 OD1 ASP A 72 6.487 -9.542 0.284 1.00 10.00 O ATOM 1128 OD2 ASP A 72 5.663 -11.603 0.440 1.00 10.00 O ATOM 0 H ASP A 72 5.320 -9.372 4.630 1.00 10.00 H new ATOM 0 HA ASP A 72 5.114 -8.216 2.081 1.00 10.00 H new ATOM 0 HB2 ASP A 72 6.638 -10.078 2.919 1.00 10.00 H new ATOM 0 HB3 ASP A 72 5.261 -11.159 2.838 1.00 10.00 H new ATOM 1133 N GLU A 73 2.491 -10.029 2.938 1.00 10.00 N ATOM 1134 CA GLU A 73 1.070 -10.204 2.621 1.00 10.00 C ATOM 1135 C GLU A 73 0.323 -8.863 2.596 1.00 10.00 C ATOM 1136 O GLU A 73 -0.560 -8.676 1.757 1.00 10.00 O ATOM 1137 CB GLU A 73 0.358 -11.113 3.628 1.00 10.00 C ATOM 1138 CG GLU A 73 0.825 -12.572 3.633 1.00 10.00 C ATOM 1139 CD GLU A 73 -0.296 -13.498 4.144 1.00 10.00 C ATOM 1140 OE1 GLU A 73 -0.833 -13.213 5.243 1.00 10.00 O ATOM 1141 OE2 GLU A 73 -0.631 -14.465 3.419 1.00 10.00 O ATOM 0 H GLU A 73 2.779 -10.465 3.814 1.00 10.00 H new ATOM 0 HA GLU A 73 1.050 -10.664 1.633 1.00 10.00 H new ATOM 0 HB2 GLU A 73 0.497 -10.700 4.627 1.00 10.00 H new ATOM 0 HB3 GLU A 73 -0.712 -11.091 3.420 1.00 10.00 H new ATOM 0 HG2 GLU A 73 1.119 -12.869 2.626 1.00 10.00 H new ATOM 0 HG3 GLU A 73 1.706 -12.675 4.266 1.00 10.00 H new ATOM 1148 N ALA A 74 0.681 -7.905 3.466 1.00 10.00 N ATOM 1149 CA ALA A 74 0.068 -6.578 3.447 1.00 10.00 C ATOM 1150 C ALA A 74 0.446 -5.814 2.172 1.00 10.00 C ATOM 1151 O ALA A 74 -0.418 -5.195 1.546 1.00 10.00 O ATOM 1152 CB ALA A 74 0.473 -5.802 4.706 1.00 10.00 C ATOM 0 H ALA A 74 1.391 -8.030 4.188 1.00 10.00 H new ATOM 0 HA ALA A 74 -1.016 -6.690 3.444 1.00 10.00 H new ATOM 0 HB1 ALA A 74 0.014 -4.814 4.688 1.00 10.00 H new ATOM 0 HB2 ALA A 74 0.136 -6.342 5.591 1.00 10.00 H new ATOM 0 HB3 ALA A 74 1.558 -5.698 4.736 1.00 10.00 H new ATOM 1158 N VAL A 75 1.721 -5.878 1.760 1.00 10.00 N ATOM 1159 CA VAL A 75 2.171 -5.216 0.533 1.00 10.00 C ATOM 1160 C VAL A 75 1.595 -5.901 -0.713 1.00 10.00 C ATOM 1161 O VAL A 75 1.094 -5.212 -1.594 1.00 10.00 O ATOM 1162 CB VAL A 75 3.704 -5.102 0.427 1.00 10.00 C ATOM 1163 CG1 VAL A 75 4.033 -3.892 -0.447 1.00 10.00 C ATOM 1164 CG2 VAL A 75 4.434 -4.875 1.757 1.00 10.00 C ATOM 0 H VAL A 75 2.455 -6.381 2.259 1.00 10.00 H new ATOM 0 HA VAL A 75 1.785 -4.198 0.587 1.00 10.00 H new ATOM 0 HB VAL A 75 4.039 -6.058 0.025 1.00 10.00 H new ATOM 0 HG11 VAL A 75 5.115 -3.791 -0.536 1.00 10.00 H new ATOM 0 HG12 VAL A 75 3.598 -4.029 -1.437 1.00 10.00 H new ATOM 0 HG13 VAL A 75 3.621 -2.991 0.008 1.00 10.00 H new ATOM 0 HG21 VAL A 75 5.507 -4.809 1.576 1.00 10.00 H new ATOM 0 HG22 VAL A 75 4.084 -3.948 2.210 1.00 10.00 H new ATOM 0 HG23 VAL A 75 4.230 -5.707 2.431 1.00 10.00 H new ATOM 1174 N ASP A 76 1.558 -7.237 -0.764 1.00 10.00 N ATOM 1175 CA ASP A 76 0.906 -8.020 -1.821 1.00 10.00 C ATOM 1176 C ASP A 76 -0.591 -7.682 -1.921 1.00 10.00 C ATOM 1177 O ASP A 76 -1.094 -7.456 -3.025 1.00 10.00 O ATOM 1178 CB ASP A 76 1.125 -9.511 -1.513 1.00 10.00 C ATOM 1179 CG ASP A 76 0.371 -10.438 -2.466 1.00 10.00 C ATOM 1180 OD1 ASP A 76 -0.824 -10.702 -2.215 1.00 10.00 O ATOM 1181 OD2 ASP A 76 0.951 -10.893 -3.477 1.00 10.00 O ATOM 0 H ASP A 76 1.994 -7.821 -0.050 1.00 10.00 H new ATOM 0 HA ASP A 76 1.344 -7.775 -2.789 1.00 10.00 H new ATOM 0 HB2 ASP A 76 2.191 -9.734 -1.566 1.00 10.00 H new ATOM 0 HB3 ASP A 76 0.807 -9.715 -0.490 1.00 10.00 H new ATOM 1186 N ALA A 77 -1.278 -7.520 -0.784 1.00 10.00 N ATOM 1187 CA ALA A 77 -2.661 -7.052 -0.762 1.00 10.00 C ATOM 1188 C ALA A 77 -2.786 -5.627 -1.326 1.00 10.00 C ATOM 1189 O ALA A 77 -3.703 -5.369 -2.105 1.00 10.00 O ATOM 1190 CB ALA A 77 -3.214 -7.151 0.664 1.00 10.00 C ATOM 0 H ALA A 77 -0.890 -7.710 0.140 1.00 10.00 H new ATOM 0 HA ALA A 77 -3.258 -7.693 -1.411 1.00 10.00 H new ATOM 0 HB1 ALA A 77 -4.246 -6.801 0.679 1.00 10.00 H new ATOM 0 HB2 ALA A 77 -3.177 -8.188 0.997 1.00 10.00 H new ATOM 0 HB3 ALA A 77 -2.612 -6.534 1.331 1.00 10.00 H new ATOM 1196 N ALA A 78 -1.854 -4.718 -1.011 1.00 10.00 N ATOM 1197 CA ALA A 78 -1.797 -3.392 -1.630 1.00 10.00 C ATOM 1198 C ALA A 78 -1.508 -3.446 -3.142 1.00 10.00 C ATOM 1199 O ALA A 78 -2.155 -2.726 -3.904 1.00 10.00 O ATOM 1200 CB ALA A 78 -0.779 -2.526 -0.881 1.00 10.00 C ATOM 0 H ALA A 78 -1.121 -4.883 -0.321 1.00 10.00 H new ATOM 0 HA ALA A 78 -2.784 -2.937 -1.545 1.00 10.00 H new ATOM 0 HB1 ALA A 78 -0.734 -1.538 -1.340 1.00 10.00 H new ATOM 0 HB2 ALA A 78 -1.081 -2.429 0.162 1.00 10.00 H new ATOM 0 HB3 ALA A 78 0.204 -2.994 -0.931 1.00 10.00 H new ATOM 1206 N TYR A 79 -0.605 -4.324 -3.600 1.00 10.00 N ATOM 1207 CA TYR A 79 -0.331 -4.514 -5.027 1.00 10.00 C ATOM 1208 C TYR A 79 -1.554 -5.057 -5.783 1.00 10.00 C ATOM 1209 O TYR A 79 -1.897 -4.513 -6.833 1.00 10.00 O ATOM 1210 CB TYR A 79 0.871 -5.460 -5.211 1.00 10.00 C ATOM 1211 CG TYR A 79 2.231 -4.840 -4.936 1.00 10.00 C ATOM 1212 CD1 TYR A 79 2.690 -3.803 -5.773 1.00 10.00 C ATOM 1213 CD2 TYR A 79 3.054 -5.316 -3.891 1.00 10.00 C ATOM 1214 CE1 TYR A 79 3.950 -3.218 -5.555 1.00 10.00 C ATOM 1215 CE2 TYR A 79 4.321 -4.734 -3.676 1.00 10.00 C ATOM 1216 CZ TYR A 79 4.763 -3.670 -4.495 1.00 10.00 C ATOM 1217 OH TYR A 79 5.953 -3.053 -4.266 1.00 10.00 O ATOM 0 H TYR A 79 -0.046 -4.921 -2.991 1.00 10.00 H new ATOM 0 HA TYR A 79 -0.095 -3.537 -5.450 1.00 10.00 H new ATOM 0 HB2 TYR A 79 0.741 -6.319 -4.552 1.00 10.00 H new ATOM 0 HB3 TYR A 79 0.862 -5.838 -6.233 1.00 10.00 H new ATOM 0 HD1 TYR A 79 2.070 -3.456 -6.587 1.00 10.00 H new ATOM 0 HD2 TYR A 79 2.714 -6.123 -3.259 1.00 10.00 H new ATOM 0 HE1 TYR A 79 4.295 -2.423 -6.199 1.00 10.00 H new ATOM 0 HE2 TYR A 79 4.955 -5.102 -2.883 1.00 10.00 H new ATOM 0 HH TYR A 79 6.046 -2.866 -3.308 1.00 10.00 H new ATOM 1227 N ARG A 80 -2.273 -6.042 -5.219 1.00 10.00 N ATOM 1228 CA ARG A 80 -3.530 -6.558 -5.794 1.00 10.00 C ATOM 1229 C ARG A 80 -4.652 -5.522 -5.724 1.00 10.00 C ATOM 1230 O ARG A 80 -5.413 -5.379 -6.678 1.00 10.00 O ATOM 1231 CB ARG A 80 -3.950 -7.859 -5.096 1.00 10.00 C ATOM 1232 CG ARG A 80 -2.968 -8.998 -5.405 1.00 10.00 C ATOM 1233 CD ARG A 80 -3.352 -10.284 -4.664 1.00 10.00 C ATOM 1234 NE ARG A 80 -2.173 -11.143 -4.496 1.00 10.00 N ATOM 1235 CZ ARG A 80 -1.636 -12.000 -5.348 1.00 10.00 C ATOM 1236 NH1 ARG A 80 -2.259 -12.390 -6.437 1.00 10.00 N ATOM 1237 NH2 ARG A 80 -0.435 -12.463 -5.116 1.00 10.00 N ATOM 0 H ARG A 80 -2.000 -6.504 -4.351 1.00 10.00 H new ATOM 0 HA ARG A 80 -3.346 -6.771 -6.847 1.00 10.00 H new ATOM 0 HB2 ARG A 80 -3.997 -7.698 -4.019 1.00 10.00 H new ATOM 0 HB3 ARG A 80 -4.952 -8.141 -5.420 1.00 10.00 H new ATOM 0 HG2 ARG A 80 -2.952 -9.186 -6.479 1.00 10.00 H new ATOM 0 HG3 ARG A 80 -1.960 -8.699 -5.119 1.00 10.00 H new ATOM 0 HD2 ARG A 80 -3.774 -10.039 -3.690 1.00 10.00 H new ATOM 0 HD3 ARG A 80 -4.123 -10.817 -5.221 1.00 10.00 H new ATOM 0 HE ARG A 80 -1.702 -11.068 -3.595 1.00 10.00 H new ATOM 0 HH11 ARG A 80 -3.189 -12.030 -6.649 1.00 10.00 H new ATOM 0 HH12 ARG A 80 -1.812 -13.053 -7.071 1.00 10.00 H new ATOM 0 HH21 ARG A 80 0.076 -12.163 -4.286 1.00 10.00 H new ATOM 0 HH22 ARG A 80 -0.009 -13.125 -5.765 1.00 10.00 H new ATOM 1251 N SER A 81 -4.699 -4.734 -4.644 1.00 10.00 N ATOM 1252 CA SER A 81 -5.668 -3.649 -4.484 1.00 10.00 C ATOM 1253 C SER A 81 -5.452 -2.596 -5.569 1.00 10.00 C ATOM 1254 O SER A 81 -6.406 -2.267 -6.267 1.00 10.00 O ATOM 1255 CB SER A 81 -5.533 -3.028 -3.087 1.00 10.00 C ATOM 1256 OG SER A 81 -6.434 -1.954 -2.921 1.00 10.00 O ATOM 0 H SER A 81 -4.062 -4.833 -3.854 1.00 10.00 H new ATOM 0 HA SER A 81 -6.677 -4.048 -4.586 1.00 10.00 H new ATOM 0 HB2 SER A 81 -5.723 -3.787 -2.328 1.00 10.00 H new ATOM 0 HB3 SER A 81 -4.512 -2.677 -2.938 1.00 10.00 H new ATOM 0 HG SER A 81 -6.028 -1.131 -3.264 1.00 10.00 H new ATOM 1262 N LEU A 82 -4.208 -2.147 -5.799 1.00 10.00 N ATOM 1263 CA LEU A 82 -3.892 -1.222 -6.888 1.00 10.00 C ATOM 1264 C LEU A 82 -4.159 -1.824 -8.277 1.00 10.00 C ATOM 1265 O LEU A 82 -4.738 -1.142 -9.121 1.00 10.00 O ATOM 1266 CB LEU A 82 -2.438 -0.743 -6.748 1.00 10.00 C ATOM 1267 CG LEU A 82 -2.000 0.290 -7.809 1.00 10.00 C ATOM 1268 CD1 LEU A 82 -2.936 1.501 -7.949 1.00 10.00 C ATOM 1269 CD2 LEU A 82 -0.604 0.799 -7.452 1.00 10.00 C ATOM 0 H LEU A 82 -3.401 -2.416 -5.237 1.00 10.00 H new ATOM 0 HA LEU A 82 -4.561 -0.365 -6.806 1.00 10.00 H new ATOM 0 HB2 LEU A 82 -2.306 -0.307 -5.758 1.00 10.00 H new ATOM 0 HB3 LEU A 82 -1.777 -1.607 -6.806 1.00 10.00 H new ATOM 0 HG LEU A 82 -2.024 -0.231 -8.766 1.00 10.00 H new ATOM 0 HD11 LEU A 82 -2.550 2.173 -8.716 1.00 10.00 H new ATOM 0 HD12 LEU A 82 -3.932 1.160 -8.233 1.00 10.00 H new ATOM 0 HD13 LEU A 82 -2.991 2.030 -6.998 1.00 10.00 H new ATOM 0 HD21 LEU A 82 -0.282 1.530 -8.194 1.00 10.00 H new ATOM 0 HD22 LEU A 82 -0.628 1.267 -6.468 1.00 10.00 H new ATOM 0 HD23 LEU A 82 0.096 -0.037 -7.439 1.00 10.00 H new ATOM 1281 N GLU A 83 -3.780 -3.084 -8.522 1.00 10.00 N ATOM 1282 CA GLU A 83 -4.034 -3.745 -9.809 1.00 10.00 C ATOM 1283 C GLU A 83 -5.532 -3.817 -10.134 1.00 10.00 C ATOM 1284 O GLU A 83 -5.931 -3.443 -11.239 1.00 10.00 O ATOM 1285 CB GLU A 83 -3.369 -5.144 -9.753 1.00 10.00 C ATOM 1286 CG GLU A 83 -3.898 -6.238 -10.699 1.00 10.00 C ATOM 1287 CD GLU A 83 -4.759 -7.253 -9.933 1.00 10.00 C ATOM 1288 OE1 GLU A 83 -5.938 -6.931 -9.655 1.00 10.00 O ATOM 1289 OE2 GLU A 83 -4.226 -8.332 -9.592 1.00 10.00 O ATOM 0 H GLU A 83 -3.294 -3.669 -7.843 1.00 10.00 H new ATOM 0 HA GLU A 83 -3.599 -3.165 -10.623 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -2.305 -5.016 -9.954 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -3.458 -5.515 -8.732 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -4.487 -5.783 -11.495 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -3.061 -6.750 -11.174 1.00 10.00 H new ATOM 1296 N SER A 84 -6.374 -4.129 -9.145 1.00 10.00 N ATOM 1297 CA SER A 84 -7.816 -4.259 -9.364 1.00 10.00 C ATOM 1298 C SER A 84 -8.520 -2.894 -9.325 1.00 10.00 C ATOM 1299 O SER A 84 -9.499 -2.680 -10.036 1.00 10.00 O ATOM 1300 CB SER A 84 -8.395 -5.241 -8.344 1.00 10.00 C ATOM 1301 OG SER A 84 -8.106 -6.584 -8.701 1.00 10.00 O ATOM 0 H SER A 84 -6.080 -4.297 -8.183 1.00 10.00 H new ATOM 0 HA SER A 84 -7.992 -4.657 -10.363 1.00 10.00 H new ATOM 0 HB2 SER A 84 -7.984 -5.028 -7.357 1.00 10.00 H new ATOM 0 HB3 SER A 84 -9.474 -5.104 -8.276 1.00 10.00 H new ATOM 0 HG SER A 84 -7.343 -6.602 -9.316 1.00 10.00 H new ATOM 1307 N PHE A 85 -7.990 -1.929 -8.563 1.00 10.00 N ATOM 1308 CA PHE A 85 -8.399 -0.523 -8.606 1.00 10.00 C ATOM 1309 C PHE A 85 -8.138 0.074 -9.995 1.00 10.00 C ATOM 1310 O PHE A 85 -9.003 0.764 -10.531 1.00 10.00 O ATOM 1311 CB PHE A 85 -7.610 0.203 -7.502 1.00 10.00 C ATOM 1312 CG PHE A 85 -7.620 1.718 -7.425 1.00 10.00 C ATOM 1313 CD1 PHE A 85 -6.887 2.478 -8.358 1.00 10.00 C ATOM 1314 CD2 PHE A 85 -8.195 2.357 -6.309 1.00 10.00 C ATOM 1315 CE1 PHE A 85 -6.716 3.861 -8.168 1.00 10.00 C ATOM 1316 CE2 PHE A 85 -8.014 3.737 -6.110 1.00 10.00 C ATOM 1317 CZ PHE A 85 -7.270 4.489 -7.037 1.00 10.00 C ATOM 0 H PHE A 85 -7.249 -2.110 -7.886 1.00 10.00 H new ATOM 0 HA PHE A 85 -9.469 -0.413 -8.430 1.00 10.00 H new ATOM 0 HB2 PHE A 85 -7.975 -0.171 -6.545 1.00 10.00 H new ATOM 0 HB3 PHE A 85 -6.569 -0.109 -7.591 1.00 10.00 H new ATOM 0 HD1 PHE A 85 -6.455 1.996 -9.223 1.00 10.00 H new ATOM 0 HD2 PHE A 85 -8.778 1.784 -5.603 1.00 10.00 H new ATOM 0 HE1 PHE A 85 -6.160 4.441 -8.890 1.00 10.00 H new ATOM 0 HE2 PHE A 85 -8.446 4.219 -5.246 1.00 10.00 H new ATOM 0 HZ PHE A 85 -7.124 5.548 -6.881 1.00 10.00 H new ATOM 1327 N LEU A 86 -6.986 -0.223 -10.618 1.00 10.00 N ATOM 1328 CA LEU A 86 -6.664 0.309 -11.943 1.00 10.00 C ATOM 1329 C LEU A 86 -7.434 -0.411 -13.054 1.00 10.00 C ATOM 1330 O LEU A 86 -7.888 0.246 -13.994 1.00 10.00 O ATOM 1331 CB LEU A 86 -5.149 0.213 -12.178 1.00 10.00 C ATOM 1332 CG LEU A 86 -4.632 1.211 -13.226 1.00 10.00 C ATOM 1333 CD1 LEU A 86 -4.791 2.669 -12.774 1.00 10.00 C ATOM 1334 CD2 LEU A 86 -3.150 0.943 -13.493 1.00 10.00 C ATOM 0 H LEU A 86 -6.266 -0.828 -10.222 1.00 10.00 H new ATOM 0 HA LEU A 86 -6.971 1.354 -11.974 1.00 10.00 H new ATOM 0 HB2 LEU A 86 -4.630 0.386 -11.235 1.00 10.00 H new ATOM 0 HB3 LEU A 86 -4.901 -0.799 -12.497 1.00 10.00 H new ATOM 0 HG LEU A 86 -5.227 1.070 -14.128 1.00 10.00 H new ATOM 0 HD11 LEU A 86 -4.411 3.334 -13.550 1.00 10.00 H new ATOM 0 HD12 LEU A 86 -5.845 2.882 -12.598 1.00 10.00 H new ATOM 0 HD13 LEU A 86 -4.230 2.828 -11.853 1.00 10.00 H new ATOM 0 HD21 LEU A 86 -2.781 1.650 -14.236 1.00 10.00 H new ATOM 0 HD22 LEU A 86 -2.586 1.062 -12.568 1.00 10.00 H new ATOM 0 HD23 LEU A 86 -3.025 -0.074 -13.866 1.00 10.00 H new ATOM 1346 N ASP A 87 -7.686 -1.717 -12.900 1.00 10.00 N ATOM 1347 CA ASP A 87 -8.631 -2.445 -13.752 1.00 10.00 C ATOM 1348 C ASP A 87 -10.034 -1.820 -13.643 1.00 10.00 C ATOM 1349 O ASP A 87 -10.757 -1.734 -14.632 1.00 10.00 O ATOM 1350 CB ASP A 87 -8.639 -3.925 -13.346 1.00 10.00 C ATOM 1351 CG ASP A 87 -9.465 -4.778 -14.309 1.00 10.00 C ATOM 1352 OD1 ASP A 87 -9.030 -4.889 -15.476 1.00 10.00 O ATOM 1353 OD2 ASP A 87 -10.501 -5.317 -13.861 1.00 10.00 O ATOM 0 H ASP A 87 -7.243 -2.295 -12.186 1.00 10.00 H new ATOM 0 HA ASP A 87 -8.322 -2.375 -14.795 1.00 10.00 H new ATOM 0 HB2 ASP A 87 -7.615 -4.299 -13.317 1.00 10.00 H new ATOM 0 HB3 ASP A 87 -9.042 -4.022 -12.338 1.00 10.00 H new ATOM 1358 N GLY A 88 -10.369 -1.256 -12.472 1.00 10.00 N ATOM 1359 CA GLY A 88 -11.639 -0.578 -12.223 1.00 10.00 C ATOM 1360 C GLY A 88 -11.738 0.821 -12.842 1.00 10.00 C ATOM 1361 O GLY A 88 -12.838 1.368 -12.910 1.00 10.00 O ATOM 0 H GLY A 88 -9.750 -1.262 -11.661 1.00 10.00 H new ATOM 0 HA2 GLY A 88 -12.449 -1.194 -12.614 1.00 10.00 H new ATOM 0 HA3 GLY A 88 -11.790 -0.498 -11.146 1.00 10.00 H new ATOM 1365 N PHE A 89 -10.622 1.401 -13.313 1.00 10.00 N ATOM 1366 CA PHE A 89 -10.575 2.779 -13.820 1.00 10.00 C ATOM 1367 C PHE A 89 -9.951 2.939 -15.207 1.00 10.00 C ATOM 1368 O PHE A 89 -10.129 4.006 -15.799 1.00 10.00 O ATOM 1369 CB PHE A 89 -9.857 3.688 -12.810 1.00 10.00 C ATOM 1370 CG PHE A 89 -10.506 3.814 -11.443 1.00 10.00 C ATOM 1371 CD1 PHE A 89 -11.905 3.936 -11.308 1.00 10.00 C ATOM 1372 CD2 PHE A 89 -9.699 3.839 -10.291 1.00 10.00 C ATOM 1373 CE1 PHE A 89 -12.494 4.069 -10.040 1.00 10.00 C ATOM 1374 CE2 PHE A 89 -10.291 3.970 -9.022 1.00 10.00 C ATOM 1375 CZ PHE A 89 -11.685 4.086 -8.894 1.00 10.00 C ATOM 0 H PHE A 89 -9.722 0.922 -13.352 1.00 10.00 H new ATOM 0 HA PHE A 89 -11.617 3.078 -13.938 1.00 10.00 H new ATOM 0 HB2 PHE A 89 -8.842 3.315 -12.674 1.00 10.00 H new ATOM 0 HB3 PHE A 89 -9.775 4.685 -13.244 1.00 10.00 H new ATOM 0 HD1 PHE A 89 -12.530 3.927 -12.189 1.00 10.00 H new ATOM 0 HD2 PHE A 89 -8.626 3.758 -10.381 1.00 10.00 H new ATOM 0 HE1 PHE A 89 -13.566 4.158 -9.947 1.00 10.00 H new ATOM 0 HE2 PHE A 89 -9.669 3.981 -8.139 1.00 10.00 H new ATOM 0 HZ PHE A 89 -12.133 4.188 -7.916 1.00 10.00 H new ATOM 1385 N ARG A 90 -9.290 1.909 -15.752 1.00 10.00 N ATOM 1386 CA ARG A 90 -8.718 1.911 -17.106 1.00 10.00 C ATOM 1387 C ARG A 90 -8.998 0.648 -17.912 1.00 10.00 C ATOM 1388 O ARG A 90 -9.283 0.793 -19.099 1.00 10.00 O ATOM 1389 CB ARG A 90 -7.188 1.954 -17.058 1.00 10.00 C ATOM 1390 CG ARG A 90 -6.495 3.114 -16.336 1.00 10.00 C ATOM 1391 CD ARG A 90 -4.982 3.092 -16.638 1.00 10.00 C ATOM 1392 NE ARG A 90 -4.461 1.709 -16.648 1.00 10.00 N ATOM 1393 CZ ARG A 90 -3.557 1.189 -17.459 1.00 10.00 C ATOM 1394 NH1 ARG A 90 -2.644 1.938 -18.039 1.00 10.00 N ATOM 1395 NH2 ARG A 90 -3.588 -0.104 -17.701 1.00 10.00 N ATOM 0 H ARG A 90 -9.135 1.033 -15.254 1.00 10.00 H new ATOM 0 HA ARG A 90 -9.182 2.783 -17.567 1.00 10.00 H new ATOM 0 HB2 ARG A 90 -6.848 1.028 -16.593 1.00 10.00 H new ATOM 0 HB3 ARG A 90 -6.827 1.945 -18.086 1.00 10.00 H new ATOM 0 HG2 ARG A 90 -6.925 4.063 -16.657 1.00 10.00 H new ATOM 0 HG3 ARG A 90 -6.661 3.036 -15.262 1.00 10.00 H new ATOM 0 HD2 ARG A 90 -4.794 3.562 -17.604 1.00 10.00 H new ATOM 0 HD3 ARG A 90 -4.450 3.679 -15.889 1.00 10.00 H new ATOM 0 HE ARG A 90 -4.846 1.080 -15.943 1.00 10.00 H new ATOM 0 HH11 ARG A 90 -2.624 2.943 -17.866 1.00 10.00 H new ATOM 0 HH12 ARG A 90 -1.956 1.514 -18.661 1.00 10.00 H new ATOM 0 HH21 ARG A 90 -4.302 -0.687 -17.265 1.00 10.00 H new ATOM 0 HH22 ARG A 90 -2.898 -0.523 -18.325 1.00 10.00 H new ATOM 1409 N GLU A 91 -8.892 -0.522 -17.263 1.00 10.00 N ATOM 1410 CA GLU A 91 -8.781 -1.837 -17.922 1.00 10.00 C ATOM 1411 C GLU A 91 -7.380 -1.930 -18.603 1.00 10.00 C ATOM 1412 O GLU A 91 -6.395 -1.401 -18.005 1.00 10.00 O ATOM 1413 CB GLU A 91 -10.029 -2.096 -18.814 1.00 10.00 C ATOM 1414 CG GLU A 91 -10.419 -3.573 -19.006 1.00 10.00 C ATOM 1415 CD GLU A 91 -11.668 -3.739 -19.900 1.00 10.00 C ATOM 1416 OE1 GLU A 91 -12.693 -3.068 -19.627 1.00 10.00 O ATOM 1417 OE2 GLU A 91 -11.605 -4.550 -20.854 1.00 10.00 O ATOM 1418 OXT GLU A 91 -7.288 -2.506 -19.708 1.00 10.00 O ATOM 0 H GLU A 91 -8.881 -0.584 -16.245 1.00 10.00 H new ATOM 0 HA GLU A 91 -8.806 -2.669 -17.218 1.00 10.00 H new ATOM 0 HB2 GLU A 91 -10.878 -1.569 -18.380 1.00 10.00 H new ATOM 0 HB3 GLU A 91 -9.849 -1.657 -19.795 1.00 10.00 H new ATOM 0 HG2 GLU A 91 -9.583 -4.112 -19.451 1.00 10.00 H new ATOM 0 HG3 GLU A 91 -10.609 -4.026 -18.033 1.00 10.00 H new TER 1425 GLU A 91