USER MOD reduce.3.24.130724 H: found=0, std=0, add=989, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 988 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 ASN : amide:sc= -1.47 K(o=-0.63,f=-0.084) USER MOD Set 1.2: A 86 THR OG1 : rot 89:sc= 0.841 USER MOD Set 2.1: A 20 THR OG1 : rot 160:sc= 1.03 USER MOD Set 2.2: A 41 CYS SG : rot 176:sc= 1.19 USER MOD Single : A 1 VAL N :NH3+ -149:sc= -0.0982 (180deg=-0.561) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 CYS SG : rot 180:sc= -1.2 USER MOD Single : A 9 THR OG1 : rot 171:sc= 0.993 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.071 USER MOD Single : A 32 LYS NZ :NH3+ 168:sc= 1.24 (180deg=0.948) USER MOD Single : A 34 THR OG1 : rot 63:sc= 0.392 USER MOD Single : A 38 LYS NZ :NH3+ -162:sc= -0.0404 (180deg=-0.317) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 180:sc=0.000632 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A 73 LYS NZ :NH3+ 144:sc= -1.06 (180deg=-3.27!) USER MOD Single : A 74 ASN : amide:sc= 1.04 K(o=1,f=-0.75) USER MOD Single : A 79 LYS NZ :NH3+ -172:sc= 2.01 (180deg=1.9) USER MOD Single : A 84 LYS NZ :NH3+ 174:sc= 1.15 (180deg=1.04) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 MET CE :methyl -167:sc= -0.445 (180deg=-0.967) USER MOD Single : A 108 LYS NZ :NH3+ 172:sc=-0.00489 (180deg=-0.0814) USER MOD Single : A 114 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0291) USER MOD Single : A 115 THR OG1 : rot 121:sc= -1.16! USER MOD Single : A 122 ASN : amide:sc= -0.668 K(o=-0.67,f=-11!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 5.514 15.241 -11.173 1.00 0.00 N ATOM 2 CA VAL A 1 5.511 15.532 -9.748 1.00 0.00 C ATOM 3 C VAL A 1 6.032 14.340 -8.958 1.00 0.00 C ATOM 4 O VAL A 1 5.685 13.194 -9.239 1.00 0.00 O ATOM 5 CB VAL A 1 4.099 15.902 -9.243 1.00 0.00 C ATOM 6 CG1 VAL A 1 4.146 16.373 -7.796 1.00 0.00 C ATOM 7 CG2 VAL A 1 3.469 16.970 -10.124 1.00 0.00 C ATOM 0 H1 VAL A 1 5.677 16.119 -11.706 1.00 0.00 H new ATOM 0 H2 VAL A 1 6.271 14.561 -11.387 1.00 0.00 H new ATOM 0 H3 VAL A 1 4.596 14.835 -11.446 1.00 0.00 H new ATOM 0 HA VAL A 1 6.167 16.389 -9.594 1.00 0.00 H new ATOM 0 HB VAL A 1 3.482 15.005 -9.294 1.00 0.00 H new ATOM 0 HG11 VAL A 1 3.140 16.628 -7.463 1.00 0.00 H new ATOM 0 HG12 VAL A 1 4.546 15.577 -7.167 1.00 0.00 H new ATOM 0 HG13 VAL A 1 4.786 17.252 -7.720 1.00 0.00 H new ATOM 0 HG21 VAL A 1 2.475 17.213 -9.747 1.00 0.00 H new ATOM 0 HG22 VAL A 1 4.091 17.865 -10.111 1.00 0.00 H new ATOM 0 HG23 VAL A 1 3.389 16.598 -11.146 1.00 0.00 H new ATOM 17 N LYS A 2 6.875 14.619 -7.981 1.00 0.00 N ATOM 18 CA LYS A 2 7.428 13.586 -7.127 1.00 0.00 C ATOM 19 C LYS A 2 7.276 13.997 -5.667 1.00 0.00 C ATOM 20 O LYS A 2 7.875 14.974 -5.222 1.00 0.00 O ATOM 21 CB LYS A 2 8.897 13.333 -7.495 1.00 0.00 C ATOM 22 CG LYS A 2 9.741 14.598 -7.580 1.00 0.00 C ATOM 23 CD LYS A 2 11.076 14.334 -8.253 1.00 0.00 C ATOM 24 CE LYS A 2 11.943 15.583 -8.284 1.00 0.00 C ATOM 25 NZ LYS A 2 13.136 15.403 -9.151 1.00 0.00 N ATOM 0 H LYS A 2 7.194 15.562 -7.758 1.00 0.00 H new ATOM 0 HA LYS A 2 6.885 12.653 -7.274 1.00 0.00 H new ATOM 0 HB2 LYS A 2 9.336 12.664 -6.755 1.00 0.00 H new ATOM 0 HB3 LYS A 2 8.937 12.817 -8.454 1.00 0.00 H new ATOM 0 HG2 LYS A 2 9.197 15.362 -8.136 1.00 0.00 H new ATOM 0 HG3 LYS A 2 9.910 14.992 -6.578 1.00 0.00 H new ATOM 0 HD2 LYS A 2 11.601 13.539 -7.723 1.00 0.00 H new ATOM 0 HD3 LYS A 2 10.908 13.982 -9.271 1.00 0.00 H new ATOM 0 HE2 LYS A 2 11.354 16.426 -8.646 1.00 0.00 H new ATOM 0 HE3 LYS A 2 12.263 15.829 -7.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 13.703 16.275 -9.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 13.711 14.615 -8.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 12.830 15.193 -10.123 1.00 0.00 H new ATOM 39 N PHE A 3 6.450 13.267 -4.933 1.00 0.00 N ATOM 40 CA PHE A 3 6.156 13.621 -3.549 1.00 0.00 C ATOM 41 C PHE A 3 7.084 12.895 -2.587 1.00 0.00 C ATOM 42 O PHE A 3 7.579 11.809 -2.884 1.00 0.00 O ATOM 43 CB PHE A 3 4.706 13.284 -3.188 1.00 0.00 C ATOM 44 CG PHE A 3 3.673 14.062 -3.954 1.00 0.00 C ATOM 45 CD1 PHE A 3 3.359 15.364 -3.596 1.00 0.00 C ATOM 46 CD2 PHE A 3 3.005 13.485 -5.023 1.00 0.00 C ATOM 47 CE1 PHE A 3 2.401 16.077 -4.290 1.00 0.00 C ATOM 48 CE2 PHE A 3 2.044 14.193 -5.720 1.00 0.00 C ATOM 49 CZ PHE A 3 1.743 15.491 -5.353 1.00 0.00 C ATOM 0 H PHE A 3 5.973 12.430 -5.268 1.00 0.00 H new ATOM 0 HA PHE A 3 6.310 14.696 -3.457 1.00 0.00 H new ATOM 0 HB2 PHE A 3 4.541 12.220 -3.359 1.00 0.00 H new ATOM 0 HB3 PHE A 3 4.560 13.462 -2.123 1.00 0.00 H new ATOM 0 HD1 PHE A 3 3.870 15.826 -2.764 1.00 0.00 H new ATOM 0 HD2 PHE A 3 3.238 12.471 -5.314 1.00 0.00 H new ATOM 0 HE1 PHE A 3 2.167 17.091 -4.002 1.00 0.00 H new ATOM 0 HE2 PHE A 3 1.529 13.733 -6.550 1.00 0.00 H new ATOM 0 HZ PHE A 3 0.994 16.047 -5.897 1.00 0.00 H new ATOM 59 N ALA A 4 7.308 13.505 -1.435 1.00 0.00 N ATOM 60 CA ALA A 4 8.083 12.884 -0.374 1.00 0.00 C ATOM 61 C ALA A 4 7.147 12.355 0.701 1.00 0.00 C ATOM 62 O ALA A 4 6.333 13.105 1.244 1.00 0.00 O ATOM 63 CB ALA A 4 9.068 13.880 0.221 1.00 0.00 C ATOM 0 H ALA A 4 6.961 14.437 -1.210 1.00 0.00 H new ATOM 0 HA ALA A 4 8.651 12.053 -0.791 1.00 0.00 H new ATOM 0 HB1 ALA A 4 9.639 13.397 1.014 1.00 0.00 H new ATOM 0 HB2 ALA A 4 9.748 14.228 -0.556 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.523 14.729 0.632 1.00 0.00 H new ATOM 69 N CYS A 5 7.255 11.074 1.006 1.00 0.00 N ATOM 70 CA CYS A 5 6.354 10.452 1.960 1.00 0.00 C ATOM 71 C CYS A 5 7.126 9.894 3.150 1.00 0.00 C ATOM 72 O CYS A 5 8.358 9.895 3.162 1.00 0.00 O ATOM 73 CB CYS A 5 5.561 9.336 1.279 1.00 0.00 C ATOM 74 SG CYS A 5 4.683 9.861 -0.209 1.00 0.00 S ATOM 0 H CYS A 5 7.954 10.446 0.609 1.00 0.00 H new ATOM 0 HA CYS A 5 5.662 11.211 2.326 1.00 0.00 H new ATOM 0 HB2 CYS A 5 6.243 8.526 1.019 1.00 0.00 H new ATOM 0 HB3 CYS A 5 4.841 8.931 1.989 1.00 0.00 H new ATOM 0 HG CYS A 5 4.044 8.849 -0.715 1.00 0.00 H new ATOM 80 N ARG A 6 6.396 9.414 4.140 1.00 0.00 N ATOM 81 CA ARG A 6 6.993 8.860 5.339 1.00 0.00 C ATOM 82 C ARG A 6 7.160 7.358 5.171 1.00 0.00 C ATOM 83 O ARG A 6 6.181 6.614 5.099 1.00 0.00 O ATOM 84 CB ARG A 6 6.114 9.191 6.545 1.00 0.00 C ATOM 85 CG ARG A 6 6.607 8.628 7.864 1.00 0.00 C ATOM 86 CD ARG A 6 5.733 9.107 9.013 1.00 0.00 C ATOM 87 NE ARG A 6 6.119 8.514 10.293 1.00 0.00 N ATOM 88 CZ ARG A 6 6.044 9.153 11.463 1.00 0.00 C ATOM 89 NH1 ARG A 6 5.628 10.417 11.508 1.00 0.00 N ATOM 90 NH2 ARG A 6 6.393 8.535 12.583 1.00 0.00 N ATOM 0 H ARG A 6 5.376 9.398 4.135 1.00 0.00 H new ATOM 0 HA ARG A 6 7.978 9.297 5.506 1.00 0.00 H new ATOM 0 HB2 ARG A 6 6.037 10.275 6.634 1.00 0.00 H new ATOM 0 HB3 ARG A 6 5.108 8.814 6.358 1.00 0.00 H new ATOM 0 HG2 ARG A 6 6.601 7.539 7.825 1.00 0.00 H new ATOM 0 HG3 ARG A 6 7.639 8.935 8.033 1.00 0.00 H new ATOM 0 HD2 ARG A 6 5.796 10.193 9.085 1.00 0.00 H new ATOM 0 HD3 ARG A 6 4.692 8.861 8.801 1.00 0.00 H new ATOM 0 HE ARG A 6 6.466 7.555 10.292 1.00 0.00 H new ATOM 0 HH11 ARG A 6 5.366 10.899 10.648 1.00 0.00 H new ATOM 0 HH12 ARG A 6 5.571 10.904 12.403 1.00 0.00 H new ATOM 0 HH21 ARG A 6 6.720 7.569 12.552 1.00 0.00 H new ATOM 0 HH22 ARG A 6 6.335 9.025 13.475 1.00 0.00 H new ATOM 104 N ALA A 7 8.403 6.926 5.083 1.00 0.00 N ATOM 105 CA ALA A 7 8.714 5.545 4.744 1.00 0.00 C ATOM 106 C ALA A 7 8.832 4.678 5.986 1.00 0.00 C ATOM 107 O ALA A 7 9.401 5.093 6.998 1.00 0.00 O ATOM 108 CB ALA A 7 10.000 5.480 3.931 1.00 0.00 C ATOM 0 H ALA A 7 9.221 7.514 5.242 1.00 0.00 H new ATOM 0 HA ALA A 7 7.891 5.156 4.144 1.00 0.00 H new ATOM 0 HB1 ALA A 7 10.222 4.442 3.684 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.879 6.054 3.012 1.00 0.00 H new ATOM 0 HB3 ALA A 7 10.821 5.897 4.514 1.00 0.00 H new ATOM 114 N ILE A 8 8.272 3.480 5.913 1.00 0.00 N ATOM 115 CA ILE A 8 8.406 2.518 6.989 1.00 0.00 C ATOM 116 C ILE A 8 9.419 1.454 6.590 1.00 0.00 C ATOM 117 O ILE A 8 10.375 1.183 7.318 1.00 0.00 O ATOM 118 CB ILE A 8 7.063 1.841 7.359 1.00 0.00 C ATOM 119 CG1 ILE A 8 6.020 2.872 7.811 1.00 0.00 C ATOM 120 CG2 ILE A 8 7.280 0.815 8.458 1.00 0.00 C ATOM 121 CD1 ILE A 8 5.327 3.595 6.675 1.00 0.00 C ATOM 0 H ILE A 8 7.721 3.154 5.119 1.00 0.00 H new ATOM 0 HA ILE A 8 8.745 3.062 7.871 1.00 0.00 H new ATOM 0 HB ILE A 8 6.684 1.344 6.466 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.268 2.369 8.419 1.00 0.00 H new ATOM 0 HG13 ILE A 8 6.507 3.608 8.451 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.329 0.345 8.710 1.00 0.00 H new ATOM 0 HG22 ILE A 8 7.980 0.054 8.113 1.00 0.00 H new ATOM 0 HG23 ILE A 8 7.687 1.308 9.341 1.00 0.00 H new ATOM 0 HD11 ILE A 8 4.606 4.305 7.081 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.067 4.130 6.079 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.808 2.872 6.046 1.00 0.00 H new ATOM 133 N THR A 9 9.211 0.868 5.421 1.00 0.00 N ATOM 134 CA THR A 9 10.141 -0.103 4.876 1.00 0.00 C ATOM 135 C THR A 9 10.984 0.547 3.782 1.00 0.00 C ATOM 136 O THR A 9 10.771 1.714 3.448 1.00 0.00 O ATOM 137 CB THR A 9 9.401 -1.339 4.319 1.00 0.00 C ATOM 138 OG1 THR A 9 8.426 -0.943 3.346 1.00 0.00 O ATOM 139 CG2 THR A 9 8.712 -2.101 5.438 1.00 0.00 C ATOM 0 H THR A 9 8.400 1.051 4.830 1.00 0.00 H new ATOM 0 HA THR A 9 10.793 -0.441 5.681 1.00 0.00 H new ATOM 0 HB THR A 9 10.139 -1.987 3.847 1.00 0.00 H new ATOM 0 HG1 THR A 9 8.064 -1.739 2.903 1.00 0.00 H new ATOM 0 HG21 THR A 9 8.197 -2.968 5.024 1.00 0.00 H new ATOM 0 HG22 THR A 9 9.455 -2.433 6.164 1.00 0.00 H new ATOM 0 HG23 THR A 9 7.989 -1.450 5.930 1.00 0.00 H new ATOM 147 N ARG A 10 11.937 -0.192 3.231 1.00 0.00 N ATOM 148 CA ARG A 10 12.838 0.364 2.231 1.00 0.00 C ATOM 149 C ARG A 10 12.772 -0.430 0.932 1.00 0.00 C ATOM 150 O ARG A 10 11.963 -1.349 0.798 1.00 0.00 O ATOM 151 CB ARG A 10 14.270 0.397 2.770 1.00 0.00 C ATOM 152 CG ARG A 10 14.418 1.264 4.009 1.00 0.00 C ATOM 153 CD ARG A 10 15.854 1.321 4.496 1.00 0.00 C ATOM 154 NE ARG A 10 15.979 2.133 5.704 1.00 0.00 N ATOM 155 CZ ARG A 10 16.993 2.955 5.954 1.00 0.00 C ATOM 156 NH1 ARG A 10 17.984 3.083 5.079 1.00 0.00 N ATOM 157 NH2 ARG A 10 17.020 3.641 7.091 1.00 0.00 N ATOM 0 H ARG A 10 12.106 -1.172 3.458 1.00 0.00 H new ATOM 0 HA ARG A 10 12.521 1.384 2.015 1.00 0.00 H new ATOM 0 HB2 ARG A 10 14.588 -0.619 3.004 1.00 0.00 H new ATOM 0 HB3 ARG A 10 14.937 0.768 1.992 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.070 2.273 3.789 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.781 0.873 4.803 1.00 0.00 H new ATOM 0 HD2 ARG A 10 16.211 0.311 4.697 1.00 0.00 H new ATOM 0 HD3 ARG A 10 16.489 1.734 3.712 1.00 0.00 H new ATOM 0 HE ARG A 10 15.239 2.065 6.402 1.00 0.00 H new ATOM 0 HH11 ARG A 10 17.969 2.549 4.210 1.00 0.00 H new ATOM 0 HH12 ARG A 10 18.760 3.715 5.276 1.00 0.00 H new ATOM 0 HH21 ARG A 10 16.264 3.536 7.768 1.00 0.00 H new ATOM 0 HH22 ARG A 10 17.796 4.273 7.287 1.00 0.00 H new ATOM 171 N GLY A 11 13.622 -0.071 -0.019 1.00 0.00 N ATOM 172 CA GLY A 11 13.575 -0.685 -1.329 1.00 0.00 C ATOM 173 C GLY A 11 12.902 0.221 -2.336 1.00 0.00 C ATOM 174 O GLY A 11 12.347 1.254 -1.966 1.00 0.00 O ATOM 0 H GLY A 11 14.346 0.638 0.095 1.00 0.00 H new ATOM 0 HA2 GLY A 11 14.587 -0.914 -1.662 1.00 0.00 H new ATOM 0 HA3 GLY A 11 13.037 -1.631 -1.271 1.00 0.00 H new ATOM 178 N ARG A 12 12.941 -0.148 -3.603 1.00 0.00 N ATOM 179 CA ARG A 12 12.344 0.681 -4.639 1.00 0.00 C ATOM 180 C ARG A 12 11.638 -0.186 -5.677 1.00 0.00 C ATOM 181 O ARG A 12 12.131 -1.249 -6.056 1.00 0.00 O ATOM 182 CB ARG A 12 13.396 1.602 -5.290 1.00 0.00 C ATOM 183 CG ARG A 12 14.374 0.925 -6.250 1.00 0.00 C ATOM 184 CD ARG A 12 15.190 -0.186 -5.595 1.00 0.00 C ATOM 185 NE ARG A 12 15.917 0.257 -4.405 1.00 0.00 N ATOM 186 CZ ARG A 12 17.091 -0.244 -4.024 1.00 0.00 C ATOM 187 NH1 ARG A 12 17.730 -1.123 -4.789 1.00 0.00 N ATOM 188 NH2 ARG A 12 17.633 0.133 -2.874 1.00 0.00 N ATOM 0 H ARG A 12 13.375 -1.008 -3.940 1.00 0.00 H new ATOM 0 HA ARG A 12 11.596 1.324 -4.175 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.874 2.392 -5.831 1.00 0.00 H new ATOM 0 HB3 ARG A 12 13.969 2.083 -4.498 1.00 0.00 H new ATOM 0 HG2 ARG A 12 13.819 0.511 -7.091 1.00 0.00 H new ATOM 0 HG3 ARG A 12 15.053 1.675 -6.655 1.00 0.00 H new ATOM 0 HD2 ARG A 12 14.524 -1.004 -5.322 1.00 0.00 H new ATOM 0 HD3 ARG A 12 15.901 -0.582 -6.320 1.00 0.00 H new ATOM 0 HE ARG A 12 15.501 0.992 -3.834 1.00 0.00 H new ATOM 0 HH11 ARG A 12 17.322 -1.419 -5.676 1.00 0.00 H new ATOM 0 HH12 ARG A 12 18.629 -1.502 -4.489 1.00 0.00 H new ATOM 0 HH21 ARG A 12 17.151 0.807 -2.280 1.00 0.00 H new ATOM 0 HH22 ARG A 12 18.532 -0.252 -2.584 1.00 0.00 H new ATOM 202 N ALA A 13 10.477 0.264 -6.122 1.00 0.00 N ATOM 203 CA ALA A 13 9.651 -0.523 -7.023 1.00 0.00 C ATOM 204 C ALA A 13 9.103 0.321 -8.163 1.00 0.00 C ATOM 205 O ALA A 13 8.797 1.501 -7.990 1.00 0.00 O ATOM 206 CB ALA A 13 8.511 -1.166 -6.253 1.00 0.00 C ATOM 0 H ALA A 13 10.084 1.172 -5.874 1.00 0.00 H new ATOM 0 HA ALA A 13 10.278 -1.301 -7.459 1.00 0.00 H new ATOM 0 HB1 ALA A 13 7.897 -1.754 -6.935 1.00 0.00 H new ATOM 0 HB2 ALA A 13 8.917 -1.816 -5.478 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.900 -0.390 -5.792 1.00 0.00 H new ATOM 212 N GLU A 14 8.981 -0.297 -9.328 1.00 0.00 N ATOM 213 CA GLU A 14 8.459 0.370 -10.508 1.00 0.00 C ATOM 214 C GLU A 14 7.282 -0.420 -11.080 1.00 0.00 C ATOM 215 O GLU A 14 7.403 -1.610 -11.383 1.00 0.00 O ATOM 216 CB GLU A 14 9.564 0.540 -11.567 1.00 0.00 C ATOM 217 CG GLU A 14 10.085 -0.767 -12.175 1.00 0.00 C ATOM 218 CD GLU A 14 10.821 -1.656 -11.186 1.00 0.00 C ATOM 219 OE1 GLU A 14 10.163 -2.462 -10.486 1.00 0.00 O ATOM 220 OE2 GLU A 14 12.062 -1.560 -11.109 1.00 0.00 O ATOM 0 H GLU A 14 9.240 -1.272 -9.481 1.00 0.00 H new ATOM 0 HA GLU A 14 8.107 1.361 -10.222 1.00 0.00 H new ATOM 0 HB2 GLU A 14 9.183 1.170 -12.370 1.00 0.00 H new ATOM 0 HB3 GLU A 14 10.401 1.072 -11.115 1.00 0.00 H new ATOM 0 HG2 GLU A 14 9.245 -1.322 -12.592 1.00 0.00 H new ATOM 0 HG3 GLU A 14 10.753 -0.530 -13.003 1.00 0.00 H new ATOM 227 N GLY A 15 6.135 0.224 -11.204 1.00 0.00 N ATOM 228 CA GLY A 15 4.987 -0.459 -11.754 1.00 0.00 C ATOM 229 C GLY A 15 3.871 0.487 -12.116 1.00 0.00 C ATOM 230 O GLY A 15 3.971 1.697 -11.889 1.00 0.00 O ATOM 0 H GLY A 15 5.979 1.196 -10.937 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.290 -1.015 -12.641 1.00 0.00 H new ATOM 0 HA3 GLY A 15 4.621 -1.188 -11.031 1.00 0.00 H new ATOM 234 N GLU A 16 2.820 -0.065 -12.693 1.00 0.00 N ATOM 235 CA GLU A 16 1.647 0.707 -13.053 1.00 0.00 C ATOM 236 C GLU A 16 0.817 1.000 -11.810 1.00 0.00 C ATOM 237 O GLU A 16 0.627 0.126 -10.963 1.00 0.00 O ATOM 238 CB GLU A 16 0.819 -0.065 -14.078 1.00 0.00 C ATOM 239 CG GLU A 16 -0.400 0.686 -14.573 1.00 0.00 C ATOM 240 CD GLU A 16 -1.210 -0.133 -15.546 1.00 0.00 C ATOM 241 OE1 GLU A 16 -0.875 -0.133 -16.748 1.00 0.00 O ATOM 242 OE2 GLU A 16 -2.168 -0.799 -15.110 1.00 0.00 O ATOM 0 H GLU A 16 2.756 -1.056 -12.924 1.00 0.00 H new ATOM 0 HA GLU A 16 1.958 1.654 -13.493 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.452 -0.312 -14.930 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.498 -1.008 -13.635 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.025 0.963 -13.724 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -0.085 1.613 -15.053 1.00 0.00 H new ATOM 249 N ALA A 17 0.327 2.222 -11.708 1.00 0.00 N ATOM 250 CA ALA A 17 -0.424 2.651 -10.544 1.00 0.00 C ATOM 251 C ALA A 17 -1.865 2.172 -10.624 1.00 0.00 C ATOM 252 O ALA A 17 -2.560 2.425 -11.607 1.00 0.00 O ATOM 253 CB ALA A 17 -0.376 4.166 -10.412 1.00 0.00 C ATOM 0 H ALA A 17 0.437 2.940 -12.424 1.00 0.00 H new ATOM 0 HA ALA A 17 0.034 2.208 -9.660 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -0.944 4.473 -9.534 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.659 4.489 -10.306 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.809 4.623 -11.302 1.00 0.00 H new ATOM 259 N LEU A 18 -2.289 1.465 -9.593 1.00 0.00 N ATOM 260 CA LEU A 18 -3.652 0.979 -9.490 1.00 0.00 C ATOM 261 C LEU A 18 -4.298 1.575 -8.245 1.00 0.00 C ATOM 262 O LEU A 18 -3.805 1.392 -7.129 1.00 0.00 O ATOM 263 CB LEU A 18 -3.652 -0.557 -9.421 1.00 0.00 C ATOM 264 CG LEU A 18 -4.989 -1.257 -9.710 1.00 0.00 C ATOM 265 CD1 LEU A 18 -4.758 -2.741 -9.919 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.989 -1.048 -8.579 1.00 0.00 C ATOM 0 H LEU A 18 -1.697 1.211 -8.802 1.00 0.00 H new ATOM 0 HA LEU A 18 -4.224 1.282 -10.367 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.912 -0.930 -10.129 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -3.320 -0.854 -8.426 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.407 -0.816 -10.615 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.709 -3.232 -10.123 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.084 -2.889 -10.763 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.314 -3.170 -9.021 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.922 -1.558 -8.820 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.582 -1.455 -7.653 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.180 0.018 -8.454 1.00 0.00 H new ATOM 278 N VAL A 19 -5.389 2.294 -8.433 1.00 0.00 N ATOM 279 CA VAL A 19 -6.078 2.912 -7.321 1.00 0.00 C ATOM 280 C VAL A 19 -7.435 2.237 -7.099 1.00 0.00 C ATOM 281 O VAL A 19 -8.272 2.180 -8.001 1.00 0.00 O ATOM 282 CB VAL A 19 -6.224 4.444 -7.537 1.00 0.00 C ATOM 283 CG1 VAL A 19 -7.176 4.789 -8.674 1.00 0.00 C ATOM 284 CG2 VAL A 19 -6.648 5.123 -6.258 1.00 0.00 C ATOM 0 H VAL A 19 -5.815 2.463 -9.344 1.00 0.00 H new ATOM 0 HA VAL A 19 -5.482 2.772 -6.419 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.242 4.818 -7.827 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -7.239 5.872 -8.780 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -6.806 4.355 -9.603 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -8.165 4.387 -8.455 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -6.745 6.195 -6.430 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -7.607 4.720 -5.933 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -5.899 4.945 -5.486 1.00 0.00 H new ATOM 294 N THR A 20 -7.629 1.673 -5.910 1.00 0.00 N ATOM 295 CA THR A 20 -8.849 0.923 -5.624 1.00 0.00 C ATOM 296 C THR A 20 -9.898 1.803 -4.961 1.00 0.00 C ATOM 297 O THR A 20 -11.046 1.392 -4.770 1.00 0.00 O ATOM 298 CB THR A 20 -8.552 -0.304 -4.735 1.00 0.00 C ATOM 299 OG1 THR A 20 -9.701 -1.160 -4.639 1.00 0.00 O ATOM 300 CG2 THR A 20 -8.135 0.136 -3.342 1.00 0.00 C ATOM 0 H THR A 20 -6.966 1.720 -5.137 1.00 0.00 H new ATOM 0 HA THR A 20 -9.245 0.575 -6.578 1.00 0.00 H new ATOM 0 HB THR A 20 -7.736 -0.859 -5.199 1.00 0.00 H new ATOM 0 HG1 THR A 20 -9.419 -2.056 -4.360 1.00 0.00 H new ATOM 0 HG21 THR A 20 -7.930 -0.742 -2.729 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.237 0.750 -3.408 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.939 0.716 -2.888 1.00 0.00 H new ATOM 308 N LYS A 21 -9.484 3.020 -4.638 1.00 0.00 N ATOM 309 CA LYS A 21 -10.370 4.056 -4.105 1.00 0.00 C ATOM 310 C LYS A 21 -10.887 3.755 -2.687 1.00 0.00 C ATOM 311 O LYS A 21 -10.625 4.521 -1.761 1.00 0.00 O ATOM 312 CB LYS A 21 -11.538 4.272 -5.079 1.00 0.00 C ATOM 313 CG LYS A 21 -12.709 5.052 -4.507 1.00 0.00 C ATOM 314 CD LYS A 21 -13.876 5.070 -5.483 1.00 0.00 C ATOM 315 CE LYS A 21 -15.129 5.649 -4.850 1.00 0.00 C ATOM 316 NZ LYS A 21 -16.262 5.702 -5.809 1.00 0.00 N ATOM 0 H LYS A 21 -8.515 3.323 -4.738 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.782 4.969 -4.013 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.166 4.796 -5.959 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.897 3.299 -5.415 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.024 4.604 -3.565 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.398 6.073 -4.286 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -13.607 5.657 -6.361 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.078 4.056 -5.828 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -15.412 5.045 -3.987 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -14.918 6.653 -4.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.098 6.103 -5.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -16.002 6.299 -6.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -16.480 4.741 -6.142 1.00 0.00 H new ATOM 330 N GLU A 22 -11.613 2.655 -2.528 1.00 0.00 N ATOM 331 CA GLU A 22 -12.302 2.347 -1.275 1.00 0.00 C ATOM 332 C GLU A 22 -11.338 1.947 -0.158 1.00 0.00 C ATOM 333 O GLU A 22 -10.178 1.609 -0.405 1.00 0.00 O ATOM 334 CB GLU A 22 -13.328 1.233 -1.500 1.00 0.00 C ATOM 335 CG GLU A 22 -14.550 1.679 -2.291 1.00 0.00 C ATOM 336 CD GLU A 22 -15.366 2.722 -1.553 1.00 0.00 C ATOM 337 OE1 GLU A 22 -15.911 2.404 -0.477 1.00 0.00 O ATOM 338 OE2 GLU A 22 -15.462 3.869 -2.042 1.00 0.00 O ATOM 0 H GLU A 22 -11.742 1.954 -3.257 1.00 0.00 H new ATOM 0 HA GLU A 22 -12.807 3.259 -0.956 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -12.847 0.408 -2.026 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -13.652 0.849 -0.533 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.230 2.084 -3.251 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -15.178 0.814 -2.503 1.00 0.00 H new ATOM 345 N TYR A 23 -11.844 1.984 1.073 1.00 0.00 N ATOM 346 CA TYR A 23 -11.060 1.631 2.248 1.00 0.00 C ATOM 347 C TYR A 23 -11.037 0.118 2.444 1.00 0.00 C ATOM 348 O TYR A 23 -11.767 -0.419 3.282 1.00 0.00 O ATOM 349 CB TYR A 23 -11.640 2.268 3.516 1.00 0.00 C ATOM 350 CG TYR A 23 -11.642 3.780 3.547 1.00 0.00 C ATOM 351 CD1 TYR A 23 -10.542 4.486 4.017 1.00 0.00 C ATOM 352 CD2 TYR A 23 -12.760 4.500 3.140 1.00 0.00 C ATOM 353 CE1 TYR A 23 -10.559 5.866 4.082 1.00 0.00 C ATOM 354 CE2 TYR A 23 -12.779 5.880 3.197 1.00 0.00 C ATOM 355 CZ TYR A 23 -11.679 6.558 3.670 1.00 0.00 C ATOM 356 OH TYR A 23 -11.700 7.933 3.746 1.00 0.00 O ATOM 0 H TYR A 23 -12.804 2.258 1.280 1.00 0.00 H new ATOM 0 HA TYR A 23 -10.050 2.005 2.082 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -12.665 1.919 3.640 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -11.074 1.906 4.374 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -9.661 3.949 4.336 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -13.628 3.972 2.773 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -9.698 6.401 4.454 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -13.653 6.424 2.872 1.00 0.00 H new ATOM 0 HH TYR A 23 -12.561 8.266 3.416 1.00 0.00 H new ATOM 366 N ILE A 24 -10.219 -0.574 1.673 1.00 0.00 N ATOM 367 CA ILE A 24 -10.108 -2.016 1.812 1.00 0.00 C ATOM 368 C ILE A 24 -8.796 -2.384 2.488 1.00 0.00 C ATOM 369 O ILE A 24 -7.745 -1.826 2.176 1.00 0.00 O ATOM 370 CB ILE A 24 -10.231 -2.756 0.459 1.00 0.00 C ATOM 371 CG1 ILE A 24 -9.177 -2.268 -0.540 1.00 0.00 C ATOM 372 CG2 ILE A 24 -11.630 -2.573 -0.114 1.00 0.00 C ATOM 373 CD1 ILE A 24 -9.159 -3.051 -1.837 1.00 0.00 C ATOM 0 H ILE A 24 -9.626 -0.167 0.950 1.00 0.00 H new ATOM 0 HA ILE A 24 -10.943 -2.338 2.434 1.00 0.00 H new ATOM 0 HB ILE A 24 -10.056 -3.817 0.637 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.360 -1.217 -0.763 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -8.193 -2.329 -0.075 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.705 -3.098 -1.066 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -12.364 -2.978 0.582 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -11.824 -1.512 -0.269 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.388 -2.649 -2.494 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -8.946 -4.099 -1.626 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -10.130 -2.969 -2.325 1.00 0.00 H new ATOM 385 N SER A 25 -8.869 -3.305 3.432 1.00 0.00 N ATOM 386 CA SER A 25 -7.694 -3.718 4.175 1.00 0.00 C ATOM 387 C SER A 25 -7.319 -5.147 3.802 1.00 0.00 C ATOM 388 O SER A 25 -8.021 -5.799 3.028 1.00 0.00 O ATOM 389 CB SER A 25 -7.956 -3.603 5.679 1.00 0.00 C ATOM 390 OG SER A 25 -6.763 -3.780 6.425 1.00 0.00 O ATOM 0 H SER A 25 -9.730 -3.781 3.702 1.00 0.00 H new ATOM 0 HA SER A 25 -6.861 -3.063 3.920 1.00 0.00 H new ATOM 0 HB2 SER A 25 -8.385 -2.626 5.902 1.00 0.00 H new ATOM 0 HB3 SER A 25 -8.690 -4.350 5.981 1.00 0.00 H new ATOM 0 HG SER A 25 -6.960 -3.700 7.382 1.00 0.00 H new ATOM 396 N PHE A 26 -6.235 -5.638 4.380 1.00 0.00 N ATOM 397 CA PHE A 26 -5.703 -6.945 4.028 1.00 0.00 C ATOM 398 C PHE A 26 -6.349 -8.049 4.854 1.00 0.00 C ATOM 399 O PHE A 26 -5.747 -9.092 5.108 1.00 0.00 O ATOM 400 CB PHE A 26 -4.187 -6.947 4.190 1.00 0.00 C ATOM 401 CG PHE A 26 -3.515 -5.938 3.308 1.00 0.00 C ATOM 402 CD1 PHE A 26 -3.452 -6.135 1.938 1.00 0.00 C ATOM 403 CD2 PHE A 26 -2.970 -4.784 3.844 1.00 0.00 C ATOM 404 CE1 PHE A 26 -2.852 -5.200 1.118 1.00 0.00 C ATOM 405 CE2 PHE A 26 -2.371 -3.844 3.028 1.00 0.00 C ATOM 406 CZ PHE A 26 -2.311 -4.054 1.665 1.00 0.00 C ATOM 0 H PHE A 26 -5.703 -5.148 5.099 1.00 0.00 H new ATOM 0 HA PHE A 26 -5.942 -7.147 2.984 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -3.936 -6.740 5.230 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -3.801 -7.940 3.960 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -3.877 -7.029 1.507 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.013 -4.617 4.910 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -2.806 -5.365 0.052 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -1.950 -2.946 3.456 1.00 0.00 H new ATOM 0 HZ PHE A 26 -1.840 -3.321 1.026 1.00 0.00 H new ATOM 416 N LEU A 27 -7.599 -7.811 5.245 1.00 0.00 N ATOM 417 CA LEU A 27 -8.428 -8.833 5.875 1.00 0.00 C ATOM 418 C LEU A 27 -8.692 -9.942 4.855 1.00 0.00 C ATOM 419 O LEU A 27 -9.009 -11.081 5.198 1.00 0.00 O ATOM 420 CB LEU A 27 -9.761 -8.214 6.322 1.00 0.00 C ATOM 421 CG LEU A 27 -10.180 -8.472 7.774 1.00 0.00 C ATOM 422 CD1 LEU A 27 -10.259 -9.963 8.066 1.00 0.00 C ATOM 423 CD2 LEU A 27 -9.225 -7.783 8.736 1.00 0.00 C ATOM 0 H LEU A 27 -8.063 -6.909 5.134 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.918 -9.242 6.747 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -9.705 -7.136 6.169 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.548 -8.589 5.668 1.00 0.00 H new ATOM 0 HG LEU A 27 -11.175 -8.052 7.918 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.558 -10.115 9.103 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.992 -10.425 7.405 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.283 -10.419 7.899 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -9.539 -7.977 9.762 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.216 -8.168 8.586 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -9.235 -6.709 8.551 1.00 0.00 H new ATOM 435 N GLY A 28 -8.551 -9.564 3.592 1.00 0.00 N ATOM 436 CA GLY A 28 -8.756 -10.465 2.483 1.00 0.00 C ATOM 437 C GLY A 28 -8.717 -9.702 1.176 1.00 0.00 C ATOM 438 O GLY A 28 -7.765 -8.969 0.913 1.00 0.00 O ATOM 0 H GLY A 28 -8.290 -8.618 3.314 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -7.986 -11.237 2.485 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -9.716 -10.971 2.589 1.00 0.00 H new ATOM 442 N GLY A 29 -9.740 -9.873 0.357 1.00 0.00 N ATOM 443 CA GLY A 29 -9.874 -9.076 -0.844 1.00 0.00 C ATOM 444 C GLY A 29 -9.130 -9.662 -2.024 1.00 0.00 C ATOM 445 O GLY A 29 -9.648 -9.701 -3.129 1.00 0.00 O ATOM 0 H GLY A 29 -10.485 -10.554 0.503 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -10.930 -8.983 -1.096 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -9.503 -8.070 -0.650 1.00 0.00 H new ATOM 449 N ILE A 30 -7.914 -10.112 -1.786 1.00 0.00 N ATOM 450 CA ILE A 30 -7.076 -10.677 -2.835 1.00 0.00 C ATOM 451 C ILE A 30 -6.941 -12.185 -2.640 1.00 0.00 C ATOM 452 O ILE A 30 -6.780 -12.657 -1.513 1.00 0.00 O ATOM 453 CB ILE A 30 -5.670 -10.032 -2.830 1.00 0.00 C ATOM 454 CG1 ILE A 30 -5.786 -8.507 -2.912 1.00 0.00 C ATOM 455 CG2 ILE A 30 -4.830 -10.565 -3.986 1.00 0.00 C ATOM 456 CD1 ILE A 30 -4.455 -7.789 -2.815 1.00 0.00 C ATOM 0 H ILE A 30 -7.476 -10.098 -0.865 1.00 0.00 H new ATOM 0 HA ILE A 30 -7.552 -10.471 -3.794 1.00 0.00 H new ATOM 0 HB ILE A 30 -5.173 -10.295 -1.896 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -6.266 -8.238 -3.853 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.437 -8.157 -2.111 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.845 -10.099 -3.965 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.723 -11.645 -3.890 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.321 -10.332 -4.931 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.616 -6.713 -2.881 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -3.982 -8.027 -1.863 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.808 -8.109 -3.632 1.00 0.00 H new ATOM 468 N ASP A 31 -7.042 -12.935 -3.731 1.00 0.00 N ATOM 469 CA ASP A 31 -6.861 -14.384 -3.685 1.00 0.00 C ATOM 470 C ASP A 31 -5.419 -14.712 -3.320 1.00 0.00 C ATOM 471 O ASP A 31 -4.485 -14.196 -3.937 1.00 0.00 O ATOM 472 CB ASP A 31 -7.223 -15.022 -5.026 1.00 0.00 C ATOM 473 CG ASP A 31 -7.177 -16.536 -4.973 1.00 0.00 C ATOM 474 OD1 ASP A 31 -6.064 -17.104 -4.987 1.00 0.00 O ATOM 475 OD2 ASP A 31 -8.256 -17.163 -4.935 1.00 0.00 O ATOM 0 H ASP A 31 -7.248 -12.565 -4.659 1.00 0.00 H new ATOM 0 HA ASP A 31 -7.527 -14.792 -2.925 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -8.222 -14.701 -5.321 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -6.535 -14.666 -5.793 1.00 0.00 H new ATOM 480 N LYS A 32 -5.254 -15.587 -2.335 1.00 0.00 N ATOM 481 CA LYS A 32 -3.953 -15.855 -1.730 1.00 0.00 C ATOM 482 C LYS A 32 -2.932 -16.424 -2.722 1.00 0.00 C ATOM 483 O LYS A 32 -1.742 -16.139 -2.612 1.00 0.00 O ATOM 484 CB LYS A 32 -4.129 -16.792 -0.530 1.00 0.00 C ATOM 485 CG LYS A 32 -4.765 -18.132 -0.869 1.00 0.00 C ATOM 486 CD LYS A 32 -5.401 -18.769 0.357 1.00 0.00 C ATOM 487 CE LYS A 32 -5.975 -20.142 0.040 1.00 0.00 C ATOM 488 NZ LYS A 32 -4.908 -21.162 -0.133 1.00 0.00 N ATOM 0 H LYS A 32 -6.017 -16.131 -1.933 1.00 0.00 H new ATOM 0 HA LYS A 32 -3.546 -14.900 -1.397 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.154 -16.970 -0.077 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.742 -16.292 0.220 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -5.521 -17.993 -1.642 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -4.009 -18.802 -1.279 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.657 -18.859 1.148 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -6.192 -18.122 0.735 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -6.645 -20.450 0.843 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.573 -20.084 -0.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -5.333 -22.111 -0.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -4.410 -20.995 -1.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -4.233 -21.095 0.655 1.00 0.00 H new ATOM 502 N GLU A 33 -3.383 -17.213 -3.692 1.00 0.00 N ATOM 503 CA GLU A 33 -2.456 -17.813 -4.652 1.00 0.00 C ATOM 504 C GLU A 33 -2.596 -17.196 -6.039 1.00 0.00 C ATOM 505 O GLU A 33 -1.614 -17.049 -6.764 1.00 0.00 O ATOM 506 CB GLU A 33 -2.651 -19.327 -4.747 1.00 0.00 C ATOM 507 CG GLU A 33 -1.747 -20.124 -3.818 1.00 0.00 C ATOM 508 CD GLU A 33 -2.153 -20.040 -2.365 1.00 0.00 C ATOM 509 OE1 GLU A 33 -3.155 -20.682 -1.993 1.00 0.00 O ATOM 510 OE2 GLU A 33 -1.462 -19.357 -1.580 1.00 0.00 O ATOM 0 H GLU A 33 -4.365 -17.450 -3.835 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.452 -17.607 -4.280 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.690 -19.565 -4.519 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.470 -19.643 -5.774 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.751 -21.169 -4.128 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -0.724 -19.764 -3.923 1.00 0.00 H new ATOM 517 N THR A 34 -3.813 -16.839 -6.407 1.00 0.00 N ATOM 518 CA THR A 34 -4.086 -16.350 -7.748 1.00 0.00 C ATOM 519 C THR A 34 -3.731 -14.867 -7.890 1.00 0.00 C ATOM 520 O THR A 34 -3.382 -14.405 -8.979 1.00 0.00 O ATOM 521 CB THR A 34 -5.555 -16.571 -8.115 1.00 0.00 C ATOM 522 OG1 THR A 34 -6.012 -17.814 -7.555 1.00 0.00 O ATOM 523 CG2 THR A 34 -5.743 -16.598 -9.622 1.00 0.00 C ATOM 0 H THR A 34 -4.629 -16.878 -5.796 1.00 0.00 H new ATOM 0 HA THR A 34 -3.457 -16.917 -8.435 1.00 0.00 H new ATOM 0 HB THR A 34 -6.136 -15.744 -7.708 1.00 0.00 H new ATOM 0 HG1 THR A 34 -5.966 -17.769 -6.577 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.796 -16.756 -9.855 1.00 0.00 H new ATOM 0 HG22 THR A 34 -5.417 -15.649 -10.046 1.00 0.00 H new ATOM 0 HG23 THR A 34 -5.151 -17.408 -10.048 1.00 0.00 H new ATOM 531 N GLY A 35 -3.814 -14.128 -6.788 1.00 0.00 N ATOM 532 CA GLY A 35 -3.479 -12.714 -6.811 1.00 0.00 C ATOM 533 C GLY A 35 -4.562 -11.872 -7.453 1.00 0.00 C ATOM 534 O GLY A 35 -4.314 -10.741 -7.876 1.00 0.00 O ATOM 0 H GLY A 35 -4.108 -14.483 -5.878 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.310 -12.367 -5.792 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -2.544 -12.574 -7.354 1.00 0.00 H new ATOM 538 N ILE A 36 -5.764 -12.425 -7.522 1.00 0.00 N ATOM 539 CA ILE A 36 -6.898 -11.728 -8.109 1.00 0.00 C ATOM 540 C ILE A 36 -7.713 -11.049 -7.018 1.00 0.00 C ATOM 541 O ILE A 36 -8.028 -11.669 -6.000 1.00 0.00 O ATOM 542 CB ILE A 36 -7.812 -12.699 -8.897 1.00 0.00 C ATOM 543 CG1 ILE A 36 -7.042 -13.359 -10.047 1.00 0.00 C ATOM 544 CG2 ILE A 36 -9.047 -11.978 -9.425 1.00 0.00 C ATOM 545 CD1 ILE A 36 -6.521 -12.384 -11.080 1.00 0.00 C ATOM 0 H ILE A 36 -5.979 -13.360 -7.176 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.507 -10.982 -8.801 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.141 -13.480 -8.211 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -6.202 -13.918 -9.634 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -7.694 -14.080 -10.540 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -9.672 -12.682 -9.974 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -9.613 -11.566 -8.589 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -8.740 -11.170 -10.089 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -5.989 -12.929 -11.859 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.357 -11.842 -11.523 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -5.842 -11.677 -10.603 1.00 0.00 H new ATOM 557 N VAL A 37 -8.028 -9.775 -7.216 1.00 0.00 N ATOM 558 CA VAL A 37 -8.883 -9.054 -6.286 1.00 0.00 C ATOM 559 C VAL A 37 -10.326 -9.550 -6.401 1.00 0.00 C ATOM 560 O VAL A 37 -11.022 -9.304 -7.391 1.00 0.00 O ATOM 561 CB VAL A 37 -8.819 -7.521 -6.496 1.00 0.00 C ATOM 562 CG1 VAL A 37 -7.478 -6.984 -6.036 1.00 0.00 C ATOM 563 CG2 VAL A 37 -9.063 -7.150 -7.949 1.00 0.00 C ATOM 0 H VAL A 37 -7.705 -9.223 -8.010 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.512 -9.255 -5.281 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.609 -7.068 -5.897 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -7.446 -5.905 -6.189 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.342 -7.204 -4.977 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.681 -7.456 -6.610 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -9.011 -6.067 -8.062 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -8.304 -7.617 -8.576 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -10.050 -7.500 -8.253 1.00 0.00 H new ATOM 573 N LYS A 38 -10.747 -10.276 -5.383 1.00 0.00 N ATOM 574 CA LYS A 38 -12.069 -10.870 -5.334 1.00 0.00 C ATOM 575 C LYS A 38 -13.037 -9.930 -4.634 1.00 0.00 C ATOM 576 O LYS A 38 -14.247 -10.154 -4.630 1.00 0.00 O ATOM 577 CB LYS A 38 -12.001 -12.205 -4.594 1.00 0.00 C ATOM 578 CG LYS A 38 -10.996 -13.176 -5.194 1.00 0.00 C ATOM 579 CD LYS A 38 -11.427 -13.648 -6.576 1.00 0.00 C ATOM 580 CE LYS A 38 -12.591 -14.624 -6.491 1.00 0.00 C ATOM 581 NZ LYS A 38 -12.187 -15.900 -5.842 1.00 0.00 N ATOM 0 H LYS A 38 -10.177 -10.472 -4.560 1.00 0.00 H new ATOM 0 HA LYS A 38 -12.425 -11.042 -6.350 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -11.741 -12.022 -3.552 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.989 -12.666 -4.599 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.020 -12.695 -5.261 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -10.882 -14.036 -4.534 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -11.714 -12.789 -7.182 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -10.586 -14.126 -7.078 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -13.407 -14.171 -5.928 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -12.970 -14.828 -7.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -12.884 -16.639 -6.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -11.252 -16.188 -6.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -12.142 -15.766 -4.812 1.00 0.00 H new ATOM 595 N GLU A 39 -12.482 -8.888 -4.024 1.00 0.00 N ATOM 596 CA GLU A 39 -13.279 -7.866 -3.362 1.00 0.00 C ATOM 597 C GLU A 39 -13.811 -6.877 -4.394 1.00 0.00 C ATOM 598 O GLU A 39 -13.212 -6.689 -5.455 1.00 0.00 O ATOM 599 CB GLU A 39 -12.447 -7.146 -2.293 1.00 0.00 C ATOM 600 CG GLU A 39 -13.232 -6.131 -1.473 1.00 0.00 C ATOM 601 CD GLU A 39 -14.474 -6.724 -0.838 1.00 0.00 C ATOM 602 OE1 GLU A 39 -14.372 -7.284 0.269 1.00 0.00 O ATOM 603 OE2 GLU A 39 -15.562 -6.624 -1.449 1.00 0.00 O ATOM 0 H GLU A 39 -11.475 -8.730 -3.975 1.00 0.00 H new ATOM 0 HA GLU A 39 -14.125 -8.341 -2.866 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.020 -7.889 -1.619 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -11.613 -6.638 -2.778 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -12.588 -5.726 -0.692 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -13.520 -5.297 -2.114 1.00 0.00 H new ATOM 610 N ASP A 40 -14.932 -6.255 -4.079 1.00 0.00 N ATOM 611 CA ASP A 40 -15.617 -5.384 -5.015 1.00 0.00 C ATOM 612 C ASP A 40 -15.315 -3.919 -4.728 1.00 0.00 C ATOM 613 O ASP A 40 -15.276 -3.495 -3.574 1.00 0.00 O ATOM 614 CB ASP A 40 -17.123 -5.634 -4.943 1.00 0.00 C ATOM 615 CG ASP A 40 -17.915 -4.713 -5.846 1.00 0.00 C ATOM 616 OD1 ASP A 40 -17.910 -4.935 -7.075 1.00 0.00 O ATOM 617 OD2 ASP A 40 -18.565 -3.780 -5.325 1.00 0.00 O ATOM 0 H ASP A 40 -15.391 -6.339 -3.172 1.00 0.00 H new ATOM 0 HA ASP A 40 -15.258 -5.610 -6.019 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -17.328 -6.669 -5.217 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -17.459 -5.504 -3.914 1.00 0.00 H new ATOM 622 N CYS A 41 -15.089 -3.160 -5.789 1.00 0.00 N ATOM 623 CA CYS A 41 -14.860 -1.723 -5.693 1.00 0.00 C ATOM 624 C CYS A 41 -15.095 -1.083 -7.055 1.00 0.00 C ATOM 625 O CYS A 41 -15.921 -0.178 -7.201 1.00 0.00 O ATOM 626 CB CYS A 41 -13.437 -1.430 -5.191 1.00 0.00 C ATOM 627 SG CYS A 41 -12.126 -2.227 -6.147 1.00 0.00 S ATOM 0 H CYS A 41 -15.059 -3.521 -6.742 1.00 0.00 H new ATOM 0 HA CYS A 41 -15.559 -1.297 -4.973 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -13.275 -0.352 -5.205 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -13.358 -1.751 -4.152 1.00 0.00 H new ATOM 0 HG CYS A 41 -10.968 -1.844 -5.698 1.00 0.00 H new ATOM 633 N GLU A 42 -14.367 -1.583 -8.047 1.00 0.00 N ATOM 634 CA GLU A 42 -14.535 -1.175 -9.433 1.00 0.00 C ATOM 635 C GLU A 42 -13.670 -2.052 -10.329 1.00 0.00 C ATOM 636 O GLU A 42 -14.153 -2.655 -11.286 1.00 0.00 O ATOM 637 CB GLU A 42 -14.164 0.301 -9.624 1.00 0.00 C ATOM 638 CG GLU A 42 -14.325 0.782 -11.058 1.00 0.00 C ATOM 639 CD GLU A 42 -14.057 2.264 -11.217 1.00 0.00 C ATOM 640 OE1 GLU A 42 -12.883 2.673 -11.139 1.00 0.00 O ATOM 641 OE2 GLU A 42 -15.023 3.029 -11.427 1.00 0.00 O ATOM 0 H GLU A 42 -13.641 -2.286 -7.910 1.00 0.00 H new ATOM 0 HA GLU A 42 -15.584 -1.295 -9.705 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -14.787 0.912 -8.971 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -13.131 0.452 -9.311 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -13.645 0.224 -11.701 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -15.337 0.563 -11.398 1.00 0.00 H new ATOM 648 N ILE A 43 -12.391 -2.151 -9.984 1.00 0.00 N ATOM 649 CA ILE A 43 -11.434 -2.924 -10.766 1.00 0.00 C ATOM 650 C ILE A 43 -11.352 -4.356 -10.233 1.00 0.00 C ATOM 651 O ILE A 43 -10.276 -4.932 -10.081 1.00 0.00 O ATOM 652 CB ILE A 43 -10.038 -2.260 -10.729 1.00 0.00 C ATOM 653 CG1 ILE A 43 -10.178 -0.743 -10.894 1.00 0.00 C ATOM 654 CG2 ILE A 43 -9.146 -2.828 -11.828 1.00 0.00 C ATOM 655 CD1 ILE A 43 -8.870 0.008 -10.780 1.00 0.00 C ATOM 0 H ILE A 43 -11.991 -1.701 -9.161 1.00 0.00 H new ATOM 0 HA ILE A 43 -11.775 -2.951 -11.801 1.00 0.00 H new ATOM 0 HB ILE A 43 -9.575 -2.473 -9.765 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -10.623 -0.532 -11.866 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -10.869 -0.367 -10.139 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.168 -2.349 -11.787 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -9.030 -3.902 -11.684 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.601 -2.639 -12.800 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -9.051 1.075 -10.908 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -8.432 -0.171 -9.798 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -8.183 -0.339 -11.552 1.00 0.00 H new ATOM 667 N LYS A 44 -12.517 -4.927 -9.964 1.00 0.00 N ATOM 668 CA LYS A 44 -12.614 -6.288 -9.456 1.00 0.00 C ATOM 669 C LYS A 44 -12.437 -7.293 -10.590 1.00 0.00 C ATOM 670 O LYS A 44 -13.084 -7.182 -11.631 1.00 0.00 O ATOM 671 CB LYS A 44 -13.972 -6.485 -8.773 1.00 0.00 C ATOM 672 CG LYS A 44 -14.286 -7.924 -8.390 1.00 0.00 C ATOM 673 CD LYS A 44 -15.635 -8.020 -7.699 1.00 0.00 C ATOM 674 CE LYS A 44 -16.040 -9.463 -7.450 1.00 0.00 C ATOM 675 NZ LYS A 44 -17.345 -9.547 -6.746 1.00 0.00 N ATOM 0 H LYS A 44 -13.417 -4.464 -10.091 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.821 -6.454 -8.727 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.005 -5.868 -7.875 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -14.755 -6.121 -9.438 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.285 -8.550 -9.282 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.507 -8.307 -7.731 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -15.596 -7.484 -6.750 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -16.393 -7.530 -8.311 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.103 -9.994 -8.400 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.273 -9.961 -6.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.592 -10.545 -6.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.277 -9.061 -5.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -18.081 -9.093 -7.324 1.00 0.00 H new ATOM 689 N GLY A 45 -11.557 -8.263 -10.387 1.00 0.00 N ATOM 690 CA GLY A 45 -11.325 -9.277 -11.400 1.00 0.00 C ATOM 691 C GLY A 45 -9.896 -9.284 -11.908 1.00 0.00 C ATOM 692 O GLY A 45 -9.462 -10.256 -12.527 1.00 0.00 O ATOM 0 H GLY A 45 -10.999 -8.367 -9.540 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.564 -10.257 -10.988 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.003 -9.109 -12.237 1.00 0.00 H new ATOM 696 N GLU A 46 -9.162 -8.209 -11.650 1.00 0.00 N ATOM 697 CA GLU A 46 -7.777 -8.114 -12.100 1.00 0.00 C ATOM 698 C GLU A 46 -6.799 -8.598 -11.039 1.00 0.00 C ATOM 699 O GLU A 46 -7.176 -8.872 -9.898 1.00 0.00 O ATOM 700 CB GLU A 46 -7.426 -6.683 -12.501 1.00 0.00 C ATOM 701 CG GLU A 46 -7.910 -6.306 -13.886 1.00 0.00 C ATOM 702 CD GLU A 46 -7.259 -5.037 -14.386 1.00 0.00 C ATOM 703 OE1 GLU A 46 -6.008 -4.969 -14.386 1.00 0.00 O ATOM 704 OE2 GLU A 46 -7.984 -4.101 -14.771 1.00 0.00 O ATOM 0 H GLU A 46 -9.499 -7.395 -11.135 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.687 -8.763 -12.971 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.858 -5.995 -11.774 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.344 -6.557 -12.456 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.697 -7.120 -14.579 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.992 -6.176 -13.869 1.00 0.00 H new ATOM 711 N SER A 47 -5.538 -8.704 -11.434 1.00 0.00 N ATOM 712 CA SER A 47 -4.481 -9.131 -10.538 1.00 0.00 C ATOM 713 C SER A 47 -3.617 -7.942 -10.128 1.00 0.00 C ATOM 714 O SER A 47 -3.482 -6.966 -10.874 1.00 0.00 O ATOM 715 CB SER A 47 -3.627 -10.198 -11.227 1.00 0.00 C ATOM 716 OG SER A 47 -3.244 -9.783 -12.529 1.00 0.00 O ATOM 0 H SER A 47 -5.223 -8.496 -12.382 1.00 0.00 H new ATOM 0 HA SER A 47 -4.926 -9.555 -9.638 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.738 -10.398 -10.629 1.00 0.00 H new ATOM 0 HB3 SER A 47 -4.186 -11.132 -11.289 1.00 0.00 H new ATOM 0 HG SER A 47 -2.698 -10.481 -12.947 1.00 0.00 H new ATOM 722 N VAL A 48 -3.041 -8.024 -8.939 1.00 0.00 N ATOM 723 CA VAL A 48 -2.163 -6.975 -8.429 1.00 0.00 C ATOM 724 C VAL A 48 -0.697 -7.388 -8.552 1.00 0.00 C ATOM 725 O VAL A 48 0.186 -6.789 -7.941 1.00 0.00 O ATOM 726 CB VAL A 48 -2.483 -6.640 -6.956 1.00 0.00 C ATOM 727 CG1 VAL A 48 -3.864 -6.017 -6.839 1.00 0.00 C ATOM 728 CG2 VAL A 48 -2.388 -7.888 -6.087 1.00 0.00 C ATOM 0 H VAL A 48 -3.165 -8.811 -8.303 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.337 -6.085 -9.033 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.746 -5.919 -6.603 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.072 -5.788 -5.794 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.900 -5.099 -7.426 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.612 -6.717 -7.213 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.617 -7.630 -5.053 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.100 -8.633 -6.441 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.379 -8.295 -6.144 1.00 0.00 H new ATOM 738 N ALA A 49 -0.453 -8.379 -9.398 1.00 0.00 N ATOM 739 CA ALA A 49 0.852 -8.997 -9.524 1.00 0.00 C ATOM 740 C ALA A 49 1.827 -8.106 -10.275 1.00 0.00 C ATOM 741 O ALA A 49 1.837 -8.061 -11.506 1.00 0.00 O ATOM 742 CB ALA A 49 0.726 -10.347 -10.211 1.00 0.00 C ATOM 0 H ALA A 49 -1.160 -8.776 -10.017 1.00 0.00 H new ATOM 0 HA ALA A 49 1.251 -9.143 -8.520 1.00 0.00 H new ATOM 0 HB1 ALA A 49 1.712 -10.803 -10.301 1.00 0.00 H new ATOM 0 HB2 ALA A 49 0.078 -10.996 -9.622 1.00 0.00 H new ATOM 0 HB3 ALA A 49 0.297 -10.211 -11.204 1.00 0.00 H new ATOM 748 N GLY A 50 2.604 -7.364 -9.517 1.00 0.00 N ATOM 749 CA GLY A 50 3.716 -6.629 -10.086 1.00 0.00 C ATOM 750 C GLY A 50 3.372 -5.202 -10.449 1.00 0.00 C ATOM 751 O GLY A 50 4.054 -4.585 -11.270 1.00 0.00 O ATOM 0 H GLY A 50 2.489 -7.253 -8.510 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.542 -6.626 -9.374 1.00 0.00 H new ATOM 0 HA3 GLY A 50 4.066 -7.148 -10.978 1.00 0.00 H new ATOM 755 N ARG A 51 2.322 -4.670 -9.848 1.00 0.00 N ATOM 756 CA ARG A 51 1.942 -3.290 -10.083 1.00 0.00 C ATOM 757 C ARG A 51 1.890 -2.533 -8.758 1.00 0.00 C ATOM 758 O ARG A 51 2.081 -3.128 -7.692 1.00 0.00 O ATOM 759 CB ARG A 51 0.610 -3.225 -10.840 1.00 0.00 C ATOM 760 CG ARG A 51 -0.566 -3.855 -10.115 1.00 0.00 C ATOM 761 CD ARG A 51 -1.578 -4.448 -11.092 1.00 0.00 C ATOM 762 NE ARG A 51 -1.999 -3.504 -12.131 1.00 0.00 N ATOM 763 CZ ARG A 51 -3.084 -3.674 -12.900 1.00 0.00 C ATOM 764 NH1 ARG A 51 -3.875 -4.731 -12.723 1.00 0.00 N ATOM 765 NH2 ARG A 51 -3.371 -2.797 -13.856 1.00 0.00 N ATOM 0 H ARG A 51 1.720 -5.172 -9.196 1.00 0.00 H new ATOM 0 HA ARG A 51 2.691 -2.807 -10.710 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.375 -2.180 -11.045 1.00 0.00 H new ATOM 0 HB3 ARG A 51 0.732 -3.719 -11.804 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -0.205 -4.636 -9.446 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -1.056 -3.105 -9.494 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.144 -5.329 -11.565 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -2.455 -4.783 -10.538 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.433 -2.668 -12.278 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -3.657 -5.416 -12.000 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -4.699 -4.855 -13.311 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -2.765 -1.991 -14.007 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -4.197 -2.930 -14.439 1.00 0.00 H new ATOM 779 N ILE A 52 1.656 -1.236 -8.825 1.00 0.00 N ATOM 780 CA ILE A 52 1.697 -0.386 -7.641 1.00 0.00 C ATOM 781 C ILE A 52 0.286 -0.140 -7.129 1.00 0.00 C ATOM 782 O ILE A 52 -0.597 0.231 -7.894 1.00 0.00 O ATOM 783 CB ILE A 52 2.387 0.969 -7.942 1.00 0.00 C ATOM 784 CG1 ILE A 52 3.819 0.747 -8.448 1.00 0.00 C ATOM 785 CG2 ILE A 52 2.391 1.863 -6.709 1.00 0.00 C ATOM 786 CD1 ILE A 52 4.711 0.010 -7.472 1.00 0.00 C ATOM 0 H ILE A 52 1.434 -0.742 -9.690 1.00 0.00 H new ATOM 0 HA ILE A 52 2.279 -0.902 -6.878 1.00 0.00 H new ATOM 0 HB ILE A 52 1.818 1.470 -8.725 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.780 0.187 -9.382 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.267 1.714 -8.674 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.881 2.808 -6.946 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.365 2.055 -6.395 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.930 1.367 -5.902 1.00 0.00 H new ATOM 0 HD11 ILE A 52 5.705 -0.107 -7.904 1.00 0.00 H new ATOM 0 HD12 ILE A 52 4.783 0.578 -6.544 1.00 0.00 H new ATOM 0 HD13 ILE A 52 4.288 -0.973 -7.264 1.00 0.00 H new ATOM 798 N LEU A 53 0.068 -0.360 -5.843 1.00 0.00 N ATOM 799 CA LEU A 53 -1.264 -0.225 -5.271 1.00 0.00 C ATOM 800 C LEU A 53 -1.354 0.990 -4.356 1.00 0.00 C ATOM 801 O LEU A 53 -0.505 1.196 -3.485 1.00 0.00 O ATOM 802 CB LEU A 53 -1.646 -1.499 -4.510 1.00 0.00 C ATOM 803 CG LEU A 53 -2.482 -2.515 -5.299 1.00 0.00 C ATOM 804 CD1 LEU A 53 -3.858 -1.945 -5.607 1.00 0.00 C ATOM 805 CD2 LEU A 53 -1.778 -2.920 -6.584 1.00 0.00 C ATOM 0 H LEU A 53 0.791 -0.632 -5.177 1.00 0.00 H new ATOM 0 HA LEU A 53 -1.969 -0.078 -6.089 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.732 -1.989 -4.175 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.201 -1.215 -3.616 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.601 -3.406 -4.682 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -4.438 -2.678 -6.167 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -4.372 -1.711 -4.675 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.751 -1.037 -6.200 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.392 -3.641 -7.124 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -1.621 -2.039 -7.206 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.815 -3.371 -6.345 1.00 0.00 H new ATOM 817 N VAL A 54 -2.384 1.796 -4.567 1.00 0.00 N ATOM 818 CA VAL A 54 -2.596 2.993 -3.770 1.00 0.00 C ATOM 819 C VAL A 54 -3.916 2.906 -3.008 1.00 0.00 C ATOM 820 O VAL A 54 -4.973 2.669 -3.601 1.00 0.00 O ATOM 821 CB VAL A 54 -2.598 4.261 -4.651 1.00 0.00 C ATOM 822 CG1 VAL A 54 -2.766 5.515 -3.804 1.00 0.00 C ATOM 823 CG2 VAL A 54 -1.326 4.343 -5.481 1.00 0.00 C ATOM 0 H VAL A 54 -3.089 1.641 -5.288 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.771 3.061 -3.060 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.448 4.195 -5.330 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.764 6.393 -4.450 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.711 5.465 -3.263 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.944 5.586 -3.092 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -1.349 5.244 -6.094 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.461 4.377 -4.819 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.255 3.467 -6.126 1.00 0.00 H new ATOM 833 N PHE A 55 -3.843 3.085 -1.695 1.00 0.00 N ATOM 834 CA PHE A 55 -5.025 3.053 -0.836 1.00 0.00 C ATOM 835 C PHE A 55 -5.014 4.266 0.084 1.00 0.00 C ATOM 836 O PHE A 55 -3.949 4.687 0.539 1.00 0.00 O ATOM 837 CB PHE A 55 -5.036 1.799 0.061 1.00 0.00 C ATOM 838 CG PHE A 55 -4.825 0.486 -0.640 1.00 0.00 C ATOM 839 CD1 PHE A 55 -3.553 0.066 -0.990 1.00 0.00 C ATOM 840 CD2 PHE A 55 -5.898 -0.339 -0.920 1.00 0.00 C ATOM 841 CE1 PHE A 55 -3.357 -1.150 -1.614 1.00 0.00 C ATOM 842 CE2 PHE A 55 -5.708 -1.559 -1.540 1.00 0.00 C ATOM 843 CZ PHE A 55 -4.437 -1.964 -1.888 1.00 0.00 C ATOM 0 H PHE A 55 -2.970 3.256 -1.196 1.00 0.00 H new ATOM 0 HA PHE A 55 -5.901 3.047 -1.484 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -4.261 1.912 0.819 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -5.991 1.759 0.585 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -2.704 0.697 -0.772 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -6.896 -0.026 -0.651 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -2.360 -1.463 -1.887 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.555 -2.195 -1.752 1.00 0.00 H new ATOM 0 HZ PHE A 55 -4.287 -2.917 -2.374 1.00 0.00 H new ATOM 853 N PRO A 56 -6.184 4.842 0.382 1.00 0.00 N ATOM 854 CA PRO A 56 -6.293 5.885 1.399 1.00 0.00 C ATOM 855 C PRO A 56 -6.152 5.287 2.799 1.00 0.00 C ATOM 856 O PRO A 56 -5.446 5.821 3.658 1.00 0.00 O ATOM 857 CB PRO A 56 -7.696 6.455 1.185 1.00 0.00 C ATOM 858 CG PRO A 56 -8.468 5.350 0.548 1.00 0.00 C ATOM 859 CD PRO A 56 -7.483 4.542 -0.254 1.00 0.00 C ATOM 0 HA PRO A 56 -5.515 6.644 1.317 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -8.147 6.758 2.130 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -7.670 7.338 0.546 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.953 4.731 1.303 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -9.256 5.747 -0.092 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -7.712 3.477 -0.214 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -7.490 4.830 -1.305 1.00 0.00 H new ATOM 867 N GLY A 57 -6.808 4.150 2.992 1.00 0.00 N ATOM 868 CA GLY A 57 -6.771 3.441 4.249 1.00 0.00 C ATOM 869 C GLY A 57 -7.535 2.137 4.143 1.00 0.00 C ATOM 870 O GLY A 57 -8.046 1.810 3.070 1.00 0.00 O ATOM 0 H GLY A 57 -7.379 3.699 2.277 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -5.737 3.242 4.531 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -7.203 4.060 5.036 1.00 0.00 H new ATOM 969 N TYR A 66 0.275 -11.568 7.433 1.00 0.00 N ATOM 970 CA TYR A 66 0.691 -12.858 6.892 1.00 0.00 C ATOM 971 C TYR A 66 0.391 -12.974 5.397 1.00 0.00 C ATOM 972 O TYR A 66 1.149 -13.602 4.654 1.00 0.00 O ATOM 973 CB TYR A 66 0.004 -14.004 7.638 1.00 0.00 C ATOM 974 CG TYR A 66 0.397 -14.121 9.096 1.00 0.00 C ATOM 975 CD1 TYR A 66 1.677 -14.527 9.462 1.00 0.00 C ATOM 976 CD2 TYR A 66 -0.510 -13.826 10.108 1.00 0.00 C ATOM 977 CE1 TYR A 66 2.038 -14.640 10.792 1.00 0.00 C ATOM 978 CE2 TYR A 66 -0.155 -13.939 11.440 1.00 0.00 C ATOM 979 CZ TYR A 66 1.118 -14.344 11.775 1.00 0.00 C ATOM 980 OH TYR A 66 1.470 -14.457 13.100 1.00 0.00 O ATOM 0 HA TYR A 66 1.770 -12.927 7.031 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -1.076 -13.868 7.574 1.00 0.00 H new ATOM 0 HB3 TYR A 66 0.238 -14.942 7.134 1.00 0.00 H new ATOM 0 HD1 TYR A 66 2.401 -14.758 8.694 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -1.508 -13.503 9.850 1.00 0.00 H new ATOM 0 HE1 TYR A 66 3.035 -14.958 11.059 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -0.873 -13.711 12.214 1.00 0.00 H new ATOM 0 HH TYR A 66 0.707 -14.210 13.663 1.00 0.00 H new ATOM 990 N VAL A 67 -0.709 -12.366 4.954 1.00 0.00 N ATOM 991 CA VAL A 67 -1.163 -12.532 3.574 1.00 0.00 C ATOM 992 C VAL A 67 -0.222 -11.847 2.585 1.00 0.00 C ATOM 993 O VAL A 67 -0.033 -12.329 1.469 1.00 0.00 O ATOM 994 CB VAL A 67 -2.609 -12.017 3.366 1.00 0.00 C ATOM 995 CG1 VAL A 67 -3.584 -12.808 4.227 1.00 0.00 C ATOM 996 CG2 VAL A 67 -2.721 -10.528 3.663 1.00 0.00 C ATOM 0 H VAL A 67 -1.298 -11.759 5.525 1.00 0.00 H new ATOM 0 HA VAL A 67 -1.155 -13.605 3.380 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.866 -12.165 2.317 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -4.595 -12.434 4.069 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -3.540 -13.862 3.952 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.316 -12.696 5.277 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -3.749 -10.202 3.506 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -2.435 -10.341 4.698 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -2.059 -9.973 2.998 1.00 0.00 H new ATOM 1006 N LEU A 68 0.388 -10.744 3.010 1.00 0.00 N ATOM 1007 CA LEU A 68 1.314 -10.001 2.159 1.00 0.00 C ATOM 1008 C LEU A 68 2.505 -10.869 1.761 1.00 0.00 C ATOM 1009 O LEU A 68 2.970 -10.822 0.622 1.00 0.00 O ATOM 1010 CB LEU A 68 1.797 -8.738 2.875 1.00 0.00 C ATOM 1011 CG LEU A 68 0.706 -7.706 3.171 1.00 0.00 C ATOM 1012 CD1 LEU A 68 1.276 -6.530 3.949 1.00 0.00 C ATOM 1013 CD2 LEU A 68 0.063 -7.228 1.878 1.00 0.00 C ATOM 0 H LEU A 68 0.258 -10.344 3.939 1.00 0.00 H new ATOM 0 HA LEU A 68 0.783 -9.712 1.252 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.266 -9.028 3.815 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.568 -8.265 2.266 1.00 0.00 H new ATOM 0 HG LEU A 68 -0.060 -8.182 3.784 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.484 -5.808 4.149 1.00 0.00 H new ATOM 0 HD12 LEU A 68 1.691 -6.885 4.893 1.00 0.00 H new ATOM 0 HD13 LEU A 68 2.062 -6.053 3.364 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.711 -6.495 2.106 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.821 -6.770 1.242 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.383 -8.076 1.358 1.00 0.00 H new ATOM 1025 N LEU A 69 2.976 -11.676 2.702 1.00 0.00 N ATOM 1026 CA LEU A 69 4.110 -12.556 2.457 1.00 0.00 C ATOM 1027 C LEU A 69 3.708 -13.705 1.532 1.00 0.00 C ATOM 1028 O LEU A 69 4.454 -14.075 0.625 1.00 0.00 O ATOM 1029 CB LEU A 69 4.643 -13.108 3.781 1.00 0.00 C ATOM 1030 CG LEU A 69 5.878 -14.005 3.666 1.00 0.00 C ATOM 1031 CD1 LEU A 69 7.057 -13.228 3.098 1.00 0.00 C ATOM 1032 CD2 LEU A 69 6.231 -14.601 5.020 1.00 0.00 C ATOM 0 H LEU A 69 2.589 -11.739 3.644 1.00 0.00 H new ATOM 0 HA LEU A 69 4.897 -11.980 1.971 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.883 -12.270 4.435 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.848 -13.673 4.266 1.00 0.00 H new ATOM 0 HG LEU A 69 5.647 -14.820 2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 69 7.924 -13.884 3.025 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.802 -12.852 2.107 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.291 -12.390 3.755 1.00 0.00 H new ATOM 0 HD21 LEU A 69 7.111 -15.236 4.920 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.441 -13.799 5.727 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.394 -15.196 5.385 1.00 0.00 H new ATOM 1044 N ASN A 70 2.516 -14.254 1.758 1.00 0.00 N ATOM 1045 CA ASN A 70 2.019 -15.377 0.959 1.00 0.00 C ATOM 1046 C ASN A 70 1.860 -14.971 -0.501 1.00 0.00 C ATOM 1047 O ASN A 70 2.252 -15.707 -1.411 1.00 0.00 O ATOM 1048 CB ASN A 70 0.684 -15.882 1.507 1.00 0.00 C ATOM 1049 CG ASN A 70 0.243 -17.179 0.853 1.00 0.00 C ATOM 1050 OD1 ASN A 70 0.580 -18.266 1.321 1.00 0.00 O ATOM 1051 ND2 ASN A 70 -0.502 -17.078 -0.234 1.00 0.00 N ATOM 0 H ASN A 70 1.875 -13.941 2.487 1.00 0.00 H new ATOM 0 HA ASN A 70 2.751 -16.182 1.021 1.00 0.00 H new ATOM 0 HB2 ASN A 70 0.770 -16.032 2.583 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -0.081 -15.121 1.351 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -0.818 -17.920 -0.716 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -0.761 -16.158 -0.591 1.00 0.00 H new ATOM 1058 N LEU A 71 1.295 -13.793 -0.717 1.00 0.00 N ATOM 1059 CA LEU A 71 1.118 -13.263 -2.064 1.00 0.00 C ATOM 1060 C LEU A 71 2.470 -13.046 -2.738 1.00 0.00 C ATOM 1061 O LEU A 71 2.645 -13.326 -3.928 1.00 0.00 O ATOM 1062 CB LEU A 71 0.347 -11.939 -2.018 1.00 0.00 C ATOM 1063 CG LEU A 71 -1.078 -12.019 -1.465 1.00 0.00 C ATOM 1064 CD1 LEU A 71 -1.673 -10.626 -1.327 1.00 0.00 C ATOM 1065 CD2 LEU A 71 -1.949 -12.878 -2.365 1.00 0.00 C ATOM 0 H LEU A 71 0.950 -13.183 0.024 1.00 0.00 H new ATOM 0 HA LEU A 71 0.548 -13.989 -2.643 1.00 0.00 H new ATOM 0 HB2 LEU A 71 0.913 -11.231 -1.412 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.303 -11.530 -3.028 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.039 -12.479 -0.478 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.686 -10.701 -0.933 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.061 -10.035 -0.646 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -1.699 -10.143 -2.304 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.959 -12.924 -1.957 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.981 -12.443 -3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.534 -13.884 -2.421 1.00 0.00 H new ATOM 1077 N ARG A 72 3.431 -12.563 -1.962 1.00 0.00 N ATOM 1078 CA ARG A 72 4.741 -12.212 -2.489 1.00 0.00 C ATOM 1079 C ARG A 72 5.505 -13.449 -2.947 1.00 0.00 C ATOM 1080 O ARG A 72 6.140 -13.434 -3.999 1.00 0.00 O ATOM 1081 CB ARG A 72 5.543 -11.468 -1.430 1.00 0.00 C ATOM 1082 CG ARG A 72 6.772 -10.764 -1.973 1.00 0.00 C ATOM 1083 CD ARG A 72 6.402 -9.661 -2.956 1.00 0.00 C ATOM 1084 NE ARG A 72 7.510 -8.729 -3.159 1.00 0.00 N ATOM 1085 CZ ARG A 72 7.895 -8.258 -4.346 1.00 0.00 C ATOM 1086 NH1 ARG A 72 7.252 -8.618 -5.454 1.00 0.00 N ATOM 1087 NH2 ARG A 72 8.919 -7.416 -4.421 1.00 0.00 N ATOM 0 H ARG A 72 3.326 -12.405 -0.960 1.00 0.00 H new ATOM 0 HA ARG A 72 4.595 -11.567 -3.355 1.00 0.00 H new ATOM 0 HB2 ARG A 72 4.898 -10.733 -0.949 1.00 0.00 H new ATOM 0 HB3 ARG A 72 5.851 -12.174 -0.659 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.342 -10.339 -1.147 1.00 0.00 H new ATOM 0 HG3 ARG A 72 7.418 -11.490 -2.467 1.00 0.00 H new ATOM 0 HD2 ARG A 72 6.118 -10.104 -3.911 1.00 0.00 H new ATOM 0 HD3 ARG A 72 5.532 -9.119 -2.585 1.00 0.00 H new ATOM 0 HE ARG A 72 8.025 -8.417 -2.335 1.00 0.00 H new ATOM 0 HH11 ARG A 72 6.460 -9.258 -5.399 1.00 0.00 H new ATOM 0 HH12 ARG A 72 7.552 -8.254 -6.359 1.00 0.00 H new ATOM 0 HH21 ARG A 72 9.408 -7.131 -3.573 1.00 0.00 H new ATOM 0 HH22 ARG A 72 9.216 -7.054 -5.327 1.00 0.00 H new ATOM 1101 N LYS A 73 5.431 -14.526 -2.168 1.00 0.00 N ATOM 1102 CA LYS A 73 6.136 -15.759 -2.514 1.00 0.00 C ATOM 1103 C LYS A 73 5.436 -16.483 -3.664 1.00 0.00 C ATOM 1104 O LYS A 73 5.966 -17.445 -4.223 1.00 0.00 O ATOM 1105 CB LYS A 73 6.273 -16.675 -1.290 1.00 0.00 C ATOM 1106 CG LYS A 73 4.950 -17.152 -0.713 1.00 0.00 C ATOM 1107 CD LYS A 73 5.123 -17.847 0.635 1.00 0.00 C ATOM 1108 CE LYS A 73 5.676 -19.266 0.509 1.00 0.00 C ATOM 1109 NZ LYS A 73 7.096 -19.301 0.061 1.00 0.00 N ATOM 0 H LYS A 73 4.896 -14.571 -1.301 1.00 0.00 H new ATOM 0 HA LYS A 73 7.139 -15.491 -2.846 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.870 -17.544 -1.567 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.824 -16.144 -0.514 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.279 -16.301 -0.597 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.476 -17.838 -1.415 1.00 0.00 H new ATOM 0 HD2 LYS A 73 5.793 -17.256 1.259 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.161 -17.882 1.146 1.00 0.00 H new ATOM 0 HE2 LYS A 73 5.592 -19.769 1.472 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.064 -19.827 -0.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 7.591 -20.083 0.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.132 -19.444 -0.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.558 -18.401 0.302 1.00 0.00 H new ATOM 1123 N ASN A 74 4.241 -16.021 -4.009 1.00 0.00 N ATOM 1124 CA ASN A 74 3.536 -16.517 -5.179 1.00 0.00 C ATOM 1125 C ASN A 74 3.802 -15.619 -6.379 1.00 0.00 C ATOM 1126 O ASN A 74 3.560 -16.000 -7.523 1.00 0.00 O ATOM 1127 CB ASN A 74 2.035 -16.598 -4.911 1.00 0.00 C ATOM 1128 CG ASN A 74 1.619 -17.919 -4.299 1.00 0.00 C ATOM 1129 OD1 ASN A 74 1.331 -18.882 -5.012 1.00 0.00 O ATOM 1130 ND2 ASN A 74 1.587 -17.977 -2.978 1.00 0.00 N ATOM 0 H ASN A 74 3.739 -15.300 -3.491 1.00 0.00 H new ATOM 0 HA ASN A 74 3.905 -17.519 -5.398 1.00 0.00 H new ATOM 0 HB2 ASN A 74 1.745 -15.786 -4.244 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.495 -16.450 -5.846 1.00 0.00 H new ATOM 0 HD21 ASN A 74 1.316 -18.843 -2.512 1.00 0.00 H new ATOM 0 HD22 ASN A 74 1.833 -17.156 -2.425 1.00 0.00 H new ATOM 1137 N GLY A 75 4.299 -14.421 -6.102 1.00 0.00 N ATOM 1138 CA GLY A 75 4.612 -13.480 -7.157 1.00 0.00 C ATOM 1139 C GLY A 75 3.391 -12.721 -7.622 1.00 0.00 C ATOM 1140 O GLY A 75 3.428 -12.026 -8.636 1.00 0.00 O ATOM 0 H GLY A 75 4.492 -14.083 -5.159 1.00 0.00 H new ATOM 0 HA2 GLY A 75 5.363 -12.775 -6.802 1.00 0.00 H new ATOM 0 HA3 GLY A 75 5.049 -14.014 -8.001 1.00 0.00 H new ATOM 1144 N VAL A 76 2.312 -12.841 -6.863 1.00 0.00 N ATOM 1145 CA VAL A 76 1.049 -12.213 -7.221 1.00 0.00 C ATOM 1146 C VAL A 76 0.764 -11.010 -6.328 1.00 0.00 C ATOM 1147 O VAL A 76 -0.348 -10.487 -6.303 1.00 0.00 O ATOM 1148 CB VAL A 76 -0.119 -13.214 -7.128 1.00 0.00 C ATOM 1149 CG1 VAL A 76 0.064 -14.332 -8.140 1.00 0.00 C ATOM 1150 CG2 VAL A 76 -0.239 -13.780 -5.721 1.00 0.00 C ATOM 0 H VAL A 76 2.286 -13.370 -5.991 1.00 0.00 H new ATOM 0 HA VAL A 76 1.138 -11.875 -8.253 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.043 -12.684 -7.357 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.768 -15.032 -8.063 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.093 -13.912 -9.145 1.00 0.00 H new ATOM 0 HG13 VAL A 76 0.998 -14.856 -7.939 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.070 -14.484 -5.682 1.00 0.00 H new ATOM 0 HG22 VAL A 76 0.685 -14.294 -5.456 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -0.417 -12.968 -5.016 1.00 0.00 H new ATOM 1160 N ALA A 77 1.786 -10.573 -5.607 1.00 0.00 N ATOM 1161 CA ALA A 77 1.659 -9.431 -4.716 1.00 0.00 C ATOM 1162 C ALA A 77 2.039 -8.143 -5.430 1.00 0.00 C ATOM 1163 O ALA A 77 2.785 -8.168 -6.415 1.00 0.00 O ATOM 1164 CB ALA A 77 2.537 -9.619 -3.489 1.00 0.00 C ATOM 0 H ALA A 77 2.715 -10.994 -5.622 1.00 0.00 H new ATOM 0 HA ALA A 77 0.617 -9.360 -4.403 1.00 0.00 H new ATOM 0 HB1 ALA A 77 2.432 -8.757 -2.831 1.00 0.00 H new ATOM 0 HB2 ALA A 77 2.231 -10.520 -2.958 1.00 0.00 H new ATOM 0 HB3 ALA A 77 3.578 -9.715 -3.798 1.00 0.00 H new ATOM 1170 N PRO A 78 1.518 -7.004 -4.953 1.00 0.00 N ATOM 1171 CA PRO A 78 1.904 -5.692 -5.462 1.00 0.00 C ATOM 1172 C PRO A 78 3.358 -5.380 -5.134 1.00 0.00 C ATOM 1173 O PRO A 78 3.873 -5.810 -4.101 1.00 0.00 O ATOM 1174 CB PRO A 78 0.967 -4.725 -4.728 1.00 0.00 C ATOM 1175 CG PRO A 78 0.549 -5.456 -3.501 1.00 0.00 C ATOM 1176 CD PRO A 78 0.509 -6.907 -3.882 1.00 0.00 C ATOM 0 HA PRO A 78 1.822 -5.626 -6.547 1.00 0.00 H new ATOM 0 HB2 PRO A 78 1.476 -3.794 -4.479 1.00 0.00 H new ATOM 0 HB3 PRO A 78 0.107 -4.463 -5.345 1.00 0.00 H new ATOM 0 HG2 PRO A 78 1.252 -5.285 -2.686 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -0.427 -5.115 -3.157 1.00 0.00 H new ATOM 0 HD2 PRO A 78 0.755 -7.551 -3.038 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -0.480 -7.204 -4.232 1.00 0.00 H new ATOM 1184 N LYS A 79 4.021 -4.647 -6.014 1.00 0.00 N ATOM 1185 CA LYS A 79 5.414 -4.294 -5.801 1.00 0.00 C ATOM 1186 C LYS A 79 5.564 -3.327 -4.629 1.00 0.00 C ATOM 1187 O LYS A 79 6.477 -3.458 -3.816 1.00 0.00 O ATOM 1188 CB LYS A 79 6.004 -3.660 -7.054 1.00 0.00 C ATOM 1189 CG LYS A 79 6.300 -4.634 -8.180 1.00 0.00 C ATOM 1190 CD LYS A 79 7.077 -3.944 -9.287 1.00 0.00 C ATOM 1191 CE LYS A 79 7.460 -4.899 -10.403 1.00 0.00 C ATOM 1192 NZ LYS A 79 8.265 -4.212 -11.448 1.00 0.00 N ATOM 0 H LYS A 79 3.618 -4.286 -6.879 1.00 0.00 H new ATOM 0 HA LYS A 79 5.953 -5.213 -5.571 1.00 0.00 H new ATOM 0 HB2 LYS A 79 5.312 -2.901 -7.421 1.00 0.00 H new ATOM 0 HB3 LYS A 79 6.927 -3.146 -6.784 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.873 -5.479 -7.797 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.367 -5.035 -8.577 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.477 -3.131 -9.697 1.00 0.00 H new ATOM 0 HD3 LYS A 79 7.979 -3.496 -8.870 1.00 0.00 H new ATOM 0 HE2 LYS A 79 8.029 -5.733 -9.992 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.559 -5.318 -10.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 8.397 -4.849 -12.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 7.769 -3.353 -11.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 9.193 -3.953 -11.057 1.00 0.00 H new ATOM 1206 N ALA A 80 4.667 -2.352 -4.557 1.00 0.00 N ATOM 1207 CA ALA A 80 4.720 -1.340 -3.510 1.00 0.00 C ATOM 1208 C ALA A 80 3.328 -0.812 -3.199 1.00 0.00 C ATOM 1209 O ALA A 80 2.422 -0.890 -4.035 1.00 0.00 O ATOM 1210 CB ALA A 80 5.642 -0.201 -3.916 1.00 0.00 C ATOM 0 H ALA A 80 3.893 -2.241 -5.212 1.00 0.00 H new ATOM 0 HA ALA A 80 5.119 -1.804 -2.608 1.00 0.00 H new ATOM 0 HB1 ALA A 80 5.669 0.546 -3.122 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.647 -0.589 -4.084 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.272 0.258 -4.833 1.00 0.00 H new ATOM 1216 N ILE A 81 3.165 -0.280 -1.996 1.00 0.00 N ATOM 1217 CA ILE A 81 1.873 0.208 -1.541 1.00 0.00 C ATOM 1218 C ILE A 81 2.018 1.592 -0.914 1.00 0.00 C ATOM 1219 O ILE A 81 2.871 1.803 -0.050 1.00 0.00 O ATOM 1220 CB ILE A 81 1.247 -0.762 -0.511 1.00 0.00 C ATOM 1221 CG1 ILE A 81 1.111 -2.164 -1.111 1.00 0.00 C ATOM 1222 CG2 ILE A 81 -0.110 -0.248 -0.043 1.00 0.00 C ATOM 1223 CD1 ILE A 81 0.692 -3.213 -0.108 1.00 0.00 C ATOM 0 H ILE A 81 3.917 -0.175 -1.315 1.00 0.00 H new ATOM 0 HA ILE A 81 1.216 0.271 -2.408 1.00 0.00 H new ATOM 0 HB ILE A 81 1.908 -0.818 0.354 1.00 0.00 H new ATOM 0 HG12 ILE A 81 0.381 -2.135 -1.920 1.00 0.00 H new ATOM 0 HG13 ILE A 81 2.064 -2.455 -1.552 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -0.533 -0.945 0.681 1.00 0.00 H new ATOM 0 HG22 ILE A 81 0.012 0.730 0.423 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.781 -0.161 -0.898 1.00 0.00 H new ATOM 0 HD11 ILE A 81 0.616 -4.181 -0.604 1.00 0.00 H new ATOM 0 HD12 ILE A 81 1.433 -3.271 0.689 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -0.276 -2.945 0.316 1.00 0.00 H new ATOM 1235 N ILE A 82 1.202 2.539 -1.366 1.00 0.00 N ATOM 1236 CA ILE A 82 1.226 3.891 -0.816 1.00 0.00 C ATOM 1237 C ILE A 82 -0.075 4.154 -0.065 1.00 0.00 C ATOM 1238 O ILE A 82 -1.166 3.926 -0.600 1.00 0.00 O ATOM 1239 CB ILE A 82 1.399 4.976 -1.912 1.00 0.00 C ATOM 1240 CG1 ILE A 82 2.205 4.440 -3.105 1.00 0.00 C ATOM 1241 CG2 ILE A 82 2.087 6.214 -1.333 1.00 0.00 C ATOM 1242 CD1 ILE A 82 3.632 4.070 -2.770 1.00 0.00 C ATOM 0 H ILE A 82 0.518 2.397 -2.109 1.00 0.00 H new ATOM 0 HA ILE A 82 2.084 3.953 -0.147 1.00 0.00 H new ATOM 0 HB ILE A 82 0.406 5.251 -2.267 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.698 3.563 -3.507 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.212 5.193 -3.893 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.201 6.966 -2.114 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.482 6.621 -0.523 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.069 5.938 -0.949 1.00 0.00 H new ATOM 0 HD11 ILE A 82 4.132 3.701 -3.665 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.158 4.949 -2.397 1.00 0.00 H new ATOM 0 HD13 ILE A 82 3.637 3.293 -2.005 1.00 0.00 H new ATOM 1254 N ASN A 83 0.035 4.610 1.175 1.00 0.00 N ATOM 1255 CA ASN A 83 -1.141 4.857 2.005 1.00 0.00 C ATOM 1256 C ASN A 83 -1.130 6.276 2.552 1.00 0.00 C ATOM 1257 O ASN A 83 -0.083 6.915 2.602 1.00 0.00 O ATOM 1258 CB ASN A 83 -1.202 3.872 3.182 1.00 0.00 C ATOM 1259 CG ASN A 83 -1.382 2.424 2.762 1.00 0.00 C ATOM 1260 OD1 ASN A 83 -0.911 1.511 3.440 1.00 0.00 O ATOM 1261 ND2 ASN A 83 -2.069 2.201 1.653 1.00 0.00 N ATOM 0 H ASN A 83 0.924 4.817 1.630 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.018 4.718 1.372 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -0.285 3.960 3.765 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -2.025 4.155 3.838 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.224 1.245 1.333 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -2.443 2.985 1.119 1.00 0.00 H new ATOM 1268 N LYS A 84 -2.297 6.759 2.953 1.00 0.00 N ATOM 1269 CA LYS A 84 -2.400 8.049 3.626 1.00 0.00 C ATOM 1270 C LYS A 84 -2.338 7.813 5.129 1.00 0.00 C ATOM 1271 O LYS A 84 -1.775 8.606 5.886 1.00 0.00 O ATOM 1272 CB LYS A 84 -3.710 8.757 3.242 1.00 0.00 C ATOM 1273 CG LYS A 84 -3.648 10.279 3.339 1.00 0.00 C ATOM 1274 CD LYS A 84 -3.642 10.772 4.776 1.00 0.00 C ATOM 1275 CE LYS A 84 -3.346 12.261 4.847 1.00 0.00 C ATOM 1276 NZ LYS A 84 -4.347 13.069 4.105 1.00 0.00 N ATOM 0 H LYS A 84 -3.187 6.278 2.825 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.576 8.693 3.319 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.975 8.479 2.222 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -4.509 8.395 3.889 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -2.751 10.636 2.832 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -4.502 10.708 2.815 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -4.609 10.569 5.237 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -2.894 10.223 5.348 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -3.328 12.577 5.890 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -2.353 12.452 4.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -4.164 14.080 4.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -4.277 12.861 3.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -5.302 12.833 4.441 1.00 0.00 H new ATOM 1290 N LYS A 85 -2.926 6.703 5.545 1.00 0.00 N ATOM 1291 CA LYS A 85 -2.858 6.256 6.924 1.00 0.00 C ATOM 1292 C LYS A 85 -2.745 4.738 6.943 1.00 0.00 C ATOM 1293 O LYS A 85 -3.728 4.030 6.722 1.00 0.00 O ATOM 1294 CB LYS A 85 -4.099 6.714 7.695 1.00 0.00 C ATOM 1295 CG LYS A 85 -4.041 6.421 9.185 1.00 0.00 C ATOM 1296 CD LYS A 85 -5.317 6.852 9.885 1.00 0.00 C ATOM 1297 CE LYS A 85 -5.244 6.600 11.382 1.00 0.00 C ATOM 1298 NZ LYS A 85 -6.505 6.984 12.063 1.00 0.00 N ATOM 0 H LYS A 85 -3.464 6.087 4.935 1.00 0.00 H new ATOM 0 HA LYS A 85 -1.984 6.691 7.409 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -4.229 7.786 7.550 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.978 6.226 7.273 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -3.881 5.354 9.341 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -3.190 6.939 9.626 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.493 7.912 9.702 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.164 6.310 9.465 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -5.038 5.545 11.564 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -4.414 7.165 11.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -6.419 6.798 13.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -6.688 7.996 11.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -7.293 6.427 11.675 1.00 0.00 H new ATOM 1312 N THR A 86 -1.541 4.246 7.167 1.00 0.00 N ATOM 1313 CA THR A 86 -1.285 2.820 7.096 1.00 0.00 C ATOM 1314 C THR A 86 -1.368 2.184 8.483 1.00 0.00 C ATOM 1315 O THR A 86 -1.629 2.865 9.482 1.00 0.00 O ATOM 1316 CB THR A 86 0.092 2.531 6.452 1.00 0.00 C ATOM 1317 OG1 THR A 86 0.178 1.152 6.069 1.00 0.00 O ATOM 1318 CG2 THR A 86 1.235 2.869 7.401 1.00 0.00 C ATOM 0 H THR A 86 -0.725 4.813 7.400 1.00 0.00 H new ATOM 0 HA THR A 86 -2.055 2.376 6.465 1.00 0.00 H new ATOM 0 HB THR A 86 0.183 3.164 5.569 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.162 1.044 5.156 1.00 0.00 H new ATOM 0 HG21 THR A 86 2.187 2.653 6.916 1.00 0.00 H new ATOM 0 HG22 THR A 86 1.191 3.927 7.661 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.146 2.269 8.307 1.00 0.00 H new ATOM 1326 N GLU A 87 -1.149 0.880 8.542 1.00 0.00 N ATOM 1327 CA GLU A 87 -1.251 0.145 9.788 1.00 0.00 C ATOM 1328 C GLU A 87 0.062 -0.580 10.074 1.00 0.00 C ATOM 1329 O GLU A 87 0.787 -0.960 9.153 1.00 0.00 O ATOM 1330 CB GLU A 87 -2.405 -0.862 9.718 1.00 0.00 C ATOM 1331 CG GLU A 87 -3.241 -0.934 10.989 1.00 0.00 C ATOM 1332 CD GLU A 87 -2.395 -1.093 12.231 1.00 0.00 C ATOM 1333 OE1 GLU A 87 -1.928 -2.219 12.497 1.00 0.00 O ATOM 1334 OE2 GLU A 87 -2.143 -0.078 12.915 1.00 0.00 O ATOM 0 H GLU A 87 -0.898 0.308 7.735 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.451 0.849 10.596 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.054 -0.598 8.883 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.999 -1.851 9.506 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.842 -0.029 11.076 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -3.935 -1.771 10.916 1.00 0.00 H new ATOM 1341 N THR A 88 0.355 -0.771 11.353 1.00 0.00 N ATOM 1342 CA THR A 88 1.576 -1.436 11.777 1.00 0.00 C ATOM 1343 C THR A 88 1.622 -2.880 11.281 1.00 0.00 C ATOM 1344 O THR A 88 2.680 -3.369 10.882 1.00 0.00 O ATOM 1345 CB THR A 88 1.704 -1.409 13.311 1.00 0.00 C ATOM 1346 OG1 THR A 88 1.449 -0.082 13.791 1.00 0.00 O ATOM 1347 CG2 THR A 88 3.095 -1.846 13.752 1.00 0.00 C ATOM 0 H THR A 88 -0.245 -0.470 12.121 1.00 0.00 H new ATOM 0 HA THR A 88 2.414 -0.894 11.339 1.00 0.00 H new ATOM 0 HB THR A 88 0.974 -2.104 13.727 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.529 -0.066 14.768 1.00 0.00 H new ATOM 0 HG21 THR A 88 3.157 -1.818 14.840 1.00 0.00 H new ATOM 0 HG22 THR A 88 3.285 -2.861 13.404 1.00 0.00 H new ATOM 0 HG23 THR A 88 3.840 -1.172 13.328 1.00 0.00 H new ATOM 1355 N ILE A 89 0.475 -3.557 11.279 1.00 0.00 N ATOM 1356 CA ILE A 89 0.414 -4.934 10.798 1.00 0.00 C ATOM 1357 C ILE A 89 0.756 -5.013 9.309 1.00 0.00 C ATOM 1358 O ILE A 89 1.299 -6.014 8.836 1.00 0.00 O ATOM 1359 CB ILE A 89 -0.968 -5.587 11.065 1.00 0.00 C ATOM 1360 CG1 ILE A 89 -2.114 -4.780 10.443 1.00 0.00 C ATOM 1361 CG2 ILE A 89 -1.196 -5.755 12.556 1.00 0.00 C ATOM 1362 CD1 ILE A 89 -2.530 -5.263 9.069 1.00 0.00 C ATOM 0 H ILE A 89 -0.416 -3.179 11.602 1.00 0.00 H new ATOM 0 HA ILE A 89 1.160 -5.495 11.361 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.960 -6.568 10.590 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.977 -4.821 11.108 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.813 -3.735 10.374 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.170 -6.214 12.726 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.417 -6.392 12.974 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.166 -4.779 13.041 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -3.345 -4.642 8.696 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -1.682 -5.196 8.388 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.863 -6.299 9.133 1.00 0.00 H new ATOM 1374 N ILE A 90 0.454 -3.941 8.584 1.00 0.00 N ATOM 1375 CA ILE A 90 0.782 -3.856 7.169 1.00 0.00 C ATOM 1376 C ILE A 90 2.287 -3.683 7.008 1.00 0.00 C ATOM 1377 O ILE A 90 2.915 -4.322 6.164 1.00 0.00 O ATOM 1378 CB ILE A 90 0.048 -2.677 6.487 1.00 0.00 C ATOM 1379 CG1 ILE A 90 -1.467 -2.828 6.648 1.00 0.00 C ATOM 1380 CG2 ILE A 90 0.424 -2.596 5.013 1.00 0.00 C ATOM 1381 CD1 ILE A 90 -2.257 -1.672 6.074 1.00 0.00 C ATOM 0 H ILE A 90 -0.019 -3.117 8.956 1.00 0.00 H new ATOM 0 HA ILE A 90 0.457 -4.779 6.688 1.00 0.00 H new ATOM 0 HB ILE A 90 0.356 -1.750 6.971 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.785 -3.751 6.163 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.703 -2.927 7.707 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.101 -1.761 4.549 1.00 0.00 H new ATOM 0 HG22 ILE A 90 1.499 -2.445 4.920 1.00 0.00 H new ATOM 0 HG23 ILE A 90 0.143 -3.524 4.514 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.322 -1.849 6.225 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -1.968 -0.749 6.576 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.051 -1.585 5.007 1.00 0.00 H new ATOM 1393 N ALA A 91 2.855 -2.832 7.855 1.00 0.00 N ATOM 1394 CA ALA A 91 4.283 -2.547 7.827 1.00 0.00 C ATOM 1395 C ALA A 91 5.103 -3.811 8.050 1.00 0.00 C ATOM 1396 O ALA A 91 6.102 -4.040 7.368 1.00 0.00 O ATOM 1397 CB ALA A 91 4.625 -1.503 8.878 1.00 0.00 C ATOM 0 H ALA A 91 2.342 -2.324 8.575 1.00 0.00 H new ATOM 0 HA ALA A 91 4.533 -2.157 6.840 1.00 0.00 H new ATOM 0 HB1 ALA A 91 5.695 -1.296 8.850 1.00 0.00 H new ATOM 0 HB2 ALA A 91 4.072 -0.586 8.673 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.353 -1.878 9.865 1.00 0.00 H new ATOM 1403 N VAL A 92 4.672 -4.630 9.004 1.00 0.00 N ATOM 1404 CA VAL A 92 5.358 -5.882 9.308 1.00 0.00 C ATOM 1405 C VAL A 92 5.325 -6.824 8.108 1.00 0.00 C ATOM 1406 O VAL A 92 6.353 -7.382 7.716 1.00 0.00 O ATOM 1407 CB VAL A 92 4.732 -6.593 10.531 1.00 0.00 C ATOM 1408 CG1 VAL A 92 5.489 -7.870 10.859 1.00 0.00 C ATOM 1409 CG2 VAL A 92 4.700 -5.668 11.740 1.00 0.00 C ATOM 0 H VAL A 92 3.850 -4.449 9.581 1.00 0.00 H new ATOM 0 HA VAL A 92 6.392 -5.629 9.543 1.00 0.00 H new ATOM 0 HB VAL A 92 3.706 -6.857 10.276 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.031 -8.353 11.722 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.452 -8.545 10.004 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.527 -7.629 11.087 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.255 -6.191 12.587 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.716 -5.365 11.993 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.106 -4.785 11.507 1.00 0.00 H new ATOM 1419 N GLY A 93 4.144 -6.986 7.520 1.00 0.00 N ATOM 1420 CA GLY A 93 4.005 -7.838 6.356 1.00 0.00 C ATOM 1421 C GLY A 93 4.824 -7.342 5.180 1.00 0.00 C ATOM 1422 O GLY A 93 5.495 -8.125 4.503 1.00 0.00 O ATOM 0 H GLY A 93 3.280 -6.541 7.830 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.315 -8.851 6.611 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.955 -7.889 6.069 1.00 0.00 H new ATOM 1426 N ALA A 94 4.785 -6.035 4.950 1.00 0.00 N ATOM 1427 CA ALA A 94 5.511 -5.416 3.849 1.00 0.00 C ATOM 1428 C ALA A 94 7.021 -5.542 4.038 1.00 0.00 C ATOM 1429 O ALA A 94 7.771 -5.630 3.069 1.00 0.00 O ATOM 1430 CB ALA A 94 5.113 -3.954 3.720 1.00 0.00 C ATOM 0 H ALA A 94 4.252 -5.377 5.519 1.00 0.00 H new ATOM 0 HA ALA A 94 5.247 -5.941 2.931 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.661 -3.499 2.895 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.042 -3.884 3.527 1.00 0.00 H new ATOM 0 HB3 ALA A 94 5.350 -3.429 4.645 1.00 0.00 H new ATOM 1436 N ALA A 95 7.461 -5.555 5.290 1.00 0.00 N ATOM 1437 CA ALA A 95 8.882 -5.667 5.597 1.00 0.00 C ATOM 1438 C ALA A 95 9.410 -7.055 5.266 1.00 0.00 C ATOM 1439 O ALA A 95 10.549 -7.210 4.829 1.00 0.00 O ATOM 1440 CB ALA A 95 9.135 -5.343 7.061 1.00 0.00 C ATOM 0 H ALA A 95 6.856 -5.490 6.108 1.00 0.00 H new ATOM 0 HA ALA A 95 9.416 -4.946 4.978 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.200 -5.431 7.274 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.806 -4.325 7.271 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.580 -6.040 7.689 1.00 0.00 H new ATOM 1446 N MET A 96 8.573 -8.062 5.470 1.00 0.00 N ATOM 1447 CA MET A 96 8.967 -9.444 5.226 1.00 0.00 C ATOM 1448 C MET A 96 8.853 -9.795 3.748 1.00 0.00 C ATOM 1449 O MET A 96 9.634 -10.589 3.227 1.00 0.00 O ATOM 1450 CB MET A 96 8.104 -10.400 6.050 1.00 0.00 C ATOM 1451 CG MET A 96 8.297 -10.265 7.554 1.00 0.00 C ATOM 1452 SD MET A 96 7.287 -11.425 8.497 1.00 0.00 S ATOM 1453 CE MET A 96 5.639 -10.911 8.019 1.00 0.00 C ATOM 0 H MET A 96 7.616 -7.949 5.804 1.00 0.00 H new ATOM 0 HA MET A 96 10.009 -9.550 5.528 1.00 0.00 H new ATOM 0 HB2 MET A 96 7.055 -10.224 5.811 1.00 0.00 H new ATOM 0 HB3 MET A 96 8.331 -11.424 5.755 1.00 0.00 H new ATOM 0 HG2 MET A 96 9.348 -10.425 7.796 1.00 0.00 H new ATOM 0 HG3 MET A 96 8.051 -9.247 7.857 1.00 0.00 H new ATOM 0 HE1 MET A 96 4.907 -11.370 8.684 1.00 0.00 H new ATOM 0 HE2 MET A 96 5.562 -9.826 8.088 1.00 0.00 H new ATOM 0 HE3 MET A 96 5.443 -11.224 6.993 1.00 0.00 H new ATOM 1463 N ALA A 97 7.872 -9.206 3.080 1.00 0.00 N ATOM 1464 CA ALA A 97 7.623 -9.491 1.673 1.00 0.00 C ATOM 1465 C ALA A 97 8.406 -8.554 0.751 1.00 0.00 C ATOM 1466 O ALA A 97 8.309 -8.660 -0.468 1.00 0.00 O ATOM 1467 CB ALA A 97 6.134 -9.388 1.386 1.00 0.00 C ATOM 0 H ALA A 97 7.233 -8.525 3.491 1.00 0.00 H new ATOM 0 HA ALA A 97 7.967 -10.505 1.471 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.951 -9.602 0.333 1.00 0.00 H new ATOM 0 HB2 ALA A 97 5.594 -10.108 2.002 1.00 0.00 H new ATOM 0 HB3 ALA A 97 5.788 -8.381 1.617 1.00 0.00 H new ATOM 1473 N GLU A 98 9.184 -7.651 1.339 1.00 0.00 N ATOM 1474 CA GLU A 98 9.923 -6.642 0.575 1.00 0.00 C ATOM 1475 C GLU A 98 8.961 -5.846 -0.315 1.00 0.00 C ATOM 1476 O GLU A 98 9.038 -5.876 -1.547 1.00 0.00 O ATOM 1477 CB GLU A 98 11.044 -7.285 -0.254 1.00 0.00 C ATOM 1478 CG GLU A 98 11.949 -6.279 -0.952 1.00 0.00 C ATOM 1479 CD GLU A 98 13.096 -6.938 -1.686 1.00 0.00 C ATOM 1480 OE1 GLU A 98 12.892 -7.416 -2.820 1.00 0.00 O ATOM 1481 OE2 GLU A 98 14.212 -6.985 -1.130 1.00 0.00 O ATOM 0 H GLU A 98 9.322 -7.594 2.348 1.00 0.00 H new ATOM 0 HA GLU A 98 10.393 -5.953 1.277 1.00 0.00 H new ATOM 0 HB2 GLU A 98 11.650 -7.913 0.398 1.00 0.00 H new ATOM 0 HB3 GLU A 98 10.599 -7.940 -1.003 1.00 0.00 H new ATOM 0 HG2 GLU A 98 11.359 -5.694 -1.658 1.00 0.00 H new ATOM 0 HG3 GLU A 98 12.347 -5.582 -0.215 1.00 0.00 H new ATOM 1488 N ILE A 99 8.031 -5.171 0.339 1.00 0.00 N ATOM 1489 CA ILE A 99 7.040 -4.338 -0.330 1.00 0.00 C ATOM 1490 C ILE A 99 7.117 -2.912 0.206 1.00 0.00 C ATOM 1491 O ILE A 99 6.517 -2.601 1.235 1.00 0.00 O ATOM 1492 CB ILE A 99 5.602 -4.887 -0.156 1.00 0.00 C ATOM 1493 CG1 ILE A 99 5.498 -6.307 -0.725 1.00 0.00 C ATOM 1494 CG2 ILE A 99 4.592 -3.970 -0.836 1.00 0.00 C ATOM 1495 CD1 ILE A 99 4.135 -6.941 -0.543 1.00 0.00 C ATOM 0 H ILE A 99 7.940 -5.184 1.355 1.00 0.00 H new ATOM 0 HA ILE A 99 7.268 -4.348 -1.396 1.00 0.00 H new ATOM 0 HB ILE A 99 5.375 -4.921 0.910 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.737 -6.281 -1.788 1.00 0.00 H new ATOM 0 HG13 ILE A 99 6.248 -6.936 -0.245 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.588 -4.372 -0.703 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.646 -2.976 -0.392 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.819 -3.905 -1.900 1.00 0.00 H new ATOM 0 HD11 ILE A 99 4.140 -7.944 -0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 99 3.901 -7.001 0.520 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.382 -6.335 -1.047 1.00 0.00 H new ATOM 1507 N PRO A 100 7.952 -2.065 -0.429 1.00 0.00 N ATOM 1508 CA PRO A 100 8.139 -0.664 -0.040 1.00 0.00 C ATOM 1509 C PRO A 100 6.831 0.022 0.362 1.00 0.00 C ATOM 1510 O PRO A 100 5.960 0.275 -0.474 1.00 0.00 O ATOM 1511 CB PRO A 100 8.729 -0.008 -1.302 1.00 0.00 C ATOM 1512 CG PRO A 100 8.862 -1.094 -2.327 1.00 0.00 C ATOM 1513 CD PRO A 100 8.774 -2.400 -1.591 1.00 0.00 C ATOM 0 HA PRO A 100 8.779 -0.577 0.838 1.00 0.00 H new ATOM 0 HB2 PRO A 100 8.080 0.789 -1.664 1.00 0.00 H new ATOM 0 HB3 PRO A 100 9.698 0.443 -1.087 1.00 0.00 H new ATOM 0 HG2 PRO A 100 8.073 -1.018 -3.075 1.00 0.00 H new ATOM 0 HG3 PRO A 100 9.811 -1.012 -2.856 1.00 0.00 H new ATOM 0 HD2 PRO A 100 8.314 -3.177 -2.201 1.00 0.00 H new ATOM 0 HD3 PRO A 100 9.758 -2.766 -1.298 1.00 0.00 H new ATOM 1521 N LEU A 101 6.705 0.302 1.651 1.00 0.00 N ATOM 1522 CA LEU A 101 5.503 0.902 2.203 1.00 0.00 C ATOM 1523 C LEU A 101 5.806 2.329 2.639 1.00 0.00 C ATOM 1524 O LEU A 101 6.674 2.559 3.490 1.00 0.00 O ATOM 1525 CB LEU A 101 5.020 0.064 3.398 1.00 0.00 C ATOM 1526 CG LEU A 101 3.536 0.191 3.783 1.00 0.00 C ATOM 1527 CD1 LEU A 101 3.198 1.588 4.279 1.00 0.00 C ATOM 1528 CD2 LEU A 101 2.647 -0.180 2.609 1.00 0.00 C ATOM 0 H LEU A 101 7.433 0.119 2.341 1.00 0.00 H new ATOM 0 HA LEU A 101 4.717 0.925 1.449 1.00 0.00 H new ATOM 0 HB2 LEU A 101 5.226 -0.984 3.182 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.620 0.335 4.267 1.00 0.00 H new ATOM 0 HG LEU A 101 3.352 -0.504 4.602 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.141 1.635 4.540 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.800 1.817 5.158 1.00 0.00 H new ATOM 0 HD13 LEU A 101 3.411 2.314 3.494 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.601 -0.084 2.900 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.853 0.487 1.772 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.848 -1.209 2.311 1.00 0.00 H new ATOM 1540 N VAL A 102 5.102 3.282 2.052 1.00 0.00 N ATOM 1541 CA VAL A 102 5.275 4.679 2.408 1.00 0.00 C ATOM 1542 C VAL A 102 3.925 5.335 2.683 1.00 0.00 C ATOM 1543 O VAL A 102 2.920 5.011 2.047 1.00 0.00 O ATOM 1544 CB VAL A 102 6.028 5.475 1.315 1.00 0.00 C ATOM 1545 CG1 VAL A 102 7.469 5.000 1.187 1.00 0.00 C ATOM 1546 CG2 VAL A 102 5.319 5.372 -0.023 1.00 0.00 C ATOM 0 H VAL A 102 4.405 3.113 1.327 1.00 0.00 H new ATOM 0 HA VAL A 102 5.882 4.700 3.313 1.00 0.00 H new ATOM 0 HB VAL A 102 6.037 6.522 1.619 1.00 0.00 H new ATOM 0 HG11 VAL A 102 7.975 5.576 0.412 1.00 0.00 H new ATOM 0 HG12 VAL A 102 7.984 5.140 2.137 1.00 0.00 H new ATOM 0 HG13 VAL A 102 7.481 3.943 0.920 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.870 5.941 -0.772 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.267 4.327 -0.327 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.310 5.774 0.068 1.00 0.00 H new ATOM 1556 N GLU A 103 3.911 6.241 3.645 1.00 0.00 N ATOM 1557 CA GLU A 103 2.693 6.929 4.030 1.00 0.00 C ATOM 1558 C GLU A 103 2.764 8.394 3.607 1.00 0.00 C ATOM 1559 O GLU A 103 3.687 9.116 3.981 1.00 0.00 O ATOM 1560 CB GLU A 103 2.490 6.806 5.542 1.00 0.00 C ATOM 1561 CG GLU A 103 1.148 7.313 6.028 1.00 0.00 C ATOM 1562 CD GLU A 103 0.941 7.052 7.501 1.00 0.00 C ATOM 1563 OE1 GLU A 103 1.337 7.907 8.324 1.00 0.00 O ATOM 1564 OE2 GLU A 103 0.393 5.990 7.852 1.00 0.00 O ATOM 0 H GLU A 103 4.736 6.518 4.177 1.00 0.00 H new ATOM 0 HA GLU A 103 1.842 6.471 3.527 1.00 0.00 H new ATOM 0 HB2 GLU A 103 2.597 5.760 5.828 1.00 0.00 H new ATOM 0 HB3 GLU A 103 3.281 7.358 6.050 1.00 0.00 H new ATOM 0 HG2 GLU A 103 1.074 8.383 5.836 1.00 0.00 H new ATOM 0 HG3 GLU A 103 0.352 6.832 5.460 1.00 0.00 H new ATOM 1571 N VAL A 104 1.797 8.819 2.815 1.00 0.00 N ATOM 1572 CA VAL A 104 1.774 10.175 2.289 1.00 0.00 C ATOM 1573 C VAL A 104 0.840 11.061 3.118 1.00 0.00 C ATOM 1574 O VAL A 104 -0.277 10.670 3.454 1.00 0.00 O ATOM 1575 CB VAL A 104 1.362 10.183 0.797 1.00 0.00 C ATOM 1576 CG1 VAL A 104 0.005 9.534 0.600 1.00 0.00 C ATOM 1577 CG2 VAL A 104 1.376 11.594 0.229 1.00 0.00 C ATOM 0 H VAL A 104 1.011 8.241 2.519 1.00 0.00 H new ATOM 0 HA VAL A 104 2.782 10.583 2.360 1.00 0.00 H new ATOM 0 HB VAL A 104 2.098 9.595 0.249 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -0.258 9.554 -0.458 1.00 0.00 H new ATOM 0 HG12 VAL A 104 0.042 8.501 0.945 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -0.746 10.080 1.171 1.00 0.00 H new ATOM 0 HG21 VAL A 104 1.082 11.567 -0.820 1.00 0.00 H new ATOM 0 HG22 VAL A 104 0.676 12.217 0.786 1.00 0.00 H new ATOM 0 HG23 VAL A 104 2.380 12.011 0.314 1.00 0.00 H new ATOM 1587 N ARG A 105 1.310 12.256 3.450 1.00 0.00 N ATOM 1588 CA ARG A 105 0.576 13.151 4.338 1.00 0.00 C ATOM 1589 C ARG A 105 -0.312 14.108 3.538 1.00 0.00 C ATOM 1590 O ARG A 105 -1.216 14.740 4.086 1.00 0.00 O ATOM 1591 CB ARG A 105 1.574 13.940 5.201 1.00 0.00 C ATOM 1592 CG ARG A 105 1.116 14.203 6.632 1.00 0.00 C ATOM 1593 CD ARG A 105 0.069 15.302 6.719 1.00 0.00 C ATOM 1594 NE ARG A 105 -0.330 15.553 8.102 1.00 0.00 N ATOM 1595 CZ ARG A 105 -0.944 16.662 8.524 1.00 0.00 C ATOM 1596 NH1 ARG A 105 -1.256 17.628 7.669 1.00 0.00 N ATOM 1597 NH2 ARG A 105 -1.244 16.799 9.807 1.00 0.00 N ATOM 0 H ARG A 105 2.199 12.630 3.117 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.072 12.557 4.983 1.00 0.00 H new ATOM 0 HB2 ARG A 105 2.517 13.394 5.231 1.00 0.00 H new ATOM 0 HB3 ARG A 105 1.774 14.896 4.717 1.00 0.00 H new ATOM 0 HG2 ARG A 105 0.709 13.284 7.054 1.00 0.00 H new ATOM 0 HG3 ARG A 105 1.978 14.478 7.240 1.00 0.00 H new ATOM 0 HD2 ARG A 105 0.465 16.218 6.281 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -0.805 15.020 6.132 1.00 0.00 H new ATOM 0 HE ARG A 105 -0.126 14.831 8.793 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -1.027 17.527 6.680 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -1.725 18.471 8.001 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -1.006 16.060 10.468 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -1.713 17.644 10.134 1.00 0.00 H new ATOM 1611 N ASP A 106 -0.073 14.206 2.239 1.00 0.00 N ATOM 1612 CA ASP A 106 -0.803 15.166 1.422 1.00 0.00 C ATOM 1613 C ASP A 106 -1.780 14.467 0.490 1.00 0.00 C ATOM 1614 O ASP A 106 -1.457 13.445 -0.118 1.00 0.00 O ATOM 1615 CB ASP A 106 0.159 16.030 0.617 1.00 0.00 C ATOM 1616 CG ASP A 106 -0.480 17.340 0.219 1.00 0.00 C ATOM 1617 OD1 ASP A 106 -1.258 17.364 -0.757 1.00 0.00 O ATOM 1618 OD2 ASP A 106 -0.223 18.351 0.902 1.00 0.00 O ATOM 0 H ASP A 106 0.610 13.642 1.733 1.00 0.00 H new ATOM 0 HA ASP A 106 -1.372 15.806 2.096 1.00 0.00 H new ATOM 0 HB2 ASP A 106 1.056 16.224 1.205 1.00 0.00 H new ATOM 0 HB3 ASP A 106 0.475 15.491 -0.276 1.00 0.00 H new ATOM 1623 N GLU A 107 -2.977 15.030 0.381 1.00 0.00 N ATOM 1624 CA GLU A 107 -4.046 14.431 -0.410 1.00 0.00 C ATOM 1625 C GLU A 107 -3.787 14.565 -1.910 1.00 0.00 C ATOM 1626 O GLU A 107 -4.367 13.833 -2.711 1.00 0.00 O ATOM 1627 CB GLU A 107 -5.389 15.078 -0.065 1.00 0.00 C ATOM 1628 CG GLU A 107 -6.478 14.071 0.255 1.00 0.00 C ATOM 1629 CD GLU A 107 -6.228 13.355 1.566 1.00 0.00 C ATOM 1630 OE1 GLU A 107 -5.277 12.555 1.650 1.00 0.00 O ATOM 1631 OE2 GLU A 107 -6.987 13.593 2.528 1.00 0.00 O ATOM 0 H GLU A 107 -3.233 15.907 0.834 1.00 0.00 H new ATOM 0 HA GLU A 107 -4.074 13.370 -0.164 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -5.255 15.742 0.789 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -5.711 15.697 -0.902 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -7.440 14.581 0.299 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -6.542 13.339 -0.550 1.00 0.00 H new ATOM 1638 N LYS A 108 -2.913 15.500 -2.285 1.00 0.00 N ATOM 1639 CA LYS A 108 -2.638 15.775 -3.690 1.00 0.00 C ATOM 1640 C LYS A 108 -2.135 14.544 -4.433 1.00 0.00 C ATOM 1641 O LYS A 108 -2.319 14.430 -5.645 1.00 0.00 O ATOM 1642 CB LYS A 108 -1.627 16.909 -3.820 1.00 0.00 C ATOM 1643 CG LYS A 108 -2.275 18.275 -3.931 1.00 0.00 C ATOM 1644 CD LYS A 108 -3.128 18.367 -5.185 1.00 0.00 C ATOM 1645 CE LYS A 108 -3.830 19.708 -5.302 1.00 0.00 C ATOM 1646 NZ LYS A 108 -2.872 20.837 -5.424 1.00 0.00 N ATOM 0 H LYS A 108 -2.384 16.079 -1.632 1.00 0.00 H new ATOM 0 HA LYS A 108 -3.581 16.072 -4.148 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.964 16.897 -2.955 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -1.007 16.735 -4.699 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -2.891 18.463 -3.052 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.506 19.047 -3.952 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.500 18.209 -6.062 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -3.871 17.569 -5.177 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -4.488 19.697 -6.171 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -4.461 19.863 -4.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -3.392 21.712 -5.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -2.354 20.951 -4.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -2.199 20.639 -6.192 1.00 0.00 H new ATOM 1660 N PHE A 109 -1.512 13.625 -3.712 1.00 0.00 N ATOM 1661 CA PHE A 109 -1.029 12.397 -4.320 1.00 0.00 C ATOM 1662 C PHE A 109 -2.193 11.599 -4.897 1.00 0.00 C ATOM 1663 O PHE A 109 -2.117 11.097 -6.014 1.00 0.00 O ATOM 1664 CB PHE A 109 -0.261 11.550 -3.301 1.00 0.00 C ATOM 1665 CG PHE A 109 0.249 10.253 -3.866 1.00 0.00 C ATOM 1666 CD1 PHE A 109 1.286 10.243 -4.786 1.00 0.00 C ATOM 1667 CD2 PHE A 109 -0.316 9.045 -3.487 1.00 0.00 C ATOM 1668 CE1 PHE A 109 1.751 9.055 -5.316 1.00 0.00 C ATOM 1669 CE2 PHE A 109 0.145 7.856 -4.015 1.00 0.00 C ATOM 1670 CZ PHE A 109 1.180 7.860 -4.929 1.00 0.00 C ATOM 0 H PHE A 109 -1.330 13.706 -2.712 1.00 0.00 H new ATOM 0 HA PHE A 109 -0.348 12.662 -5.128 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.581 12.128 -2.920 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.911 11.337 -2.453 1.00 0.00 H new ATOM 0 HD1 PHE A 109 1.736 11.176 -5.092 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -1.125 9.034 -2.771 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.560 9.062 -6.032 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -0.304 6.921 -3.713 1.00 0.00 H new ATOM 0 HZ PHE A 109 1.542 6.929 -5.340 1.00 0.00 H new ATOM 1680 N PHE A 110 -3.285 11.526 -4.144 1.00 0.00 N ATOM 1681 CA PHE A 110 -4.443 10.724 -4.533 1.00 0.00 C ATOM 1682 C PHE A 110 -5.235 11.401 -5.643 1.00 0.00 C ATOM 1683 O PHE A 110 -5.944 10.744 -6.407 1.00 0.00 O ATOM 1684 CB PHE A 110 -5.333 10.471 -3.317 1.00 0.00 C ATOM 1685 CG PHE A 110 -4.606 9.781 -2.201 1.00 0.00 C ATOM 1686 CD1 PHE A 110 -4.493 8.400 -2.177 1.00 0.00 C ATOM 1687 CD2 PHE A 110 -4.023 10.515 -1.182 1.00 0.00 C ATOM 1688 CE1 PHE A 110 -3.803 7.767 -1.161 1.00 0.00 C ATOM 1689 CE2 PHE A 110 -3.339 9.889 -0.164 1.00 0.00 C ATOM 1690 CZ PHE A 110 -3.227 8.513 -0.153 1.00 0.00 C ATOM 0 H PHE A 110 -3.394 12.015 -3.255 1.00 0.00 H new ATOM 0 HA PHE A 110 -4.085 9.769 -4.917 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -5.727 11.421 -2.956 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -6.188 9.865 -3.617 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -4.949 7.813 -2.960 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.106 11.592 -1.186 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -3.715 6.691 -1.156 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -2.890 10.474 0.625 1.00 0.00 H new ATOM 0 HZ PHE A 110 -2.689 8.021 0.644 1.00 0.00 H new ATOM 1700 N GLU A 111 -5.116 12.716 -5.718 1.00 0.00 N ATOM 1701 CA GLU A 111 -5.729 13.482 -6.788 1.00 0.00 C ATOM 1702 C GLU A 111 -4.957 13.292 -8.091 1.00 0.00 C ATOM 1703 O GLU A 111 -5.536 13.275 -9.179 1.00 0.00 O ATOM 1704 CB GLU A 111 -5.759 14.959 -6.410 1.00 0.00 C ATOM 1705 CG GLU A 111 -7.159 15.492 -6.171 1.00 0.00 C ATOM 1706 CD GLU A 111 -8.004 15.480 -7.426 1.00 0.00 C ATOM 1707 OE1 GLU A 111 -8.666 14.458 -7.698 1.00 0.00 O ATOM 1708 OE2 GLU A 111 -8.018 16.497 -8.149 1.00 0.00 O ATOM 0 H GLU A 111 -4.596 13.278 -5.044 1.00 0.00 H new ATOM 0 HA GLU A 111 -6.749 13.127 -6.935 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -5.163 15.108 -5.510 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -5.288 15.539 -7.204 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -7.647 14.892 -5.402 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -7.096 16.511 -5.788 1.00 0.00 H new ATOM 1715 N ALA A 112 -3.647 13.128 -7.966 1.00 0.00 N ATOM 1716 CA ALA A 112 -2.780 12.982 -9.126 1.00 0.00 C ATOM 1717 C ALA A 112 -2.737 11.539 -9.621 1.00 0.00 C ATOM 1718 O ALA A 112 -2.756 11.291 -10.829 1.00 0.00 O ATOM 1719 CB ALA A 112 -1.377 13.470 -8.799 1.00 0.00 C ATOM 0 H ALA A 112 -3.161 13.093 -7.070 1.00 0.00 H new ATOM 0 HA ALA A 112 -3.194 13.593 -9.928 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -0.739 13.355 -9.675 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -1.415 14.521 -8.513 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -0.971 12.884 -7.975 1.00 0.00 H new ATOM 1725 N VAL A 113 -2.679 10.590 -8.691 1.00 0.00 N ATOM 1726 CA VAL A 113 -2.546 9.187 -9.055 1.00 0.00 C ATOM 1727 C VAL A 113 -3.881 8.601 -9.512 1.00 0.00 C ATOM 1728 O VAL A 113 -4.896 8.676 -8.815 1.00 0.00 O ATOM 1729 CB VAL A 113 -1.945 8.333 -7.906 1.00 0.00 C ATOM 1730 CG1 VAL A 113 -2.882 8.244 -6.710 1.00 0.00 C ATOM 1731 CG2 VAL A 113 -1.588 6.943 -8.409 1.00 0.00 C ATOM 0 H VAL A 113 -2.722 10.767 -7.687 1.00 0.00 H new ATOM 0 HA VAL A 113 -1.847 9.150 -9.891 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.037 8.833 -7.569 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.421 7.637 -5.931 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -3.075 9.245 -6.324 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -3.822 7.786 -7.018 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -1.168 6.357 -7.592 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.485 6.451 -8.785 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.855 7.024 -9.212 1.00 0.00 H new ATOM 1741 N LYS A 114 -3.872 8.048 -10.713 1.00 0.00 N ATOM 1742 CA LYS A 114 -5.027 7.357 -11.259 1.00 0.00 C ATOM 1743 C LYS A 114 -4.574 6.023 -11.824 1.00 0.00 C ATOM 1744 O LYS A 114 -3.410 5.878 -12.203 1.00 0.00 O ATOM 1745 CB LYS A 114 -5.703 8.201 -12.346 1.00 0.00 C ATOM 1746 CG LYS A 114 -6.279 9.511 -11.827 1.00 0.00 C ATOM 1747 CD LYS A 114 -7.401 9.266 -10.831 1.00 0.00 C ATOM 1748 CE LYS A 114 -7.807 10.540 -10.105 1.00 0.00 C ATOM 1749 NZ LYS A 114 -8.247 11.611 -11.039 1.00 0.00 N ATOM 0 H LYS A 114 -3.065 8.065 -11.336 1.00 0.00 H new ATOM 0 HA LYS A 114 -5.759 7.192 -10.468 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -4.978 8.418 -13.130 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -6.502 7.618 -12.803 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -5.490 10.095 -11.353 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -6.654 10.102 -12.663 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -8.265 8.855 -11.353 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -7.083 8.520 -10.103 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -8.614 10.316 -9.408 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.966 10.901 -9.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -8.624 12.413 -10.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -7.437 11.929 -11.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -8.988 11.240 -11.668 1.00 0.00 H new ATOM 1763 N THR A 115 -5.475 5.052 -11.860 1.00 0.00 N ATOM 1764 CA THR A 115 -5.136 3.726 -12.347 1.00 0.00 C ATOM 1765 C THR A 115 -4.713 3.775 -13.820 1.00 0.00 C ATOM 1766 O THR A 115 -5.521 4.115 -14.685 1.00 0.00 O ATOM 1767 CB THR A 115 -6.325 2.754 -12.207 1.00 0.00 C ATOM 1768 OG1 THR A 115 -6.762 2.713 -10.843 1.00 0.00 O ATOM 1769 CG2 THR A 115 -5.938 1.352 -12.657 1.00 0.00 C ATOM 0 H THR A 115 -6.444 5.158 -11.558 1.00 0.00 H new ATOM 0 HA THR A 115 -4.306 3.368 -11.738 1.00 0.00 H new ATOM 0 HB THR A 115 -7.135 3.113 -12.843 1.00 0.00 H new ATOM 0 HG1 THR A 115 -7.702 2.986 -10.792 1.00 0.00 H new ATOM 0 HG21 THR A 115 -6.794 0.686 -12.548 1.00 0.00 H new ATOM 0 HG22 THR A 115 -5.628 1.378 -13.702 1.00 0.00 H new ATOM 0 HG23 THR A 115 -5.114 0.987 -12.043 1.00 0.00 H new ATOM 1777 N GLY A 116 -3.454 3.454 -14.106 1.00 0.00 N ATOM 1778 CA GLY A 116 -3.024 3.386 -15.490 1.00 0.00 C ATOM 1779 C GLY A 116 -1.631 3.937 -15.742 1.00 0.00 C ATOM 1780 O GLY A 116 -0.932 3.456 -16.631 1.00 0.00 O ATOM 0 H GLY A 116 -2.734 3.243 -13.415 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -3.055 2.347 -15.817 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -3.736 3.935 -16.106 1.00 0.00 H new ATOM 1784 N ASP A 117 -1.217 4.943 -14.980 1.00 0.00 N ATOM 1785 CA ASP A 117 0.069 5.590 -15.240 1.00 0.00 C ATOM 1786 C ASP A 117 1.175 4.970 -14.392 1.00 0.00 C ATOM 1787 O ASP A 117 0.951 3.963 -13.720 1.00 0.00 O ATOM 1788 CB ASP A 117 -0.018 7.093 -14.995 1.00 0.00 C ATOM 1789 CG ASP A 117 0.713 7.863 -16.075 1.00 0.00 C ATOM 1790 OD1 ASP A 117 1.957 7.943 -16.015 1.00 0.00 O ATOM 1791 OD2 ASP A 117 0.042 8.365 -17.002 1.00 0.00 O ATOM 0 H ASP A 117 -1.739 5.324 -14.191 1.00 0.00 H new ATOM 0 HA ASP A 117 0.317 5.430 -16.289 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -1.063 7.401 -14.968 1.00 0.00 H new ATOM 0 HB3 ASP A 117 0.409 7.331 -14.021 1.00 0.00 H new ATOM 1796 N ARG A 118 2.364 5.567 -14.408 1.00 0.00 N ATOM 1797 CA ARG A 118 3.521 4.953 -13.771 1.00 0.00 C ATOM 1798 C ARG A 118 3.984 5.742 -12.550 1.00 0.00 C ATOM 1799 O ARG A 118 4.253 6.942 -12.628 1.00 0.00 O ATOM 1800 CB ARG A 118 4.665 4.822 -14.777 1.00 0.00 C ATOM 1801 CG ARG A 118 5.929 4.216 -14.189 1.00 0.00 C ATOM 1802 CD ARG A 118 6.986 3.977 -15.255 1.00 0.00 C ATOM 1803 NE ARG A 118 7.381 5.212 -15.933 1.00 0.00 N ATOM 1804 CZ ARG A 118 8.149 5.245 -17.026 1.00 0.00 C ATOM 1805 NH1 ARG A 118 8.553 4.112 -17.592 1.00 0.00 N ATOM 1806 NH2 ARG A 118 8.500 6.410 -17.563 1.00 0.00 N ATOM 0 H ARG A 118 2.549 6.467 -14.851 1.00 0.00 H new ATOM 0 HA ARG A 118 3.222 3.962 -13.428 1.00 0.00 H new ATOM 0 HB2 ARG A 118 4.333 4.207 -15.613 1.00 0.00 H new ATOM 0 HB3 ARG A 118 4.898 5.808 -15.179 1.00 0.00 H new ATOM 0 HG2 ARG A 118 6.329 4.880 -13.423 1.00 0.00 H new ATOM 0 HG3 ARG A 118 5.687 3.273 -13.699 1.00 0.00 H new ATOM 0 HD2 ARG A 118 7.863 3.520 -14.797 1.00 0.00 H new ATOM 0 HD3 ARG A 118 6.604 3.268 -15.990 1.00 0.00 H new ATOM 0 HE ARG A 118 7.051 6.098 -15.550 1.00 0.00 H new ATOM 0 HH11 ARG A 118 8.277 3.215 -17.192 1.00 0.00 H new ATOM 0 HH12 ARG A 118 9.139 4.139 -18.426 1.00 0.00 H new ATOM 0 HH21 ARG A 118 8.183 7.283 -17.140 1.00 0.00 H new ATOM 0 HH22 ARG A 118 9.086 6.431 -18.397 1.00 0.00 H new ATOM 1820 N VAL A 119 4.088 5.051 -11.424 1.00 0.00 N ATOM 1821 CA VAL A 119 4.594 5.652 -10.200 1.00 0.00 C ATOM 1822 C VAL A 119 5.817 4.885 -9.713 1.00 0.00 C ATOM 1823 O VAL A 119 5.746 3.683 -9.458 1.00 0.00 O ATOM 1824 CB VAL A 119 3.524 5.679 -9.082 1.00 0.00 C ATOM 1825 CG1 VAL A 119 4.079 6.305 -7.811 1.00 0.00 C ATOM 1826 CG2 VAL A 119 2.279 6.425 -9.541 1.00 0.00 C ATOM 0 H VAL A 119 3.827 4.069 -11.333 1.00 0.00 H new ATOM 0 HA VAL A 119 4.865 6.682 -10.430 1.00 0.00 H new ATOM 0 HB VAL A 119 3.246 4.648 -8.862 1.00 0.00 H new ATOM 0 HG11 VAL A 119 3.307 6.312 -7.042 1.00 0.00 H new ATOM 0 HG12 VAL A 119 4.933 5.725 -7.463 1.00 0.00 H new ATOM 0 HG13 VAL A 119 4.395 7.328 -8.017 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.542 6.431 -8.738 1.00 0.00 H new ATOM 0 HG22 VAL A 119 2.543 7.451 -9.798 1.00 0.00 H new ATOM 0 HG23 VAL A 119 1.859 5.929 -10.416 1.00 0.00 H new ATOM 1836 N VAL A 120 6.941 5.578 -9.618 1.00 0.00 N ATOM 1837 CA VAL A 120 8.164 4.983 -9.110 1.00 0.00 C ATOM 1838 C VAL A 120 8.231 5.155 -7.601 1.00 0.00 C ATOM 1839 O VAL A 120 8.361 6.273 -7.095 1.00 0.00 O ATOM 1840 CB VAL A 120 9.419 5.607 -9.757 1.00 0.00 C ATOM 1841 CG1 VAL A 120 10.684 4.938 -9.236 1.00 0.00 C ATOM 1842 CG2 VAL A 120 9.346 5.506 -11.272 1.00 0.00 C ATOM 0 H VAL A 120 7.030 6.558 -9.888 1.00 0.00 H new ATOM 0 HA VAL A 120 8.147 3.923 -9.365 1.00 0.00 H new ATOM 0 HB VAL A 120 9.454 6.662 -9.484 1.00 0.00 H new ATOM 0 HG11 VAL A 120 11.556 5.393 -9.705 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.745 5.066 -8.155 1.00 0.00 H new ATOM 0 HG13 VAL A 120 10.658 3.875 -9.474 1.00 0.00 H new ATOM 0 HG21 VAL A 120 10.239 5.951 -11.710 1.00 0.00 H new ATOM 0 HG22 VAL A 120 9.282 4.458 -11.564 1.00 0.00 H new ATOM 0 HG23 VAL A 120 8.464 6.037 -11.630 1.00 0.00 H new ATOM 1852 N VAL A 121 8.122 4.050 -6.886 1.00 0.00 N ATOM 1853 CA VAL A 121 8.116 4.087 -5.437 1.00 0.00 C ATOM 1854 C VAL A 121 9.510 3.831 -4.891 1.00 0.00 C ATOM 1855 O VAL A 121 10.022 2.715 -4.969 1.00 0.00 O ATOM 1856 CB VAL A 121 7.142 3.049 -4.849 1.00 0.00 C ATOM 1857 CG1 VAL A 121 7.067 3.174 -3.333 1.00 0.00 C ATOM 1858 CG2 VAL A 121 5.764 3.197 -5.474 1.00 0.00 C ATOM 0 H VAL A 121 8.036 3.116 -7.286 1.00 0.00 H new ATOM 0 HA VAL A 121 7.784 5.082 -5.141 1.00 0.00 H new ATOM 0 HB VAL A 121 7.519 2.054 -5.085 1.00 0.00 H new ATOM 0 HG11 VAL A 121 6.373 2.431 -2.941 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.056 3.009 -2.905 1.00 0.00 H new ATOM 0 HG13 VAL A 121 6.718 4.172 -3.067 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.089 2.455 -5.047 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.379 4.197 -5.273 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.835 3.045 -6.551 1.00 0.00 H new ATOM 1868 N ASN A 122 10.123 4.865 -4.349 1.00 0.00 N ATOM 1869 CA ASN A 122 11.447 4.745 -3.769 1.00 0.00 C ATOM 1870 C ASN A 122 11.350 4.889 -2.257 1.00 0.00 C ATOM 1871 O ASN A 122 11.256 5.999 -1.734 1.00 0.00 O ATOM 1872 CB ASN A 122 12.385 5.805 -4.366 1.00 0.00 C ATOM 1873 CG ASN A 122 13.832 5.646 -3.923 1.00 0.00 C ATOM 1874 OD1 ASN A 122 14.114 5.278 -2.785 1.00 0.00 O ATOM 1875 ND2 ASN A 122 14.762 5.917 -4.827 1.00 0.00 N ATOM 0 H ASN A 122 9.723 5.802 -4.298 1.00 0.00 H new ATOM 0 HA ASN A 122 11.861 3.764 -4.001 1.00 0.00 H new ATOM 0 HB2 ASN A 122 12.337 5.751 -5.454 1.00 0.00 H new ATOM 0 HB3 ASN A 122 12.031 6.796 -4.080 1.00 0.00 H new ATOM 0 HD21 ASN A 122 15.749 5.822 -4.588 1.00 0.00 H new ATOM 0 HD22 ASN A 122 14.491 6.220 -5.762 1.00 0.00 H new ATOM 1882 N ALA A 123 11.349 3.762 -1.560 1.00 0.00 N ATOM 1883 CA ALA A 123 11.200 3.756 -0.111 1.00 0.00 C ATOM 1884 C ALA A 123 12.550 3.892 0.577 1.00 0.00 C ATOM 1885 O ALA A 123 12.625 4.071 1.793 1.00 0.00 O ATOM 1886 CB ALA A 123 10.495 2.492 0.344 1.00 0.00 C ATOM 0 H ALA A 123 11.450 2.836 -1.976 1.00 0.00 H new ATOM 0 HA ALA A 123 10.591 4.615 0.171 1.00 0.00 H new ATOM 0 HB1 ALA A 123 10.392 2.503 1.429 1.00 0.00 H new ATOM 0 HB2 ALA A 123 9.507 2.441 -0.114 1.00 0.00 H new ATOM 0 HB3 ALA A 123 11.079 1.622 0.044 1.00 0.00 H new ATOM 1892 N ASP A 124 13.618 3.797 -0.208 1.00 0.00 N ATOM 1893 CA ASP A 124 14.963 4.033 0.303 1.00 0.00 C ATOM 1894 C ASP A 124 15.071 5.480 0.755 1.00 0.00 C ATOM 1895 O ASP A 124 15.552 5.776 1.850 1.00 0.00 O ATOM 1896 CB ASP A 124 16.021 3.768 -0.774 1.00 0.00 C ATOM 1897 CG ASP A 124 15.937 2.380 -1.378 1.00 0.00 C ATOM 1898 OD1 ASP A 124 16.413 1.418 -0.743 1.00 0.00 O ATOM 1899 OD2 ASP A 124 15.428 2.250 -2.513 1.00 0.00 O ATOM 0 H ASP A 124 13.578 3.559 -1.199 1.00 0.00 H new ATOM 0 HA ASP A 124 15.141 3.353 1.136 1.00 0.00 H new ATOM 0 HB2 ASP A 124 15.913 4.508 -1.567 1.00 0.00 H new ATOM 0 HB3 ASP A 124 17.011 3.907 -0.341 1.00 0.00 H new ATOM 1904 N GLU A 125 14.597 6.371 -0.104 1.00 0.00 N ATOM 1905 CA GLU A 125 14.614 7.797 0.165 1.00 0.00 C ATOM 1906 C GLU A 125 13.299 8.243 0.802 1.00 0.00 C ATOM 1907 O GLU A 125 13.270 9.177 1.602 1.00 0.00 O ATOM 1908 CB GLU A 125 14.835 8.563 -1.141 1.00 0.00 C ATOM 1909 CG GLU A 125 16.091 8.146 -1.892 1.00 0.00 C ATOM 1910 CD GLU A 125 17.366 8.571 -1.196 1.00 0.00 C ATOM 1911 OE1 GLU A 125 17.888 7.801 -0.364 1.00 0.00 O ATOM 1912 OE2 GLU A 125 17.864 9.675 -1.496 1.00 0.00 O ATOM 0 H GLU A 125 14.190 6.123 -1.006 1.00 0.00 H new ATOM 0 HA GLU A 125 15.427 8.009 0.859 1.00 0.00 H new ATOM 0 HB2 GLU A 125 13.970 8.416 -1.788 1.00 0.00 H new ATOM 0 HB3 GLU A 125 14.891 9.629 -0.921 1.00 0.00 H new ATOM 0 HG2 GLU A 125 16.093 7.063 -2.012 1.00 0.00 H new ATOM 0 HG3 GLU A 125 16.069 8.577 -2.893 1.00 0.00 H new ATOM 1919 N GLY A 126 12.214 7.565 0.446 1.00 0.00 N ATOM 1920 CA GLY A 126 10.899 7.967 0.911 1.00 0.00 C ATOM 1921 C GLY A 126 10.243 8.911 -0.073 1.00 0.00 C ATOM 1922 O GLY A 126 9.888 10.039 0.267 1.00 0.00 O ATOM 0 H GLY A 126 12.221 6.743 -0.157 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.272 7.086 1.048 1.00 0.00 H new ATOM 0 HA3 GLY A 126 10.985 8.452 1.884 1.00 0.00 H new ATOM 1926 N TYR A 127 10.069 8.440 -1.297 1.00 0.00 N ATOM 1927 CA TYR A 127 9.658 9.294 -2.395 1.00 0.00 C ATOM 1928 C TYR A 127 8.764 8.533 -3.360 1.00 0.00 C ATOM 1929 O TYR A 127 8.962 7.340 -3.596 1.00 0.00 O ATOM 1930 CB TYR A 127 10.896 9.802 -3.140 1.00 0.00 C ATOM 1931 CG TYR A 127 11.026 11.308 -3.178 1.00 0.00 C ATOM 1932 CD1 TYR A 127 11.666 11.997 -2.155 1.00 0.00 C ATOM 1933 CD2 TYR A 127 10.519 12.037 -4.244 1.00 0.00 C ATOM 1934 CE1 TYR A 127 11.792 13.374 -2.191 1.00 0.00 C ATOM 1935 CE2 TYR A 127 10.642 13.413 -4.289 1.00 0.00 C ATOM 1936 CZ TYR A 127 11.280 14.075 -3.262 1.00 0.00 C ATOM 1937 OH TYR A 127 11.398 15.447 -3.307 1.00 0.00 O ATOM 0 H TYR A 127 10.208 7.463 -1.554 1.00 0.00 H new ATOM 0 HA TYR A 127 9.098 10.137 -1.990 1.00 0.00 H new ATOM 0 HB2 TYR A 127 11.786 9.384 -2.669 1.00 0.00 H new ATOM 0 HB3 TYR A 127 10.870 9.425 -4.163 1.00 0.00 H new ATOM 0 HD1 TYR A 127 12.072 11.448 -1.318 1.00 0.00 H new ATOM 0 HD2 TYR A 127 10.020 11.521 -5.051 1.00 0.00 H new ATOM 0 HE1 TYR A 127 12.288 13.896 -1.386 1.00 0.00 H new ATOM 0 HE2 TYR A 127 10.240 13.967 -5.125 1.00 0.00 H new ATOM 0 HH TYR A 127 10.985 15.784 -4.129 1.00 0.00 H new ATOM 1947 N VAL A 128 7.777 9.219 -3.905 1.00 0.00 N ATOM 1948 CA VAL A 128 6.918 8.644 -4.926 1.00 0.00 C ATOM 1949 C VAL A 128 6.966 9.498 -6.188 1.00 0.00 C ATOM 1950 O VAL A 128 6.421 10.605 -6.235 1.00 0.00 O ATOM 1951 CB VAL A 128 5.459 8.477 -4.438 1.00 0.00 C ATOM 1952 CG1 VAL A 128 5.356 7.311 -3.466 1.00 0.00 C ATOM 1953 CG2 VAL A 128 4.949 9.754 -3.782 1.00 0.00 C ATOM 0 H VAL A 128 7.548 10.181 -3.656 1.00 0.00 H new ATOM 0 HA VAL A 128 7.295 7.646 -5.150 1.00 0.00 H new ATOM 0 HB VAL A 128 4.836 8.270 -5.308 1.00 0.00 H new ATOM 0 HG11 VAL A 128 4.324 7.206 -3.132 1.00 0.00 H new ATOM 0 HG12 VAL A 128 5.671 6.394 -3.963 1.00 0.00 H new ATOM 0 HG13 VAL A 128 5.999 7.497 -2.606 1.00 0.00 H new ATOM 0 HG21 VAL A 128 3.922 9.607 -3.449 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.577 9.998 -2.925 1.00 0.00 H new ATOM 0 HG23 VAL A 128 4.983 10.572 -4.502 1.00 0.00 H new ATOM 1963 N GLU A 129 7.646 8.991 -7.201 1.00 0.00 N ATOM 1964 CA GLU A 129 7.865 9.741 -8.423 1.00 0.00 C ATOM 1965 C GLU A 129 6.830 9.370 -9.473 1.00 0.00 C ATOM 1966 O GLU A 129 6.855 8.267 -10.020 1.00 0.00 O ATOM 1967 CB GLU A 129 9.275 9.474 -8.958 1.00 0.00 C ATOM 1968 CG GLU A 129 10.374 9.712 -7.931 1.00 0.00 C ATOM 1969 CD GLU A 129 11.759 9.433 -8.477 1.00 0.00 C ATOM 1970 OE1 GLU A 129 12.084 8.255 -8.727 1.00 0.00 O ATOM 1971 OE2 GLU A 129 12.538 10.393 -8.657 1.00 0.00 O ATOM 0 H GLU A 129 8.058 8.058 -7.200 1.00 0.00 H new ATOM 0 HA GLU A 129 7.764 10.803 -8.199 1.00 0.00 H new ATOM 0 HB2 GLU A 129 9.333 8.443 -9.307 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.453 10.113 -9.823 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.326 10.745 -7.587 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.197 9.078 -7.062 1.00 0.00 H new ATOM 1978 N LEU A 130 5.910 10.285 -9.740 1.00 0.00 N ATOM 1979 CA LEU A 130 4.915 10.077 -10.778 1.00 0.00 C ATOM 1980 C LEU A 130 5.519 10.404 -12.133 1.00 0.00 C ATOM 1981 O LEU A 130 5.793 11.573 -12.439 1.00 0.00 O ATOM 1982 CB LEU A 130 3.679 10.945 -10.530 1.00 0.00 C ATOM 1983 CG LEU A 130 2.587 10.839 -11.599 1.00 0.00 C ATOM 1984 CD1 LEU A 130 1.961 9.455 -11.595 1.00 0.00 C ATOM 1985 CD2 LEU A 130 1.523 11.905 -11.385 1.00 0.00 C ATOM 0 H LEU A 130 5.833 11.177 -9.252 1.00 0.00 H new ATOM 0 HA LEU A 130 4.605 9.032 -10.761 1.00 0.00 H new ATOM 0 HB2 LEU A 130 3.250 10.672 -9.566 1.00 0.00 H new ATOM 0 HB3 LEU A 130 3.994 11.986 -10.456 1.00 0.00 H new ATOM 0 HG LEU A 130 3.049 11.002 -12.573 1.00 0.00 H new ATOM 0 HD11 LEU A 130 1.188 9.403 -12.362 1.00 0.00 H new ATOM 0 HD12 LEU A 130 2.728 8.708 -11.801 1.00 0.00 H new ATOM 0 HD13 LEU A 130 1.517 9.259 -10.619 1.00 0.00 H new ATOM 0 HD21 LEU A 130 0.756 11.813 -12.154 1.00 0.00 H new ATOM 0 HD22 LEU A 130 1.069 11.774 -10.403 1.00 0.00 H new ATOM 0 HD23 LEU A 130 1.980 12.893 -11.445 1.00 0.00 H new ATOM 1997 N ILE A 131 5.732 9.380 -12.942 1.00 0.00 N ATOM 1998 CA ILE A 131 6.366 9.560 -14.232 1.00 0.00 C ATOM 1999 C ILE A 131 5.366 9.273 -15.324 1.00 0.00 C ATOM 2000 O ILE A 131 4.924 8.138 -15.495 1.00 0.00 O ATOM 2001 CB ILE A 131 7.592 8.653 -14.424 1.00 0.00 C ATOM 2002 CG1 ILE A 131 8.510 8.696 -13.195 1.00 0.00 C ATOM 2003 CG2 ILE A 131 8.362 9.065 -15.672 1.00 0.00 C ATOM 2004 CD1 ILE A 131 9.112 10.060 -12.925 1.00 0.00 C ATOM 0 H ILE A 131 5.475 8.417 -12.726 1.00 0.00 H new ATOM 0 HA ILE A 131 6.712 10.593 -14.279 1.00 0.00 H new ATOM 0 HB ILE A 131 7.239 7.629 -14.547 1.00 0.00 H new ATOM 0 HG12 ILE A 131 7.943 8.380 -12.319 1.00 0.00 H new ATOM 0 HG13 ILE A 131 9.316 7.975 -13.330 1.00 0.00 H new ATOM 0 HG21 ILE A 131 9.228 8.415 -15.796 1.00 0.00 H new ATOM 0 HG22 ILE A 131 7.714 8.978 -16.544 1.00 0.00 H new ATOM 0 HG23 ILE A 131 8.696 10.098 -15.569 1.00 0.00 H new ATOM 0 HD11 ILE A 131 9.748 10.009 -12.041 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.708 10.371 -13.783 1.00 0.00 H new ATOM 0 HD13 ILE A 131 8.314 10.783 -12.756 1.00 0.00 H new ATOM 2016 N GLU A 132 5.055 10.308 -16.068 1.00 0.00 N ATOM 2017 CA GLU A 132 3.972 10.275 -17.031 1.00 0.00 C ATOM 2018 C GLU A 132 4.319 9.391 -18.216 1.00 0.00 C ATOM 2019 O GLU A 132 5.109 9.762 -19.090 1.00 0.00 O ATOM 2020 CB GLU A 132 3.647 11.696 -17.475 1.00 0.00 C ATOM 2021 CG GLU A 132 3.136 12.562 -16.335 1.00 0.00 C ATOM 2022 CD GLU A 132 3.378 14.039 -16.555 1.00 0.00 C ATOM 2023 OE1 GLU A 132 2.504 14.717 -17.131 1.00 0.00 O ATOM 2024 OE2 GLU A 132 4.439 14.532 -16.124 1.00 0.00 O ATOM 0 H GLU A 132 5.546 11.201 -16.025 1.00 0.00 H new ATOM 0 HA GLU A 132 3.089 9.843 -16.559 1.00 0.00 H new ATOM 0 HB2 GLU A 132 4.540 12.153 -17.901 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.897 11.663 -18.266 1.00 0.00 H new ATOM 0 HG2 GLU A 132 2.067 12.390 -16.208 1.00 0.00 H new ATOM 0 HG3 GLU A 132 3.621 12.255 -15.408 1.00 0.00 H new