USER MOD reduce.3.24.130724 H: found=0, std=0, add=710, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 707 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00252) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HE2:sc= -2.64 K(o=-2.6,f=-6.8!) USER MOD Single : A 16 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.00937) USER MOD Single : A 18 LYS NZ :NH3+ 179:sc= 0.766 (180deg=0.748) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -157:sc= 1.25 (180deg=0.966) USER MOD Single : A 32 GLN : amide:sc= 1.11 K(o=1.1,f=-0.091) USER MOD Single : A 33 ASN : amide:sc= 0.314 X(o=0.31,f=0) USER MOD Single : A 44 THR OG1 : rot 150:sc= 0.16 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -150:sc= 1.19 (180deg=0.617) USER MOD Single : A 60 TYR OH : rot 170:sc= 1.39 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 170:sc= 0.112 USER MOD Single : A 66 LYS NZ :NH3+ -177:sc= 1 (180deg=0.924) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.0118 USER MOD Single : A 72 TYR OH : rot 21:sc= 0.89 USER MOD Single : A 73 SER OG : rot 180:sc= 0.0147 USER MOD Single : A 84 LYS NZ :NH3+ 168:sc= 1.1 (180deg=0.575) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.563 -0.312 9.789 1.00 0.00 N ATOM 2 CA MET A 1 14.430 0.603 9.583 1.00 0.00 C ATOM 3 C MET A 1 13.740 0.254 8.264 1.00 0.00 C ATOM 4 O MET A 1 14.094 0.769 7.201 1.00 0.00 O ATOM 5 CB MET A 1 14.853 2.080 9.684 1.00 0.00 C ATOM 6 CG MET A 1 13.718 2.986 10.163 1.00 0.00 C ATOM 7 SD MET A 1 12.266 3.071 9.089 1.00 0.00 S ATOM 8 CE MET A 1 11.362 4.361 9.975 1.00 0.00 C ATOM 0 H1 MET A 1 16.038 -0.081 10.685 1.00 0.00 H new ATOM 0 H2 MET A 1 15.216 -1.292 9.824 1.00 0.00 H new ATOM 0 H3 MET A 1 16.238 -0.212 9.004 1.00 0.00 H new ATOM 0 HA MET A 1 13.705 0.470 10.386 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.696 2.166 10.370 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.199 2.422 8.709 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.398 2.645 11.147 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.113 3.994 10.288 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.421 4.563 9.463 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.158 4.029 10.993 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.961 5.271 10.004 1.00 0.00 H new ATOM 18 N ALA A 2 12.742 -0.624 8.330 1.00 0.00 N ATOM 19 CA ALA A 2 11.816 -0.957 7.260 1.00 0.00 C ATOM 20 C ALA A 2 10.402 -0.807 7.825 1.00 0.00 C ATOM 21 O ALA A 2 10.202 -0.814 9.045 1.00 0.00 O ATOM 22 CB ALA A 2 12.082 -2.386 6.769 1.00 0.00 C ATOM 0 H ALA A 2 12.550 -1.150 9.182 1.00 0.00 H new ATOM 0 HA ALA A 2 11.940 -0.297 6.402 1.00 0.00 H new ATOM 0 HB1 ALA A 2 11.385 -2.631 5.967 1.00 0.00 H new ATOM 0 HB2 ALA A 2 13.104 -2.459 6.397 1.00 0.00 H new ATOM 0 HB3 ALA A 2 11.946 -3.085 7.594 1.00 0.00 H new ATOM 28 N LEU A 3 9.421 -0.660 6.944 1.00 0.00 N ATOM 29 CA LEU A 3 8.046 -0.319 7.269 1.00 0.00 C ATOM 30 C LEU A 3 7.292 -1.635 7.107 1.00 0.00 C ATOM 31 O LEU A 3 7.073 -2.093 5.989 1.00 0.00 O ATOM 32 CB LEU A 3 7.556 0.868 6.395 1.00 0.00 C ATOM 33 CG LEU A 3 8.475 2.106 6.560 1.00 0.00 C ATOM 34 CD1 LEU A 3 9.589 2.171 5.506 1.00 0.00 C ATOM 35 CD2 LEU A 3 7.737 3.442 6.463 1.00 0.00 C ATOM 0 H LEU A 3 9.570 -0.781 5.942 1.00 0.00 H new ATOM 0 HA LEU A 3 7.892 0.058 8.280 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.533 0.566 5.348 1.00 0.00 H new ATOM 0 HB3 LEU A 3 6.535 1.130 6.673 1.00 0.00 H new ATOM 0 HG LEU A 3 8.884 1.969 7.561 1.00 0.00 H new ATOM 0 HD11 LEU A 3 10.198 3.059 5.675 1.00 0.00 H new ATOM 0 HD12 LEU A 3 10.215 1.282 5.583 1.00 0.00 H new ATOM 0 HD13 LEU A 3 9.146 2.218 4.511 1.00 0.00 H new ATOM 0 HD21 LEU A 3 8.447 4.260 6.588 1.00 0.00 H new ATOM 0 HD22 LEU A 3 7.258 3.523 5.487 1.00 0.00 H new ATOM 0 HD23 LEU A 3 6.979 3.497 7.244 1.00 0.00 H new ATOM 47 N VAL A 4 7.000 -2.299 8.228 1.00 0.00 N ATOM 48 CA VAL A 4 6.225 -3.539 8.292 1.00 0.00 C ATOM 49 C VAL A 4 4.971 -3.215 9.102 1.00 0.00 C ATOM 50 O VAL A 4 4.748 -3.655 10.230 1.00 0.00 O ATOM 51 CB VAL A 4 7.094 -4.721 8.776 1.00 0.00 C ATOM 52 CG1 VAL A 4 6.267 -5.941 9.226 1.00 0.00 C ATOM 53 CG2 VAL A 4 8.052 -5.142 7.644 1.00 0.00 C ATOM 0 H VAL A 4 7.307 -1.977 9.146 1.00 0.00 H new ATOM 0 HA VAL A 4 5.895 -3.898 7.317 1.00 0.00 H new ATOM 0 HB VAL A 4 7.646 -4.375 9.650 1.00 0.00 H new ATOM 0 HG11 VAL A 4 6.938 -6.735 9.554 1.00 0.00 H new ATOM 0 HG12 VAL A 4 5.615 -5.654 10.051 1.00 0.00 H new ATOM 0 HG13 VAL A 4 5.662 -6.298 8.392 1.00 0.00 H new ATOM 0 HG21 VAL A 4 8.668 -5.976 7.980 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.473 -5.447 6.772 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.693 -4.301 7.378 1.00 0.00 H new ATOM 63 N LEU A 5 4.179 -2.335 8.513 1.00 0.00 N ATOM 64 CA LEU A 5 2.849 -1.931 8.906 1.00 0.00 C ATOM 65 C LEU A 5 2.325 -1.022 7.814 1.00 0.00 C ATOM 66 O LEU A 5 3.107 -0.406 7.093 1.00 0.00 O ATOM 67 CB LEU A 5 2.812 -1.212 10.258 1.00 0.00 C ATOM 68 CG LEU A 5 3.897 -0.129 10.444 1.00 0.00 C ATOM 69 CD1 LEU A 5 3.247 1.237 10.577 1.00 0.00 C ATOM 70 CD2 LEU A 5 4.751 -0.413 11.676 1.00 0.00 C ATOM 0 H LEU A 5 4.483 -1.844 7.672 1.00 0.00 H new ATOM 0 HA LEU A 5 2.230 -2.819 9.030 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.832 -0.750 10.382 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.918 -1.953 11.051 1.00 0.00 H new ATOM 0 HG LEU A 5 4.544 -0.143 9.567 1.00 0.00 H new ATOM 0 HD11 LEU A 5 4.018 1.996 10.708 1.00 0.00 H new ATOM 0 HD12 LEU A 5 2.672 1.456 9.677 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.583 1.241 11.442 1.00 0.00 H new ATOM 0 HD21 LEU A 5 5.507 0.365 11.782 1.00 0.00 H new ATOM 0 HD22 LEU A 5 4.117 -0.427 12.563 1.00 0.00 H new ATOM 0 HD23 LEU A 5 5.240 -1.381 11.564 1.00 0.00 H new ATOM 82 N VAL A 6 1.006 -0.960 7.690 1.00 0.00 N ATOM 83 CA VAL A 6 0.297 0.041 6.916 1.00 0.00 C ATOM 84 C VAL A 6 -1.181 0.002 7.321 1.00 0.00 C ATOM 85 O VAL A 6 -2.062 -0.253 6.507 1.00 0.00 O ATOM 86 CB VAL A 6 0.533 -0.151 5.402 1.00 0.00 C ATOM 87 CG1 VAL A 6 0.327 -1.609 4.970 1.00 0.00 C ATOM 88 CG2 VAL A 6 -0.262 0.828 4.526 1.00 0.00 C ATOM 0 H VAL A 6 0.383 -1.629 8.142 1.00 0.00 H new ATOM 0 HA VAL A 6 0.680 1.038 7.133 1.00 0.00 H new ATOM 0 HB VAL A 6 1.582 0.094 5.235 1.00 0.00 H new ATOM 0 HG11 VAL A 6 0.503 -1.699 3.898 1.00 0.00 H new ATOM 0 HG12 VAL A 6 1.026 -2.250 5.508 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -0.694 -1.915 5.197 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -0.046 0.634 3.475 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -1.329 0.695 4.708 1.00 0.00 H new ATOM 0 HG23 VAL A 6 0.024 1.851 4.772 1.00 0.00 H new ATOM 98 N LYS A 7 -1.498 0.172 8.600 1.00 0.00 N ATOM 99 CA LYS A 7 -2.887 0.083 9.049 1.00 0.00 C ATOM 100 C LYS A 7 -3.233 1.291 9.926 1.00 0.00 C ATOM 101 O LYS A 7 -4.167 1.204 10.725 1.00 0.00 O ATOM 102 CB LYS A 7 -3.102 -1.261 9.788 1.00 0.00 C ATOM 103 CG LYS A 7 -2.266 -1.501 11.053 1.00 0.00 C ATOM 104 CD LYS A 7 -0.928 -2.206 10.794 1.00 0.00 C ATOM 105 CE LYS A 7 0.031 -2.102 11.983 1.00 0.00 C ATOM 106 NZ LYS A 7 -0.511 -2.670 13.233 1.00 0.00 N ATOM 0 H LYS A 7 -0.823 0.370 9.338 1.00 0.00 H new ATOM 0 HA LYS A 7 -3.562 0.104 8.193 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -4.155 -1.334 10.059 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -2.896 -2.070 9.087 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -2.072 -0.543 11.535 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -2.850 -2.098 11.754 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -1.112 -3.257 10.571 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -0.457 -1.771 9.913 1.00 0.00 H new ATOM 0 HE2 LYS A 7 0.961 -2.614 11.735 1.00 0.00 H new ATOM 0 HE3 LYS A 7 0.279 -1.053 12.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 0.196 -2.581 13.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -1.374 -2.156 13.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -0.738 -3.675 13.088 1.00 0.00 H new ATOM 120 N TYR A 8 -2.693 2.474 9.623 1.00 0.00 N ATOM 121 CA TYR A 8 -2.977 3.726 10.325 1.00 0.00 C ATOM 122 C TYR A 8 -2.953 4.891 9.319 1.00 0.00 C ATOM 123 O TYR A 8 -2.583 6.018 9.646 1.00 0.00 O ATOM 124 CB TYR A 8 -1.945 3.936 11.443 1.00 0.00 C ATOM 125 CG TYR A 8 -2.095 3.019 12.641 1.00 0.00 C ATOM 126 CD1 TYR A 8 -2.904 3.416 13.718 1.00 0.00 C ATOM 127 CD2 TYR A 8 -1.405 1.798 12.711 1.00 0.00 C ATOM 128 CE1 TYR A 8 -3.012 2.616 14.867 1.00 0.00 C ATOM 129 CE2 TYR A 8 -1.505 0.996 13.861 1.00 0.00 C ATOM 130 CZ TYR A 8 -2.290 1.407 14.957 1.00 0.00 C ATOM 131 OH TYR A 8 -2.360 0.640 16.084 1.00 0.00 O ATOM 0 H TYR A 8 -2.026 2.589 8.860 1.00 0.00 H new ATOM 0 HA TYR A 8 -3.967 3.684 10.780 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -0.948 3.801 11.025 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -2.010 4.969 11.786 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -3.449 4.347 13.662 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -0.796 1.475 11.880 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -3.648 2.926 15.683 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -0.975 0.056 13.905 1.00 0.00 H new ATOM 0 HH TYR A 8 -1.801 -0.157 15.972 1.00 0.00 H new ATOM 141 N GLY A 9 -3.462 4.645 8.111 1.00 0.00 N ATOM 142 CA GLY A 9 -3.671 5.621 7.057 1.00 0.00 C ATOM 143 C GLY A 9 -2.388 6.019 6.379 1.00 0.00 C ATOM 144 O GLY A 9 -2.213 5.663 5.224 1.00 0.00 O ATOM 0 H GLY A 9 -3.753 3.708 7.833 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.357 5.210 6.317 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.147 6.507 7.476 1.00 0.00 H new ATOM 148 N THR A 10 -1.516 6.743 7.063 1.00 0.00 N ATOM 149 CA THR A 10 -0.331 7.326 6.449 1.00 0.00 C ATOM 150 C THR A 10 0.954 6.771 7.050 1.00 0.00 C ATOM 151 O THR A 10 1.834 7.536 7.452 1.00 0.00 O ATOM 152 CB THR A 10 -0.378 8.853 6.459 1.00 0.00 C ATOM 153 OG1 THR A 10 -0.790 9.339 7.726 1.00 0.00 O ATOM 154 CG2 THR A 10 -1.303 9.376 5.347 1.00 0.00 C ATOM 0 H THR A 10 -1.609 6.944 8.059 1.00 0.00 H new ATOM 0 HA THR A 10 -0.330 7.027 5.401 1.00 0.00 H new ATOM 0 HB THR A 10 0.629 9.223 6.267 1.00 0.00 H new ATOM 0 HG1 THR A 10 -0.811 10.319 7.710 1.00 0.00 H new ATOM 0 HG21 THR A 10 -1.322 10.466 5.372 1.00 0.00 H new ATOM 0 HG22 THR A 10 -0.932 9.042 4.378 1.00 0.00 H new ATOM 0 HG23 THR A 10 -2.311 8.992 5.502 1.00 0.00 H new ATOM 162 N ASP A 11 1.097 5.446 7.101 1.00 0.00 N ATOM 163 CA ASP A 11 2.143 4.841 7.915 1.00 0.00 C ATOM 164 C ASP A 11 3.067 3.872 7.147 1.00 0.00 C ATOM 165 O ASP A 11 3.604 2.935 7.739 1.00 0.00 O ATOM 166 CB ASP A 11 1.456 4.184 9.142 1.00 0.00 C ATOM 167 CG ASP A 11 0.439 3.060 8.837 1.00 0.00 C ATOM 168 OD1 ASP A 11 -0.384 3.205 7.902 1.00 0.00 O ATOM 169 OD2 ASP A 11 0.343 2.082 9.616 1.00 0.00 O ATOM 0 H ASP A 11 0.510 4.783 6.595 1.00 0.00 H new ATOM 0 HA ASP A 11 2.832 5.620 8.241 1.00 0.00 H new ATOM 0 HB2 ASP A 11 2.231 3.777 9.791 1.00 0.00 H new ATOM 0 HB3 ASP A 11 0.945 4.964 9.706 1.00 0.00 H new ATOM 174 N HIS A 12 3.413 4.160 5.881 1.00 0.00 N ATOM 175 CA HIS A 12 4.342 3.403 5.022 1.00 0.00 C ATOM 176 C HIS A 12 4.595 4.164 3.701 1.00 0.00 C ATOM 177 O HIS A 12 4.006 5.228 3.525 1.00 0.00 O ATOM 178 CB HIS A 12 3.787 1.984 4.780 1.00 0.00 C ATOM 179 CG HIS A 12 2.853 1.877 3.600 1.00 0.00 C ATOM 180 ND1 HIS A 12 2.064 2.889 3.107 1.00 0.00 N ATOM 181 CD2 HIS A 12 2.708 0.802 2.765 1.00 0.00 C ATOM 182 CE1 HIS A 12 1.501 2.454 1.980 1.00 0.00 C ATOM 183 NE2 HIS A 12 1.834 1.179 1.741 1.00 0.00 N ATOM 0 H HIS A 12 3.030 4.974 5.401 1.00 0.00 H new ATOM 0 HA HIS A 12 5.305 3.303 5.522 1.00 0.00 H new ATOM 0 HB2 HIS A 12 4.622 1.300 4.631 1.00 0.00 H new ATOM 0 HB3 HIS A 12 3.261 1.654 5.676 1.00 0.00 H new ATOM 0 HD1 HIS A 12 1.933 3.809 3.528 1.00 0.00 H new ATOM 0 HD2 HIS A 12 3.182 -0.162 2.877 1.00 0.00 H new ATOM 0 HE1 HIS A 12 0.862 3.050 1.345 1.00 0.00 H new ATOM 191 N PRO A 13 5.452 3.713 2.767 1.00 0.00 N ATOM 192 CA PRO A 13 5.667 4.405 1.497 1.00 0.00 C ATOM 193 C PRO A 13 4.586 4.118 0.464 1.00 0.00 C ATOM 194 O PRO A 13 3.869 3.158 0.616 1.00 0.00 O ATOM 195 CB PRO A 13 6.996 3.861 1.014 1.00 0.00 C ATOM 196 CG PRO A 13 7.117 2.451 1.583 1.00 0.00 C ATOM 197 CD PRO A 13 6.208 2.470 2.806 1.00 0.00 C ATOM 0 HA PRO A 13 5.646 5.486 1.633 1.00 0.00 H new ATOM 0 HB2 PRO A 13 7.036 3.845 -0.075 1.00 0.00 H new ATOM 0 HB3 PRO A 13 7.819 4.489 1.354 1.00 0.00 H new ATOM 0 HG2 PRO A 13 6.799 1.700 0.860 1.00 0.00 H new ATOM 0 HG3 PRO A 13 8.146 2.216 1.854 1.00 0.00 H new ATOM 0 HD2 PRO A 13 5.536 1.612 2.798 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.795 2.407 3.722 1.00 0.00 H new ATOM 205 N VAL A 14 4.495 4.923 -0.600 1.00 0.00 N ATOM 206 CA VAL A 14 3.646 4.868 -1.770 1.00 0.00 C ATOM 207 C VAL A 14 3.796 6.284 -2.285 1.00 0.00 C ATOM 208 O VAL A 14 4.402 6.475 -3.315 1.00 0.00 O ATOM 209 CB VAL A 14 2.209 4.354 -1.488 1.00 0.00 C ATOM 210 CG1 VAL A 14 1.108 4.962 -2.369 1.00 0.00 C ATOM 211 CG2 VAL A 14 2.137 2.821 -1.659 1.00 0.00 C ATOM 0 H VAL A 14 5.106 5.738 -0.655 1.00 0.00 H new ATOM 0 HA VAL A 14 3.923 4.127 -2.520 1.00 0.00 H new ATOM 0 HB VAL A 14 2.017 4.669 -0.462 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.144 4.537 -2.092 1.00 0.00 H new ATOM 0 HG12 VAL A 14 1.083 6.042 -2.226 1.00 0.00 H new ATOM 0 HG13 VAL A 14 1.315 4.739 -3.416 1.00 0.00 H new ATOM 0 HG21 VAL A 14 1.122 2.480 -1.457 1.00 0.00 H new ATOM 0 HG22 VAL A 14 2.413 2.555 -2.680 1.00 0.00 H new ATOM 0 HG23 VAL A 14 2.826 2.344 -0.961 1.00 0.00 H new ATOM 221 N GLU A 15 3.476 7.301 -1.494 1.00 0.00 N ATOM 222 CA GLU A 15 3.315 8.676 -1.985 1.00 0.00 C ATOM 223 C GLU A 15 3.730 9.674 -0.914 1.00 0.00 C ATOM 224 O GLU A 15 3.175 10.755 -0.820 1.00 0.00 O ATOM 225 CB GLU A 15 1.867 8.860 -2.516 1.00 0.00 C ATOM 226 CG GLU A 15 1.752 8.274 -3.933 1.00 0.00 C ATOM 227 CD GLU A 15 0.630 8.820 -4.822 1.00 0.00 C ATOM 228 OE1 GLU A 15 0.128 9.945 -4.614 1.00 0.00 O ATOM 229 OE2 GLU A 15 0.267 8.107 -5.789 1.00 0.00 O ATOM 0 H GLU A 15 3.319 7.202 -0.491 1.00 0.00 H new ATOM 0 HA GLU A 15 3.980 8.871 -2.827 1.00 0.00 H new ATOM 0 HB2 GLU A 15 1.160 8.365 -1.850 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.606 9.918 -2.528 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.700 8.437 -4.445 1.00 0.00 H new ATOM 0 HG3 GLU A 15 1.620 7.196 -3.844 1.00 0.00 H new ATOM 236 N LYS A 16 4.752 9.331 -0.121 1.00 0.00 N ATOM 237 CA LYS A 16 5.482 10.274 0.726 1.00 0.00 C ATOM 238 C LYS A 16 6.639 9.576 1.393 1.00 0.00 C ATOM 239 O LYS A 16 7.779 9.846 1.039 1.00 0.00 O ATOM 240 CB LYS A 16 4.586 10.915 1.796 1.00 0.00 C ATOM 241 CG LYS A 16 5.147 12.254 2.269 1.00 0.00 C ATOM 242 CD LYS A 16 5.077 13.342 1.185 1.00 0.00 C ATOM 243 CE LYS A 16 5.140 14.728 1.826 1.00 0.00 C ATOM 244 NZ LYS A 16 3.829 15.127 2.388 1.00 0.00 N ATOM 0 H LYS A 16 5.098 8.374 -0.051 1.00 0.00 H new ATOM 0 HA LYS A 16 5.846 11.072 0.079 1.00 0.00 H new ATOM 0 HB2 LYS A 16 3.584 11.062 1.393 1.00 0.00 H new ATOM 0 HB3 LYS A 16 4.492 10.239 2.646 1.00 0.00 H new ATOM 0 HG2 LYS A 16 4.593 12.586 3.147 1.00 0.00 H new ATOM 0 HG3 LYS A 16 6.184 12.120 2.578 1.00 0.00 H new ATOM 0 HD2 LYS A 16 5.902 13.220 0.483 1.00 0.00 H new ATOM 0 HD3 LYS A 16 4.154 13.239 0.614 1.00 0.00 H new ATOM 0 HE2 LYS A 16 5.891 14.731 2.616 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.456 15.460 1.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 3.880 16.110 2.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 3.098 15.050 1.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 3.587 14.502 3.183 1.00 0.00 H new ATOM 258 N LEU A 17 6.370 8.605 2.271 1.00 0.00 N ATOM 259 CA LEU A 17 7.407 7.815 2.933 1.00 0.00 C ATOM 260 C LEU A 17 8.300 7.147 1.882 1.00 0.00 C ATOM 261 O LEU A 17 9.484 6.929 2.118 1.00 0.00 O ATOM 262 CB LEU A 17 6.769 6.789 3.900 1.00 0.00 C ATOM 263 CG LEU A 17 7.217 6.842 5.367 1.00 0.00 C ATOM 264 CD1 LEU A 17 8.732 6.718 5.524 1.00 0.00 C ATOM 265 CD2 LEU A 17 6.725 8.097 6.075 1.00 0.00 C ATOM 0 H LEU A 17 5.422 8.345 2.542 1.00 0.00 H new ATOM 0 HA LEU A 17 8.038 8.469 3.535 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.688 6.923 3.871 1.00 0.00 H new ATOM 0 HB3 LEU A 17 6.977 5.789 3.518 1.00 0.00 H new ATOM 0 HG LEU A 17 6.757 5.975 5.842 1.00 0.00 H new ATOM 0 HD11 LEU A 17 8.993 6.762 6.581 1.00 0.00 H new ATOM 0 HD12 LEU A 17 9.064 5.767 5.107 1.00 0.00 H new ATOM 0 HD13 LEU A 17 9.221 7.537 4.996 1.00 0.00 H new ATOM 0 HD21 LEU A 17 7.067 8.089 7.110 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.119 8.978 5.569 1.00 0.00 H new ATOM 0 HD23 LEU A 17 5.636 8.124 6.053 1.00 0.00 H new ATOM 277 N LYS A 18 7.763 6.886 0.682 1.00 0.00 N ATOM 278 CA LYS A 18 8.529 6.375 -0.457 1.00 0.00 C ATOM 279 C LYS A 18 9.679 7.320 -0.783 1.00 0.00 C ATOM 280 O LYS A 18 10.790 6.883 -0.996 1.00 0.00 O ATOM 281 CB LYS A 18 7.618 6.042 -1.660 1.00 0.00 C ATOM 282 CG LYS A 18 7.806 6.866 -2.934 1.00 0.00 C ATOM 283 CD LYS A 18 7.062 8.198 -2.845 1.00 0.00 C ATOM 284 CE LYS A 18 7.503 9.234 -3.870 1.00 0.00 C ATOM 285 NZ LYS A 18 7.726 8.664 -5.214 1.00 0.00 N ATOM 0 H LYS A 18 6.774 7.026 0.476 1.00 0.00 H new ATOM 0 HA LYS A 18 8.982 5.421 -0.185 1.00 0.00 H new ATOM 0 HB2 LYS A 18 7.765 4.992 -1.913 1.00 0.00 H new ATOM 0 HB3 LYS A 18 6.582 6.151 -1.338 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.868 7.050 -3.098 1.00 0.00 H new ATOM 0 HG3 LYS A 18 7.444 6.301 -3.793 1.00 0.00 H new ATOM 0 HD2 LYS A 18 5.995 8.013 -2.969 1.00 0.00 H new ATOM 0 HD3 LYS A 18 7.200 8.611 -1.846 1.00 0.00 H new ATOM 0 HE2 LYS A 18 6.747 10.016 -3.935 1.00 0.00 H new ATOM 0 HE3 LYS A 18 8.423 9.708 -3.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 8.008 9.421 -5.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.479 7.949 -5.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 6.848 8.221 -5.553 1.00 0.00 H new ATOM 299 N ILE A 19 9.442 8.625 -0.791 1.00 0.00 N ATOM 300 CA ILE A 19 10.442 9.606 -1.167 1.00 0.00 C ATOM 301 C ILE A 19 11.588 9.542 -0.151 1.00 0.00 C ATOM 302 O ILE A 19 12.745 9.758 -0.511 1.00 0.00 O ATOM 303 CB ILE A 19 9.726 10.980 -1.300 1.00 0.00 C ATOM 304 CG1 ILE A 19 9.993 11.648 -2.660 1.00 0.00 C ATOM 305 CG2 ILE A 19 9.979 11.973 -0.155 1.00 0.00 C ATOM 306 CD1 ILE A 19 8.769 12.439 -3.128 1.00 0.00 C ATOM 0 H ILE A 19 8.543 9.032 -0.534 1.00 0.00 H new ATOM 0 HA ILE A 19 10.907 9.415 -2.134 1.00 0.00 H new ATOM 0 HB ILE A 19 8.670 10.720 -1.230 1.00 0.00 H new ATOM 0 HG12 ILE A 19 10.853 12.313 -2.581 1.00 0.00 H new ATOM 0 HG13 ILE A 19 10.245 10.888 -3.400 1.00 0.00 H new ATOM 0 HG21 ILE A 19 9.434 12.897 -0.347 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.638 11.539 0.785 1.00 0.00 H new ATOM 0 HG23 ILE A 19 11.045 12.188 -0.089 1.00 0.00 H new ATOM 0 HD11 ILE A 19 8.982 12.902 -4.091 1.00 0.00 H new ATOM 0 HD12 ILE A 19 7.918 11.766 -3.229 1.00 0.00 H new ATOM 0 HD13 ILE A 19 8.535 13.213 -2.397 1.00 0.00 H new ATOM 318 N ARG A 20 11.271 9.185 1.101 1.00 0.00 N ATOM 319 CA ARG A 20 12.224 9.024 2.190 1.00 0.00 C ATOM 320 C ARG A 20 12.953 7.665 2.173 1.00 0.00 C ATOM 321 O ARG A 20 13.842 7.485 3.007 1.00 0.00 O ATOM 322 CB ARG A 20 11.519 9.281 3.535 1.00 0.00 C ATOM 323 CG ARG A 20 10.978 10.721 3.709 1.00 0.00 C ATOM 324 CD ARG A 20 9.457 10.805 3.876 1.00 0.00 C ATOM 325 NE ARG A 20 9.014 12.021 4.572 1.00 0.00 N ATOM 326 CZ ARG A 20 8.734 13.217 4.040 1.00 0.00 C ATOM 327 NH1 ARG A 20 9.053 13.521 2.784 1.00 0.00 N ATOM 328 NH2 ARG A 20 8.118 14.135 4.764 1.00 0.00 N ATOM 0 H ARG A 20 10.310 8.996 1.386 1.00 0.00 H new ATOM 0 HA ARG A 20 13.010 9.766 2.049 1.00 0.00 H new ATOM 0 HB2 ARG A 20 10.691 8.580 3.637 1.00 0.00 H new ATOM 0 HB3 ARG A 20 12.218 9.068 4.344 1.00 0.00 H new ATOM 0 HG2 ARG A 20 11.453 11.173 4.580 1.00 0.00 H new ATOM 0 HG3 ARG A 20 11.270 11.314 2.842 1.00 0.00 H new ATOM 0 HD2 ARG A 20 8.988 10.766 2.893 1.00 0.00 H new ATOM 0 HD3 ARG A 20 9.111 9.932 4.429 1.00 0.00 H new ATOM 0 HE ARG A 20 8.907 11.944 5.583 1.00 0.00 H new ATOM 0 HH11 ARG A 20 9.525 12.833 2.197 1.00 0.00 H new ATOM 0 HH12 ARG A 20 8.826 14.442 2.409 1.00 0.00 H new ATOM 0 HH21 ARG A 20 7.856 13.932 5.729 1.00 0.00 H new ATOM 0 HH22 ARG A 20 7.905 15.046 4.358 1.00 0.00 H new ATOM 342 N SER A 21 12.626 6.739 1.258 1.00 0.00 N ATOM 343 CA SER A 21 13.275 5.448 0.992 1.00 0.00 C ATOM 344 C SER A 21 12.332 4.609 0.123 1.00 0.00 C ATOM 345 O SER A 21 11.497 3.886 0.675 1.00 0.00 O ATOM 346 CB SER A 21 13.668 4.712 2.290 1.00 0.00 C ATOM 347 OG SER A 21 13.963 3.337 2.113 1.00 0.00 O ATOM 0 H SER A 21 11.834 6.888 0.633 1.00 0.00 H new ATOM 0 HA SER A 21 14.211 5.618 0.461 1.00 0.00 H new ATOM 0 HB2 SER A 21 14.537 5.205 2.725 1.00 0.00 H new ATOM 0 HB3 SER A 21 12.854 4.808 3.009 1.00 0.00 H new ATOM 0 HG SER A 21 14.204 2.940 2.976 1.00 0.00 H new ATOM 353 N ALA A 22 12.457 4.702 -1.201 1.00 0.00 N ATOM 354 CA ALA A 22 11.879 3.800 -2.191 1.00 0.00 C ATOM 355 C ALA A 22 12.498 4.103 -3.553 1.00 0.00 C ATOM 356 O ALA A 22 13.093 5.168 -3.747 1.00 0.00 O ATOM 357 CB ALA A 22 10.345 3.931 -2.284 1.00 0.00 C ATOM 0 H ALA A 22 12.996 5.453 -1.633 1.00 0.00 H new ATOM 0 HA ALA A 22 12.097 2.778 -1.881 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.966 3.238 -3.035 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.901 3.697 -1.317 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.083 4.951 -2.566 1.00 0.00 H new ATOM 363 N LYS A 23 12.314 3.193 -4.513 1.00 0.00 N ATOM 364 CA LYS A 23 12.733 3.377 -5.904 1.00 0.00 C ATOM 365 C LYS A 23 11.649 2.887 -6.861 1.00 0.00 C ATOM 366 O LYS A 23 10.531 2.603 -6.421 1.00 0.00 O ATOM 367 CB LYS A 23 14.112 2.724 -6.130 1.00 0.00 C ATOM 368 CG LYS A 23 15.050 3.634 -6.933 1.00 0.00 C ATOM 369 CD LYS A 23 15.704 4.755 -6.117 1.00 0.00 C ATOM 370 CE LYS A 23 16.842 4.235 -5.231 1.00 0.00 C ATOM 371 NZ LYS A 23 17.864 5.281 -4.997 1.00 0.00 N ATOM 0 H LYS A 23 11.863 2.294 -4.343 1.00 0.00 H new ATOM 0 HA LYS A 23 12.858 4.438 -6.119 1.00 0.00 H new ATOM 0 HB2 LYS A 23 14.567 2.493 -5.167 1.00 0.00 H new ATOM 0 HB3 LYS A 23 13.984 1.778 -6.657 1.00 0.00 H new ATOM 0 HG2 LYS A 23 15.834 3.022 -7.379 1.00 0.00 H new ATOM 0 HG3 LYS A 23 14.488 4.080 -7.753 1.00 0.00 H new ATOM 0 HD2 LYS A 23 16.091 5.517 -6.794 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.950 5.236 -5.493 1.00 0.00 H new ATOM 0 HE2 LYS A 23 16.438 3.899 -4.276 1.00 0.00 H new ATOM 0 HE3 LYS A 23 17.306 3.369 -5.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 18.620 4.899 -4.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 18.266 5.583 -5.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 17.424 6.097 -4.525 1.00 0.00 H new ATOM 385 N ALA A 24 11.921 2.857 -8.166 1.00 0.00 N ATOM 386 CA ALA A 24 10.954 2.331 -9.124 1.00 0.00 C ATOM 387 C ALA A 24 10.890 0.811 -9.009 1.00 0.00 C ATOM 388 O ALA A 24 9.830 0.222 -9.222 1.00 0.00 O ATOM 389 CB ALA A 24 11.319 2.703 -10.563 1.00 0.00 C ATOM 0 H ALA A 24 12.793 3.187 -8.579 1.00 0.00 H new ATOM 0 HA ALA A 24 9.986 2.774 -8.889 1.00 0.00 H new ATOM 0 HB1 ALA A 24 10.574 2.293 -11.245 1.00 0.00 H new ATOM 0 HB2 ALA A 24 11.344 3.788 -10.663 1.00 0.00 H new ATOM 0 HB3 ALA A 24 12.299 2.294 -10.807 1.00 0.00 H new ATOM 395 N GLU A 25 12.002 0.167 -8.644 1.00 0.00 N ATOM 396 CA GLU A 25 12.084 -1.292 -8.528 1.00 0.00 C ATOM 397 C GLU A 25 11.523 -1.814 -7.220 1.00 0.00 C ATOM 398 O GLU A 25 11.878 -2.906 -6.761 1.00 0.00 O ATOM 399 CB GLU A 25 13.490 -1.847 -8.766 1.00 0.00 C ATOM 400 CG GLU A 25 14.559 -1.036 -8.073 1.00 0.00 C ATOM 401 CD GLU A 25 14.760 -1.399 -6.599 1.00 0.00 C ATOM 402 OE1 GLU A 25 14.067 -0.878 -5.705 1.00 0.00 O ATOM 403 OE2 GLU A 25 15.677 -2.217 -6.328 1.00 0.00 O ATOM 0 H GLU A 25 12.875 0.645 -8.420 1.00 0.00 H new ATOM 0 HA GLU A 25 11.451 -1.662 -9.335 1.00 0.00 H new ATOM 0 HB2 GLU A 25 13.535 -2.877 -8.413 1.00 0.00 H new ATOM 0 HB3 GLU A 25 13.692 -1.868 -9.837 1.00 0.00 H new ATOM 0 HG2 GLU A 25 15.503 -1.171 -8.602 1.00 0.00 H new ATOM 0 HG3 GLU A 25 14.302 0.021 -8.144 1.00 0.00 H new ATOM 410 N ASP A 26 10.477 -1.164 -6.730 1.00 0.00 N ATOM 411 CA ASP A 26 10.137 -1.354 -5.343 1.00 0.00 C ATOM 412 C ASP A 26 8.758 -1.981 -5.233 1.00 0.00 C ATOM 413 O ASP A 26 7.973 -1.966 -6.189 1.00 0.00 O ATOM 414 CB ASP A 26 10.282 -0.043 -4.572 1.00 0.00 C ATOM 415 CG ASP A 26 10.689 -0.245 -3.116 1.00 0.00 C ATOM 416 OD1 ASP A 26 10.719 -1.393 -2.612 1.00 0.00 O ATOM 417 OD2 ASP A 26 11.006 0.787 -2.489 1.00 0.00 O ATOM 0 H ASP A 26 9.876 -0.527 -7.253 1.00 0.00 H new ATOM 0 HA ASP A 26 10.834 -2.051 -4.877 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.025 0.582 -5.067 1.00 0.00 H new ATOM 0 HB3 ASP A 26 9.336 0.498 -4.607 1.00 0.00 H new ATOM 422 N LYS A 27 8.446 -2.552 -4.075 1.00 0.00 N ATOM 423 CA LYS A 27 7.252 -3.366 -3.882 1.00 0.00 C ATOM 424 C LYS A 27 6.576 -2.881 -2.615 1.00 0.00 C ATOM 425 O LYS A 27 7.266 -2.659 -1.625 1.00 0.00 O ATOM 426 CB LYS A 27 7.636 -4.847 -3.784 1.00 0.00 C ATOM 427 CG LYS A 27 8.257 -5.478 -5.045 1.00 0.00 C ATOM 428 CD LYS A 27 9.619 -6.147 -4.810 1.00 0.00 C ATOM 429 CE LYS A 27 10.702 -5.117 -4.480 1.00 0.00 C ATOM 430 NZ LYS A 27 12.050 -5.710 -4.513 1.00 0.00 N ATOM 0 H LYS A 27 9.020 -2.462 -3.237 1.00 0.00 H new ATOM 0 HA LYS A 27 6.567 -3.270 -4.725 1.00 0.00 H new ATOM 0 HB2 LYS A 27 8.341 -4.963 -2.961 1.00 0.00 H new ATOM 0 HB3 LYS A 27 6.743 -5.415 -3.522 1.00 0.00 H new ATOM 0 HG2 LYS A 27 7.565 -6.219 -5.445 1.00 0.00 H new ATOM 0 HG3 LYS A 27 8.371 -4.705 -5.805 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.537 -6.864 -3.993 1.00 0.00 H new ATOM 0 HD3 LYS A 27 9.908 -6.708 -5.699 1.00 0.00 H new ATOM 0 HE2 LYS A 27 10.650 -4.294 -5.192 1.00 0.00 H new ATOM 0 HE3 LYS A 27 10.514 -4.696 -3.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 12.695 -5.138 -3.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 12.012 -6.679 -4.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 12.396 -5.732 -5.494 1.00 0.00 H new ATOM 444 N ILE A 28 5.270 -2.609 -2.665 1.00 0.00 N ATOM 445 CA ILE A 28 4.510 -2.081 -1.539 1.00 0.00 C ATOM 446 C ILE A 28 3.034 -2.486 -1.707 1.00 0.00 C ATOM 447 O ILE A 28 2.588 -2.737 -2.829 1.00 0.00 O ATOM 448 CB ILE A 28 4.652 -0.538 -1.444 1.00 0.00 C ATOM 449 CG1 ILE A 28 6.044 0.093 -1.723 1.00 0.00 C ATOM 450 CG2 ILE A 28 4.245 -0.145 -0.014 1.00 0.00 C ATOM 451 CD1 ILE A 28 5.940 1.583 -2.043 1.00 0.00 C ATOM 0 H ILE A 28 4.706 -2.753 -3.503 1.00 0.00 H new ATOM 0 HA ILE A 28 4.901 -2.498 -0.611 1.00 0.00 H new ATOM 0 HB ILE A 28 4.024 -0.151 -2.246 1.00 0.00 H new ATOM 0 HG12 ILE A 28 6.687 -0.048 -0.854 1.00 0.00 H new ATOM 0 HG13 ILE A 28 6.517 -0.425 -2.557 1.00 0.00 H new ATOM 0 HG21 ILE A 28 4.328 0.935 0.104 1.00 0.00 H new ATOM 0 HG22 ILE A 28 3.215 -0.452 0.168 1.00 0.00 H new ATOM 0 HG23 ILE A 28 4.903 -0.640 0.701 1.00 0.00 H new ATOM 0 HD11 ILE A 28 6.935 1.985 -2.232 1.00 0.00 H new ATOM 0 HD12 ILE A 28 5.319 1.723 -2.928 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.492 2.106 -1.198 1.00 0.00 H new ATOM 463 N VAL A 29 2.272 -2.505 -0.607 1.00 0.00 N ATOM 464 CA VAL A 29 0.829 -2.765 -0.526 1.00 0.00 C ATOM 465 C VAL A 29 0.239 -1.948 0.633 1.00 0.00 C ATOM 466 O VAL A 29 0.943 -1.755 1.624 1.00 0.00 O ATOM 467 CB VAL A 29 0.568 -4.276 -0.316 1.00 0.00 C ATOM 468 CG1 VAL A 29 -0.879 -4.600 0.104 1.00 0.00 C ATOM 469 CG2 VAL A 29 0.863 -5.045 -1.605 1.00 0.00 C ATOM 0 H VAL A 29 2.674 -2.327 0.313 1.00 0.00 H new ATOM 0 HA VAL A 29 0.349 -2.467 -1.458 1.00 0.00 H new ATOM 0 HB VAL A 29 1.231 -4.578 0.495 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -0.988 -5.677 0.233 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -1.106 -4.097 1.044 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -1.568 -4.255 -0.667 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.676 -6.107 -1.446 1.00 0.00 H new ATOM 0 HG22 VAL A 29 0.218 -4.678 -2.403 1.00 0.00 H new ATOM 0 HG23 VAL A 29 1.906 -4.898 -1.886 1.00 0.00 H new ATOM 479 N LEU A 30 -1.043 -1.542 0.554 1.00 0.00 N ATOM 480 CA LEU A 30 -1.788 -0.855 1.620 1.00 0.00 C ATOM 481 C LEU A 30 -2.850 -1.749 2.231 1.00 0.00 C ATOM 482 O LEU A 30 -3.506 -2.462 1.469 1.00 0.00 O ATOM 483 CB LEU A 30 -2.549 0.387 1.108 1.00 0.00 C ATOM 484 CG LEU A 30 -2.233 0.990 -0.263 1.00 0.00 C ATOM 485 CD1 LEU A 30 -3.263 2.072 -0.583 1.00 0.00 C ATOM 486 CD2 LEU A 30 -0.844 1.602 -0.273 1.00 0.00 C ATOM 0 H LEU A 30 -1.605 -1.690 -0.284 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.025 -0.575 2.346 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -3.610 0.136 1.111 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.406 1.177 1.846 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.271 0.199 -1.012 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -3.044 2.506 -1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -4.260 1.632 -0.597 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.221 2.851 0.178 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.640 2.025 -1.257 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -0.788 2.389 0.479 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.106 0.832 -0.049 1.00 0.00 H new ATOM 498 N ILE A 31 -3.144 -1.598 3.530 1.00 0.00 N ATOM 499 CA ILE A 31 -4.224 -2.328 4.193 1.00 0.00 C ATOM 500 C ILE A 31 -5.041 -1.406 5.109 1.00 0.00 C ATOM 501 O ILE A 31 -4.700 -0.247 5.293 1.00 0.00 O ATOM 502 CB ILE A 31 -3.674 -3.613 4.854 1.00 0.00 C ATOM 503 CG1 ILE A 31 -3.309 -3.328 6.313 1.00 0.00 C ATOM 504 CG2 ILE A 31 -2.514 -4.299 4.096 1.00 0.00 C ATOM 505 CD1 ILE A 31 -2.777 -4.511 7.091 1.00 0.00 C ATOM 0 H ILE A 31 -2.637 -0.965 4.148 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.949 -2.675 3.457 1.00 0.00 H new ATOM 0 HB ILE A 31 -4.481 -4.344 4.809 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -2.562 -2.535 6.335 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -4.193 -2.947 6.823 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -2.200 -5.190 4.640 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -2.849 -4.583 3.098 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -1.674 -3.609 4.014 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -2.549 -4.203 8.111 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.527 -5.301 7.110 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.870 -4.883 6.613 1.00 0.00 H new ATOM 517 N GLN A 32 -6.100 -1.932 5.719 1.00 0.00 N ATOM 518 CA GLN A 32 -6.914 -1.355 6.789 1.00 0.00 C ATOM 519 C GLN A 32 -7.155 0.151 6.620 1.00 0.00 C ATOM 520 O GLN A 32 -7.842 0.557 5.694 1.00 0.00 O ATOM 521 CB GLN A 32 -6.330 -1.704 8.165 1.00 0.00 C ATOM 522 CG GLN A 32 -6.152 -3.210 8.403 1.00 0.00 C ATOM 523 CD GLN A 32 -7.133 -3.763 9.417 1.00 0.00 C ATOM 524 OE1 GLN A 32 -6.936 -3.652 10.623 1.00 0.00 O ATOM 525 NE2 GLN A 32 -8.200 -4.372 8.946 1.00 0.00 N ATOM 0 H GLN A 32 -6.442 -2.856 5.454 1.00 0.00 H new ATOM 0 HA GLN A 32 -7.902 -1.811 6.719 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -5.363 -1.213 8.273 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -6.982 -1.299 8.939 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -6.275 -3.740 7.458 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -5.135 -3.402 8.746 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -8.339 -4.450 7.939 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -8.888 -4.766 9.588 1.00 0.00 H new ATOM 534 N ASN A 33 -6.617 0.999 7.505 1.00 0.00 N ATOM 535 CA ASN A 33 -6.698 2.452 7.359 1.00 0.00 C ATOM 536 C ASN A 33 -5.717 2.955 6.319 1.00 0.00 C ATOM 537 O ASN A 33 -6.033 3.928 5.642 1.00 0.00 O ATOM 538 CB ASN A 33 -6.399 3.164 8.681 1.00 0.00 C ATOM 539 CG ASN A 33 -7.457 2.913 9.738 1.00 0.00 C ATOM 540 OD1 ASN A 33 -8.575 3.424 9.662 1.00 0.00 O ATOM 541 ND2 ASN A 33 -7.141 2.086 10.717 1.00 0.00 N ATOM 0 H ASN A 33 -6.115 0.695 8.339 1.00 0.00 H new ATOM 0 HA ASN A 33 -7.717 2.675 7.044 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -5.431 2.831 9.056 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -6.320 4.236 8.501 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -7.830 1.857 11.433 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -6.208 1.676 10.757 1.00 0.00 H new ATOM 548 N GLY A 34 -4.553 2.309 6.192 1.00 0.00 N ATOM 549 CA GLY A 34 -3.557 2.483 5.137 1.00 0.00 C ATOM 550 C GLY A 34 -4.153 2.535 3.740 1.00 0.00 C ATOM 551 O GLY A 34 -3.519 3.078 2.840 1.00 0.00 O ATOM 0 H GLY A 34 -4.265 1.604 6.871 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.002 3.403 5.321 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -2.840 1.663 5.187 1.00 0.00 H new ATOM 555 N VAL A 35 -5.382 2.052 3.536 1.00 0.00 N ATOM 556 CA VAL A 35 -6.094 2.256 2.288 1.00 0.00 C ATOM 557 C VAL A 35 -6.087 3.737 1.847 1.00 0.00 C ATOM 558 O VAL A 35 -6.111 3.984 0.641 1.00 0.00 O ATOM 559 CB VAL A 35 -7.529 1.714 2.388 1.00 0.00 C ATOM 560 CG1 VAL A 35 -7.666 0.215 2.704 1.00 0.00 C ATOM 561 CG2 VAL A 35 -8.434 2.519 3.330 1.00 0.00 C ATOM 0 H VAL A 35 -5.901 1.514 4.230 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.566 1.695 1.517 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.875 1.846 1.363 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -8.722 -0.052 2.750 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.178 -0.368 1.923 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.196 0.001 3.664 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -9.429 2.074 3.347 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -8.014 2.507 4.336 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -8.502 3.548 2.978 1.00 0.00 H new ATOM 571 N PHE A 36 -6.003 4.701 2.785 1.00 0.00 N ATOM 572 CA PHE A 36 -5.881 6.136 2.547 1.00 0.00 C ATOM 573 C PHE A 36 -4.718 6.524 1.616 1.00 0.00 C ATOM 574 O PHE A 36 -4.798 7.599 1.022 1.00 0.00 O ATOM 575 CB PHE A 36 -5.765 6.873 3.896 1.00 0.00 C ATOM 576 CG PHE A 36 -7.086 7.238 4.571 1.00 0.00 C ATOM 577 CD1 PHE A 36 -8.046 6.264 4.914 1.00 0.00 C ATOM 578 CD2 PHE A 36 -7.377 8.590 4.833 1.00 0.00 C ATOM 579 CE1 PHE A 36 -9.261 6.641 5.519 1.00 0.00 C ATOM 580 CE2 PHE A 36 -8.608 8.972 5.394 1.00 0.00 C ATOM 581 CZ PHE A 36 -9.548 7.995 5.753 1.00 0.00 C ATOM 0 H PHE A 36 -6.020 4.478 3.780 1.00 0.00 H new ATOM 0 HA PHE A 36 -6.786 6.442 2.022 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -5.189 6.250 4.580 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -5.193 7.788 3.740 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -7.848 5.222 4.712 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -6.642 9.346 4.599 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -9.976 5.884 5.805 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -8.830 10.018 5.549 1.00 0.00 H new ATOM 0 HZ PHE A 36 -10.485 8.282 6.206 1.00 0.00 H new ATOM 591 N TRP A 37 -3.682 5.693 1.422 1.00 0.00 N ATOM 592 CA TRP A 37 -2.630 6.027 0.458 1.00 0.00 C ATOM 593 C TRP A 37 -3.103 5.935 -1.002 1.00 0.00 C ATOM 594 O TRP A 37 -2.436 6.483 -1.885 1.00 0.00 O ATOM 595 CB TRP A 37 -1.377 5.164 0.615 1.00 0.00 C ATOM 596 CG TRP A 37 -0.524 5.378 1.824 1.00 0.00 C ATOM 597 CD1 TRP A 37 -0.614 4.688 2.979 1.00 0.00 C ATOM 598 CD2 TRP A 37 0.528 6.368 2.032 1.00 0.00 C ATOM 599 NE1 TRP A 37 0.315 5.169 3.877 1.00 0.00 N ATOM 600 CE2 TRP A 37 1.010 6.244 3.365 1.00 0.00 C ATOM 601 CE3 TRP A 37 1.087 7.398 1.250 1.00 0.00 C ATOM 602 CZ2 TRP A 37 1.960 7.127 3.902 1.00 0.00 C ATOM 603 CZ3 TRP A 37 1.997 8.321 1.797 1.00 0.00 C ATOM 604 CH2 TRP A 37 2.448 8.178 3.119 1.00 0.00 C ATOM 0 H TRP A 37 -3.554 4.806 1.909 1.00 0.00 H new ATOM 0 HA TRP A 37 -2.379 7.063 0.688 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -1.688 4.119 0.606 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -0.753 5.318 -0.265 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -1.307 3.882 3.171 1.00 0.00 H new ATOM 0 HE1 TRP A 37 0.469 4.778 4.806 1.00 0.00 H new ATOM 0 HE3 TRP A 37 0.811 7.481 0.209 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.312 6.995 4.914 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 2.351 9.145 1.196 1.00 0.00 H new ATOM 0 HH2 TRP A 37 3.166 8.874 3.528 1.00 0.00 H new ATOM 615 N ALA A 38 -4.213 5.257 -1.308 1.00 0.00 N ATOM 616 CA ALA A 38 -4.758 5.186 -2.665 1.00 0.00 C ATOM 617 C ALA A 38 -5.605 6.400 -2.985 1.00 0.00 C ATOM 618 O ALA A 38 -6.608 6.261 -3.682 1.00 0.00 O ATOM 619 CB ALA A 38 -5.569 3.894 -2.827 1.00 0.00 C ATOM 0 H ALA A 38 -4.760 4.741 -0.619 1.00 0.00 H new ATOM 0 HA ALA A 38 -3.928 5.177 -3.372 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -5.974 3.843 -3.838 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -4.923 3.034 -2.651 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -6.388 3.886 -2.107 1.00 0.00 H new ATOM 625 N LEU A 39 -5.177 7.566 -2.515 1.00 0.00 N ATOM 626 CA LEU A 39 -5.886 8.828 -2.525 1.00 0.00 C ATOM 627 C LEU A 39 -5.016 9.836 -1.775 1.00 0.00 C ATOM 628 O LEU A 39 -5.330 10.340 -0.696 1.00 0.00 O ATOM 629 CB LEU A 39 -7.350 8.685 -2.083 1.00 0.00 C ATOM 630 CG LEU A 39 -7.713 8.004 -0.748 1.00 0.00 C ATOM 631 CD1 LEU A 39 -9.222 8.162 -0.579 1.00 0.00 C ATOM 632 CD2 LEU A 39 -7.510 6.491 -0.602 1.00 0.00 C ATOM 0 H LEU A 39 -4.256 7.654 -2.086 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.022 9.220 -3.533 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.775 9.688 -2.056 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.870 8.140 -2.871 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.042 8.482 -0.034 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -9.534 7.695 0.355 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -9.477 9.222 -0.558 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.734 7.682 -1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.815 6.178 0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.113 5.970 -1.346 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.458 6.249 -0.753 1.00 0.00 H new ATOM 644 N GLU A 40 -3.850 10.047 -2.378 1.00 0.00 N ATOM 645 CA GLU A 40 -2.734 10.895 -1.978 1.00 0.00 C ATOM 646 C GLU A 40 -2.339 11.862 -3.094 1.00 0.00 C ATOM 647 O GLU A 40 -2.838 11.802 -4.218 1.00 0.00 O ATOM 648 CB GLU A 40 -1.536 10.001 -1.623 1.00 0.00 C ATOM 649 CG GLU A 40 -1.724 9.391 -0.249 1.00 0.00 C ATOM 650 CD GLU A 40 -1.539 10.384 0.905 1.00 0.00 C ATOM 651 OE1 GLU A 40 -1.028 11.520 0.692 1.00 0.00 O ATOM 652 OE2 GLU A 40 -1.986 10.080 2.022 1.00 0.00 O ATOM 0 H GLU A 40 -3.642 9.574 -3.258 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.038 11.487 -1.115 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.429 9.212 -2.367 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -0.617 10.587 -1.646 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -2.723 8.960 -0.188 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.016 8.571 -0.127 1.00 0.00 H new ATOM 659 N GLU A 41 -1.401 12.750 -2.782 1.00 0.00 N ATOM 660 CA GLU A 41 -1.047 13.915 -3.572 1.00 0.00 C ATOM 661 C GLU A 41 0.457 13.951 -3.812 1.00 0.00 C ATOM 662 O GLU A 41 1.157 14.878 -3.394 1.00 0.00 O ATOM 663 CB GLU A 41 -1.656 15.175 -2.925 1.00 0.00 C ATOM 664 CG GLU A 41 -1.452 15.266 -1.394 1.00 0.00 C ATOM 665 CD GLU A 41 -2.100 16.487 -0.749 1.00 0.00 C ATOM 666 OE1 GLU A 41 -3.224 16.885 -1.142 1.00 0.00 O ATOM 667 OE2 GLU A 41 -1.532 17.031 0.226 1.00 0.00 O ATOM 0 H GLU A 41 -0.844 12.670 -1.932 1.00 0.00 H new ATOM 0 HA GLU A 41 -1.479 13.868 -4.572 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.217 16.057 -3.391 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -2.724 15.199 -3.140 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -1.857 14.366 -0.931 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.383 15.281 -1.181 1.00 0.00 H new ATOM 674 N LEU A 42 0.951 12.895 -4.463 1.00 0.00 N ATOM 675 CA LEU A 42 2.359 12.650 -4.742 1.00 0.00 C ATOM 676 C LEU A 42 2.455 11.721 -5.965 1.00 0.00 C ATOM 677 O LEU A 42 1.648 11.832 -6.888 1.00 0.00 O ATOM 678 CB LEU A 42 3.003 12.067 -3.471 1.00 0.00 C ATOM 679 CG LEU A 42 4.269 12.768 -2.939 1.00 0.00 C ATOM 680 CD1 LEU A 42 5.399 12.918 -3.952 1.00 0.00 C ATOM 681 CD2 LEU A 42 3.958 14.127 -2.327 1.00 0.00 C ATOM 0 H LEU A 42 0.348 12.156 -4.825 1.00 0.00 H new ATOM 0 HA LEU A 42 2.903 13.561 -4.991 1.00 0.00 H new ATOM 0 HB2 LEU A 42 2.254 12.074 -2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 42 3.251 11.024 -3.666 1.00 0.00 H new ATOM 0 HG LEU A 42 4.630 12.087 -2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.244 13.422 -3.483 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.711 11.932 -4.298 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.051 13.507 -4.801 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.880 14.583 -1.966 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.506 14.771 -3.081 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.265 14.001 -1.495 1.00 0.00 H new ATOM 693 N GLU A 43 3.453 10.837 -6.001 1.00 0.00 N ATOM 694 CA GLU A 43 3.754 9.880 -7.053 1.00 0.00 C ATOM 695 C GLU A 43 4.451 8.668 -6.415 1.00 0.00 C ATOM 696 O GLU A 43 5.023 8.786 -5.331 1.00 0.00 O ATOM 697 CB GLU A 43 4.666 10.540 -8.112 1.00 0.00 C ATOM 698 CG GLU A 43 5.883 11.312 -7.557 1.00 0.00 C ATOM 699 CD GLU A 43 7.234 10.774 -8.015 1.00 0.00 C ATOM 700 OE1 GLU A 43 7.540 9.615 -7.665 1.00 0.00 O ATOM 701 OE2 GLU A 43 8.050 11.555 -8.567 1.00 0.00 O ATOM 0 H GLU A 43 4.121 10.771 -5.233 1.00 0.00 H new ATOM 0 HA GLU A 43 2.839 9.556 -7.549 1.00 0.00 H new ATOM 0 HB2 GLU A 43 5.027 9.765 -8.788 1.00 0.00 H new ATOM 0 HB3 GLU A 43 4.064 11.226 -8.707 1.00 0.00 H new ATOM 0 HG2 GLU A 43 5.802 12.357 -7.856 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.847 11.288 -6.468 1.00 0.00 H new ATOM 708 N THR A 44 4.458 7.535 -7.108 1.00 0.00 N ATOM 709 CA THR A 44 5.254 6.318 -6.903 1.00 0.00 C ATOM 710 C THR A 44 5.666 5.830 -8.282 1.00 0.00 C ATOM 711 O THR A 44 4.805 5.685 -9.151 1.00 0.00 O ATOM 712 CB THR A 44 4.460 5.211 -6.206 1.00 0.00 C ATOM 713 OG1 THR A 44 5.279 4.089 -5.981 1.00 0.00 O ATOM 714 CG2 THR A 44 3.166 4.788 -6.910 1.00 0.00 C ATOM 0 H THR A 44 3.842 7.430 -7.914 1.00 0.00 H new ATOM 0 HA THR A 44 6.106 6.551 -6.265 1.00 0.00 H new ATOM 0 HB THR A 44 4.139 5.649 -5.261 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.977 3.620 -5.175 1.00 0.00 H new ATOM 0 HG21 THR A 44 2.680 3.999 -6.335 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.497 5.645 -6.988 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.399 4.418 -7.908 1.00 0.00 H new ATOM 722 N PRO A 45 6.945 5.522 -8.497 1.00 0.00 N ATOM 723 CA PRO A 45 7.344 4.646 -9.564 1.00 0.00 C ATOM 724 C PRO A 45 7.310 3.149 -9.179 1.00 0.00 C ATOM 725 O PRO A 45 7.482 2.309 -10.061 1.00 0.00 O ATOM 726 CB PRO A 45 8.739 5.145 -9.907 1.00 0.00 C ATOM 727 CG PRO A 45 9.326 5.636 -8.586 1.00 0.00 C ATOM 728 CD PRO A 45 8.096 6.022 -7.777 1.00 0.00 C ATOM 0 HA PRO A 45 6.660 4.680 -10.412 1.00 0.00 H new ATOM 0 HB2 PRO A 45 9.347 4.349 -10.336 1.00 0.00 H new ATOM 0 HB3 PRO A 45 8.700 5.948 -10.643 1.00 0.00 H new ATOM 0 HG2 PRO A 45 9.906 4.858 -8.090 1.00 0.00 H new ATOM 0 HG3 PRO A 45 9.993 6.485 -8.733 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.142 5.593 -6.776 1.00 0.00 H new ATOM 0 HD3 PRO A 45 8.036 7.104 -7.657 1.00 0.00 H new ATOM 736 N ALA A 46 7.058 2.789 -7.911 1.00 0.00 N ATOM 737 CA ALA A 46 7.041 1.402 -7.444 1.00 0.00 C ATOM 738 C ALA A 46 5.730 0.726 -7.835 1.00 0.00 C ATOM 739 O ALA A 46 4.807 1.411 -8.296 1.00 0.00 O ATOM 740 CB ALA A 46 7.158 1.395 -5.918 1.00 0.00 C ATOM 0 H ALA A 46 6.858 3.466 -7.174 1.00 0.00 H new ATOM 0 HA ALA A 46 7.872 0.863 -7.899 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.147 0.367 -5.557 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.092 1.873 -5.623 1.00 0.00 H new ATOM 0 HB3 ALA A 46 6.319 1.940 -5.486 1.00 0.00 H new ATOM 746 N LYS A 47 5.595 -0.593 -7.644 1.00 0.00 N ATOM 747 CA LYS A 47 4.270 -1.182 -7.738 1.00 0.00 C ATOM 748 C LYS A 47 3.608 -0.871 -6.415 1.00 0.00 C ATOM 749 O LYS A 47 4.207 -0.989 -5.345 1.00 0.00 O ATOM 750 CB LYS A 47 4.250 -2.690 -8.000 1.00 0.00 C ATOM 751 CG LYS A 47 5.421 -3.450 -7.381 1.00 0.00 C ATOM 752 CD LYS A 47 5.129 -4.922 -7.109 1.00 0.00 C ATOM 753 CE LYS A 47 4.984 -5.783 -8.376 1.00 0.00 C ATOM 754 NZ LYS A 47 6.249 -6.401 -8.828 1.00 0.00 N ATOM 0 H LYS A 47 6.354 -1.241 -7.433 1.00 0.00 H new ATOM 0 HA LYS A 47 3.753 -0.762 -8.601 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.319 -3.102 -7.612 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.250 -2.860 -9.077 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.281 -3.378 -8.047 1.00 0.00 H new ATOM 0 HG3 LYS A 47 5.701 -2.966 -6.445 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.931 -5.332 -6.495 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.211 -4.997 -6.526 1.00 0.00 H new ATOM 0 HE2 LYS A 47 4.254 -6.570 -8.187 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.585 -5.165 -9.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 6.074 -6.965 -9.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 6.943 -5.656 -9.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 6.621 -7.018 -8.078 1.00 0.00 H new ATOM 768 N VAL A 48 2.359 -0.477 -6.484 1.00 0.00 N ATOM 769 CA VAL A 48 1.515 -0.089 -5.421 1.00 0.00 C ATOM 770 C VAL A 48 0.209 -0.768 -5.763 1.00 0.00 C ATOM 771 O VAL A 48 -0.206 -0.820 -6.927 1.00 0.00 O ATOM 772 CB VAL A 48 1.435 1.435 -5.426 1.00 0.00 C ATOM 773 CG1 VAL A 48 2.776 2.019 -4.947 1.00 0.00 C ATOM 774 CG2 VAL A 48 0.971 2.027 -6.758 1.00 0.00 C ATOM 0 H VAL A 48 1.878 -0.421 -7.382 1.00 0.00 H new ATOM 0 HA VAL A 48 1.840 -0.369 -4.419 1.00 0.00 H new ATOM 0 HB VAL A 48 0.653 1.728 -4.725 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.721 3.108 -4.950 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.985 1.669 -3.936 1.00 0.00 H new ATOM 0 HG13 VAL A 48 3.574 1.695 -5.615 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.940 3.114 -6.682 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.666 1.738 -7.546 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.024 1.651 -6.996 1.00 0.00 H new ATOM 784 N TYR A 49 -0.367 -1.349 -4.738 1.00 0.00 N ATOM 785 CA TYR A 49 -1.551 -2.159 -4.764 1.00 0.00 C ATOM 786 C TYR A 49 -2.180 -2.010 -3.368 1.00 0.00 C ATOM 787 O TYR A 49 -1.521 -1.595 -2.413 1.00 0.00 O ATOM 788 CB TYR A 49 -1.138 -3.605 -5.072 1.00 0.00 C ATOM 789 CG TYR A 49 -0.516 -3.935 -6.439 1.00 0.00 C ATOM 790 CD1 TYR A 49 -1.359 -4.089 -7.554 1.00 0.00 C ATOM 791 CD2 TYR A 49 0.868 -4.188 -6.611 1.00 0.00 C ATOM 792 CE1 TYR A 49 -0.860 -4.381 -8.834 1.00 0.00 C ATOM 793 CE2 TYR A 49 1.358 -4.596 -7.869 1.00 0.00 C ATOM 794 CZ TYR A 49 0.515 -4.627 -8.998 1.00 0.00 C ATOM 795 OH TYR A 49 1.028 -4.823 -10.246 1.00 0.00 O ATOM 0 H TYR A 49 0.012 -1.258 -3.795 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.272 -1.864 -5.526 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.427 -3.913 -4.306 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -2.023 -4.230 -4.955 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -2.425 -3.979 -7.422 1.00 0.00 H new ATOM 0 HD2 TYR A 49 1.547 -4.068 -5.779 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -1.526 -4.416 -9.684 1.00 0.00 H new ATOM 0 HE2 TYR A 49 2.393 -4.889 -7.968 1.00 0.00 H new ATOM 0 HH TYR A 49 1.993 -4.979 -10.182 1.00 0.00 H new ATOM 805 N ALA A 50 -3.458 -2.314 -3.208 1.00 0.00 N ATOM 806 CA ALA A 50 -4.264 -2.011 -2.024 1.00 0.00 C ATOM 807 C ALA A 50 -5.154 -3.231 -1.752 1.00 0.00 C ATOM 808 O ALA A 50 -5.615 -3.856 -2.701 1.00 0.00 O ATOM 809 CB ALA A 50 -5.127 -0.807 -2.398 1.00 0.00 C ATOM 0 H ALA A 50 -3.991 -2.801 -3.929 1.00 0.00 H new ATOM 0 HA ALA A 50 -3.664 -1.795 -1.140 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.754 -0.532 -1.550 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -4.485 0.033 -2.662 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.759 -1.062 -3.249 1.00 0.00 H new ATOM 815 N ILE A 51 -5.438 -3.562 -0.497 1.00 0.00 N ATOM 816 CA ILE A 51 -6.338 -4.637 -0.111 1.00 0.00 C ATOM 817 C ILE A 51 -7.770 -4.153 -0.241 1.00 0.00 C ATOM 818 O ILE A 51 -8.270 -3.341 0.538 1.00 0.00 O ATOM 819 CB ILE A 51 -5.984 -5.154 1.301 1.00 0.00 C ATOM 820 CG1 ILE A 51 -4.589 -5.803 1.359 1.00 0.00 C ATOM 821 CG2 ILE A 51 -7.028 -6.166 1.808 1.00 0.00 C ATOM 822 CD1 ILE A 51 -4.288 -6.851 0.281 1.00 0.00 C ATOM 0 H ILE A 51 -5.035 -3.073 0.302 1.00 0.00 H new ATOM 0 HA ILE A 51 -6.225 -5.493 -0.777 1.00 0.00 H new ATOM 0 HB ILE A 51 -5.983 -4.276 1.947 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.840 -5.014 1.289 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -4.469 -6.271 2.336 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -6.748 -6.509 2.804 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -8.007 -5.688 1.851 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -7.069 -7.018 1.129 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -3.279 -7.238 0.422 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -5.005 -7.669 0.358 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -4.366 -6.392 -0.705 1.00 0.00 H new ATOM 834 N LYS A 52 -8.447 -4.744 -1.219 1.00 0.00 N ATOM 835 CA LYS A 52 -9.839 -4.515 -1.514 1.00 0.00 C ATOM 836 C LYS A 52 -10.732 -4.838 -0.332 1.00 0.00 C ATOM 837 O LYS A 52 -11.504 -3.971 0.051 1.00 0.00 O ATOM 838 CB LYS A 52 -10.188 -5.261 -2.805 1.00 0.00 C ATOM 839 CG LYS A 52 -11.470 -4.689 -3.404 1.00 0.00 C ATOM 840 CD LYS A 52 -11.539 -4.905 -4.917 1.00 0.00 C ATOM 841 CE LYS A 52 -12.073 -6.285 -5.294 1.00 0.00 C ATOM 842 NZ LYS A 52 -12.378 -6.335 -6.736 1.00 0.00 N ATOM 0 H LYS A 52 -8.015 -5.421 -1.848 1.00 0.00 H new ATOM 0 HA LYS A 52 -10.023 -3.455 -1.688 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -9.370 -5.171 -3.520 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -10.315 -6.324 -2.598 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -12.333 -5.158 -2.931 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -11.528 -3.622 -3.187 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -12.177 -4.140 -5.360 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -10.544 -4.776 -5.344 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -11.337 -7.049 -5.044 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -12.971 -6.506 -4.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -13.159 -7.002 -6.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -12.655 -5.388 -7.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -11.536 -6.651 -7.258 1.00 0.00 H new ATOM 856 N ASP A 53 -10.621 -6.025 0.273 1.00 0.00 N ATOM 857 CA ASP A 53 -11.428 -6.376 1.453 1.00 0.00 C ATOM 858 C ASP A 53 -11.343 -5.281 2.511 1.00 0.00 C ATOM 859 O ASP A 53 -12.380 -4.844 2.998 1.00 0.00 O ATOM 860 CB ASP A 53 -11.017 -7.711 2.092 1.00 0.00 C ATOM 861 CG ASP A 53 -11.820 -8.894 1.559 1.00 0.00 C ATOM 862 OD1 ASP A 53 -13.057 -8.930 1.712 1.00 0.00 O ATOM 863 OD2 ASP A 53 -11.186 -9.818 0.988 1.00 0.00 O ATOM 0 H ASP A 53 -9.982 -6.760 -0.032 1.00 0.00 H new ATOM 0 HA ASP A 53 -12.451 -6.479 1.091 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -9.957 -7.885 1.908 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -11.147 -7.647 3.172 1.00 0.00 H new ATOM 868 N ASP A 54 -10.141 -4.803 2.844 1.00 0.00 N ATOM 869 CA ASP A 54 -9.961 -3.718 3.793 1.00 0.00 C ATOM 870 C ASP A 54 -10.604 -2.423 3.324 1.00 0.00 C ATOM 871 O ASP A 54 -11.328 -1.819 4.102 1.00 0.00 O ATOM 872 CB ASP A 54 -8.479 -3.487 4.086 1.00 0.00 C ATOM 873 CG ASP A 54 -8.012 -4.334 5.260 1.00 0.00 C ATOM 874 OD1 ASP A 54 -8.718 -4.375 6.288 1.00 0.00 O ATOM 875 OD2 ASP A 54 -6.892 -4.877 5.205 1.00 0.00 O ATOM 0 H ASP A 54 -9.268 -5.163 2.458 1.00 0.00 H new ATOM 0 HA ASP A 54 -10.465 -4.023 4.710 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -7.889 -3.729 3.202 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -8.309 -2.433 4.304 1.00 0.00 H new ATOM 880 N PHE A 55 -10.377 -1.982 2.083 1.00 0.00 N ATOM 881 CA PHE A 55 -10.996 -0.779 1.520 1.00 0.00 C ATOM 882 C PHE A 55 -12.522 -0.836 1.668 1.00 0.00 C ATOM 883 O PHE A 55 -13.160 0.115 2.122 1.00 0.00 O ATOM 884 CB PHE A 55 -10.566 -0.651 0.044 1.00 0.00 C ATOM 885 CG PHE A 55 -10.652 0.725 -0.602 1.00 0.00 C ATOM 886 CD1 PHE A 55 -10.166 1.863 0.060 1.00 0.00 C ATOM 887 CD2 PHE A 55 -11.131 0.871 -1.913 1.00 0.00 C ATOM 888 CE1 PHE A 55 -10.068 3.103 -0.593 1.00 0.00 C ATOM 889 CE2 PHE A 55 -11.144 2.132 -2.530 1.00 0.00 C ATOM 890 CZ PHE A 55 -10.584 3.247 -1.887 1.00 0.00 C ATOM 0 H PHE A 55 -9.750 -2.457 1.433 1.00 0.00 H new ATOM 0 HA PHE A 55 -10.661 0.105 2.063 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -9.535 -0.995 -0.036 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -11.177 -1.336 -0.544 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -9.861 1.784 1.093 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -11.492 0.007 -2.451 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.597 3.941 -0.100 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -11.589 2.245 -3.508 1.00 0.00 H new ATOM 0 HZ PHE A 55 -10.551 4.205 -2.384 1.00 0.00 H new ATOM 900 N LEU A 56 -13.107 -1.988 1.351 1.00 0.00 N ATOM 901 CA LEU A 56 -14.529 -2.276 1.466 1.00 0.00 C ATOM 902 C LEU A 56 -14.972 -2.318 2.920 1.00 0.00 C ATOM 903 O LEU A 56 -16.117 -1.979 3.225 1.00 0.00 O ATOM 904 CB LEU A 56 -14.807 -3.642 0.830 1.00 0.00 C ATOM 905 CG LEU A 56 -14.541 -3.670 -0.683 1.00 0.00 C ATOM 906 CD1 LEU A 56 -14.623 -5.117 -1.180 1.00 0.00 C ATOM 907 CD2 LEU A 56 -15.612 -2.849 -1.412 1.00 0.00 C ATOM 0 H LEU A 56 -12.576 -2.781 0.991 1.00 0.00 H new ATOM 0 HA LEU A 56 -15.082 -1.485 0.959 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.186 -4.395 1.316 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.845 -3.917 1.015 1.00 0.00 H new ATOM 0 HG LEU A 56 -13.554 -3.253 -0.881 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -14.435 -5.144 -2.253 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -13.876 -5.721 -0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.616 -5.516 -0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -15.420 -2.871 -2.485 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -16.596 -3.273 -1.211 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -15.583 -1.818 -1.059 1.00 0.00 H new ATOM 919 N ALA A 57 -14.092 -2.758 3.815 1.00 0.00 N ATOM 920 CA ALA A 57 -14.272 -2.728 5.252 1.00 0.00 C ATOM 921 C ALA A 57 -13.955 -1.340 5.838 1.00 0.00 C ATOM 922 O ALA A 57 -13.974 -1.184 7.067 1.00 0.00 O ATOM 923 CB ALA A 57 -13.407 -3.820 5.894 1.00 0.00 C ATOM 0 H ALA A 57 -13.197 -3.162 3.540 1.00 0.00 H new ATOM 0 HA ALA A 57 -15.320 -2.926 5.478 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.540 -3.800 6.976 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -13.707 -4.795 5.509 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -12.359 -3.642 5.654 1.00 0.00 H new ATOM 929 N ARG A 58 -13.651 -0.339 4.997 1.00 0.00 N ATOM 930 CA ARG A 58 -13.342 1.033 5.419 1.00 0.00 C ATOM 931 C ARG A 58 -14.153 2.025 4.585 1.00 0.00 C ATOM 932 O ARG A 58 -13.666 3.114 4.314 1.00 0.00 O ATOM 933 CB ARG A 58 -11.812 1.271 5.291 1.00 0.00 C ATOM 934 CG ARG A 58 -11.118 1.861 6.529 1.00 0.00 C ATOM 935 CD ARG A 58 -11.093 3.393 6.576 1.00 0.00 C ATOM 936 NE ARG A 58 -12.352 3.965 7.096 1.00 0.00 N ATOM 937 CZ ARG A 58 -13.085 4.975 6.605 1.00 0.00 C ATOM 938 NH1 ARG A 58 -12.849 5.484 5.402 1.00 0.00 N ATOM 939 NH2 ARG A 58 -14.084 5.468 7.326 1.00 0.00 N ATOM 0 H ARG A 58 -13.613 -0.465 3.986 1.00 0.00 H new ATOM 0 HA ARG A 58 -13.620 1.184 6.462 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -11.335 0.321 5.049 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -11.637 1.939 4.448 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -11.621 1.491 7.422 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -10.093 1.493 6.565 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -10.263 3.720 7.203 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -10.908 3.781 5.574 1.00 0.00 H new ATOM 0 HE ARG A 58 -12.714 3.532 7.946 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -12.095 5.107 4.828 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -13.421 6.252 5.052 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -14.289 5.079 8.246 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -14.646 6.236 6.960 1.00 0.00 H new ATOM 953 N GLY A 59 -15.409 1.713 4.262 1.00 0.00 N ATOM 954 CA GLY A 59 -16.336 2.650 3.634 1.00 0.00 C ATOM 955 C GLY A 59 -15.771 3.353 2.401 1.00 0.00 C ATOM 956 O GLY A 59 -15.672 4.585 2.369 1.00 0.00 O ATOM 0 H GLY A 59 -15.814 0.792 4.432 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -17.242 2.114 3.350 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -16.627 3.403 4.367 1.00 0.00 H new ATOM 960 N TYR A 60 -15.417 2.576 1.380 1.00 0.00 N ATOM 961 CA TYR A 60 -15.055 3.021 0.055 1.00 0.00 C ATOM 962 C TYR A 60 -15.782 2.149 -0.964 1.00 0.00 C ATOM 963 O TYR A 60 -16.393 1.142 -0.595 1.00 0.00 O ATOM 964 CB TYR A 60 -13.549 2.857 -0.091 1.00 0.00 C ATOM 965 CG TYR A 60 -12.722 3.868 0.675 1.00 0.00 C ATOM 966 CD1 TYR A 60 -12.486 5.138 0.119 1.00 0.00 C ATOM 967 CD2 TYR A 60 -12.113 3.513 1.894 1.00 0.00 C ATOM 968 CE1 TYR A 60 -11.694 6.072 0.798 1.00 0.00 C ATOM 969 CE2 TYR A 60 -11.282 4.430 2.558 1.00 0.00 C ATOM 970 CZ TYR A 60 -11.075 5.713 2.012 1.00 0.00 C ATOM 971 OH TYR A 60 -10.238 6.575 2.640 1.00 0.00 O ATOM 0 H TYR A 60 -15.376 1.561 1.471 1.00 0.00 H new ATOM 0 HA TYR A 60 -15.332 4.063 -0.107 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -13.273 1.856 0.241 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -13.291 2.924 -1.148 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -12.918 5.394 -0.837 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -12.285 2.535 2.319 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -11.558 7.064 0.393 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -10.802 4.153 3.485 1.00 0.00 H new ATOM 0 HH TYR A 60 -10.023 6.231 3.532 1.00 0.00 H new ATOM 981 N SER A 61 -15.713 2.512 -2.240 1.00 0.00 N ATOM 982 CA SER A 61 -16.162 1.696 -3.349 1.00 0.00 C ATOM 983 C SER A 61 -14.944 1.407 -4.223 1.00 0.00 C ATOM 984 O SER A 61 -13.960 2.147 -4.187 1.00 0.00 O ATOM 985 CB SER A 61 -17.248 2.484 -4.091 1.00 0.00 C ATOM 986 OG SER A 61 -17.969 1.700 -5.020 1.00 0.00 O ATOM 0 H SER A 61 -15.331 3.411 -2.534 1.00 0.00 H new ATOM 0 HA SER A 61 -16.591 0.743 -3.037 1.00 0.00 H new ATOM 0 HB2 SER A 61 -17.943 2.905 -3.364 1.00 0.00 H new ATOM 0 HB3 SER A 61 -16.787 3.322 -4.613 1.00 0.00 H new ATOM 0 HG SER A 61 -18.647 2.255 -5.460 1.00 0.00 H new ATOM 992 N GLU A 62 -15.020 0.390 -5.084 1.00 0.00 N ATOM 993 CA GLU A 62 -13.908 0.022 -5.962 1.00 0.00 C ATOM 994 C GLU A 62 -13.615 1.119 -6.994 1.00 0.00 C ATOM 995 O GLU A 62 -12.642 1.035 -7.743 1.00 0.00 O ATOM 996 CB GLU A 62 -14.156 -1.309 -6.697 1.00 0.00 C ATOM 997 CG GLU A 62 -14.593 -2.475 -5.794 1.00 0.00 C ATOM 998 CD GLU A 62 -14.561 -3.846 -6.479 1.00 0.00 C ATOM 999 OE1 GLU A 62 -13.767 -4.057 -7.418 1.00 0.00 O ATOM 1000 OE2 GLU A 62 -15.233 -4.779 -5.966 1.00 0.00 O ATOM 0 H GLU A 62 -15.847 -0.197 -5.192 1.00 0.00 H new ATOM 0 HA GLU A 62 -13.043 -0.099 -5.310 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -14.921 -1.151 -7.457 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -13.243 -1.595 -7.219 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -13.945 -2.504 -4.918 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -15.605 -2.283 -5.436 1.00 0.00 H new ATOM 1007 N GLU A 63 -14.484 2.126 -7.089 1.00 0.00 N ATOM 1008 CA GLU A 63 -14.346 3.239 -8.006 1.00 0.00 C ATOM 1009 C GLU A 63 -13.619 4.415 -7.338 1.00 0.00 C ATOM 1010 O GLU A 63 -13.199 5.336 -8.039 1.00 0.00 O ATOM 1011 CB GLU A 63 -15.755 3.643 -8.480 1.00 0.00 C ATOM 1012 CG GLU A 63 -15.795 4.207 -9.904 1.00 0.00 C ATOM 1013 CD GLU A 63 -15.752 3.111 -10.978 1.00 0.00 C ATOM 1014 OE1 GLU A 63 -14.734 2.389 -11.070 1.00 0.00 O ATOM 1015 OE2 GLU A 63 -16.688 3.010 -11.801 1.00 0.00 O ATOM 0 H GLU A 63 -15.323 2.184 -6.511 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.741 2.946 -8.864 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -16.409 2.772 -8.426 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -16.159 4.387 -7.794 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -16.702 4.798 -10.031 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -14.952 4.883 -10.046 1.00 0.00 H new ATOM 1022 N ASP A 64 -13.451 4.404 -6.009 1.00 0.00 N ATOM 1023 CA ASP A 64 -12.915 5.537 -5.256 1.00 0.00 C ATOM 1024 C ASP A 64 -11.408 5.620 -5.470 1.00 0.00 C ATOM 1025 O ASP A 64 -10.853 6.715 -5.598 1.00 0.00 O ATOM 1026 CB ASP A 64 -13.145 5.379 -3.736 1.00 0.00 C ATOM 1027 CG ASP A 64 -14.530 5.764 -3.203 1.00 0.00 C ATOM 1028 OD1 ASP A 64 -15.559 5.238 -3.684 1.00 0.00 O ATOM 1029 OD2 ASP A 64 -14.601 6.543 -2.223 1.00 0.00 O ATOM 0 H ASP A 64 -13.686 3.601 -5.425 1.00 0.00 H new ATOM 0 HA ASP A 64 -13.429 6.430 -5.612 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -12.956 4.339 -3.470 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -12.401 5.982 -3.215 1.00 0.00 H new ATOM 1034 N SER A 65 -10.724 4.470 -5.459 1.00 0.00 N ATOM 1035 CA SER A 65 -9.302 4.463 -5.156 1.00 0.00 C ATOM 1036 C SER A 65 -8.532 4.901 -6.402 1.00 0.00 C ATOM 1037 O SER A 65 -9.031 4.796 -7.526 1.00 0.00 O ATOM 1038 CB SER A 65 -8.862 3.075 -4.648 1.00 0.00 C ATOM 1039 OG SER A 65 -7.977 2.394 -5.505 1.00 0.00 O ATOM 0 H SER A 65 -11.128 3.554 -5.653 1.00 0.00 H new ATOM 0 HA SER A 65 -9.083 5.167 -4.353 1.00 0.00 H new ATOM 0 HB2 SER A 65 -8.387 3.192 -3.674 1.00 0.00 H new ATOM 0 HB3 SER A 65 -9.749 2.459 -4.498 1.00 0.00 H new ATOM 0 HG SER A 65 -7.621 1.604 -5.047 1.00 0.00 H new ATOM 1045 N LYS A 66 -7.283 5.336 -6.213 1.00 0.00 N ATOM 1046 CA LYS A 66 -6.410 5.685 -7.319 1.00 0.00 C ATOM 1047 C LYS A 66 -5.207 4.759 -7.393 1.00 0.00 C ATOM 1048 O LYS A 66 -4.155 5.164 -7.885 1.00 0.00 O ATOM 1049 CB LYS A 66 -6.059 7.179 -7.170 1.00 0.00 C ATOM 1050 CG LYS A 66 -4.992 7.565 -6.130 1.00 0.00 C ATOM 1051 CD LYS A 66 -4.053 8.631 -6.696 1.00 0.00 C ATOM 1052 CE LYS A 66 -3.006 9.058 -5.665 1.00 0.00 C ATOM 1053 NZ LYS A 66 -2.063 10.027 -6.256 1.00 0.00 N ATOM 0 H LYS A 66 -6.858 5.453 -5.293 1.00 0.00 H new ATOM 0 HA LYS A 66 -6.905 5.544 -8.280 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -5.727 7.544 -8.142 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -6.976 7.716 -6.925 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -5.474 7.939 -5.227 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -4.419 6.683 -5.843 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.554 8.244 -7.584 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -4.633 9.499 -7.009 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -3.499 9.502 -4.800 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.462 8.184 -5.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -1.330 10.267 -5.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -1.617 9.609 -7.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -2.577 10.889 -6.529 1.00 0.00 H new ATOM 1067 N VAL A 67 -5.386 3.475 -7.087 1.00 0.00 N ATOM 1068 CA VAL A 67 -4.399 2.399 -7.240 1.00 0.00 C ATOM 1069 C VAL A 67 -5.186 1.119 -7.580 1.00 0.00 C ATOM 1070 O VAL A 67 -6.420 1.139 -7.574 1.00 0.00 O ATOM 1071 CB VAL A 67 -3.503 2.286 -5.977 1.00 0.00 C ATOM 1072 CG1 VAL A 67 -2.992 3.643 -5.481 1.00 0.00 C ATOM 1073 CG2 VAL A 67 -4.141 1.470 -4.854 1.00 0.00 C ATOM 0 H VAL A 67 -6.269 3.136 -6.705 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.696 2.597 -8.049 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.627 1.724 -6.302 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -2.372 3.497 -4.596 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -2.401 4.118 -6.264 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.839 4.281 -5.229 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -3.462 1.431 -4.002 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.077 1.938 -4.551 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -4.339 0.458 -5.207 1.00 0.00 H new ATOM 1083 N PRO A 68 -4.522 0.023 -7.948 1.00 0.00 N ATOM 1084 CA PRO A 68 -5.172 -1.260 -8.160 1.00 0.00 C ATOM 1085 C PRO A 68 -5.521 -1.920 -6.819 1.00 0.00 C ATOM 1086 O PRO A 68 -4.680 -2.031 -5.919 1.00 0.00 O ATOM 1087 CB PRO A 68 -4.185 -2.045 -9.022 1.00 0.00 C ATOM 1088 CG PRO A 68 -2.826 -1.425 -8.720 1.00 0.00 C ATOM 1089 CD PRO A 68 -3.128 -0.005 -8.336 1.00 0.00 C ATOM 0 HA PRO A 68 -6.135 -1.192 -8.666 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -4.200 -3.106 -8.773 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -4.431 -1.962 -10.081 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -2.321 -1.954 -7.912 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -2.170 -1.469 -9.589 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -2.489 0.320 -7.515 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -2.943 0.671 -9.171 1.00 0.00 H new ATOM 1097 N LEU A 69 -6.782 -2.333 -6.698 1.00 0.00 N ATOM 1098 CA LEU A 69 -7.393 -2.939 -5.527 1.00 0.00 C ATOM 1099 C LEU A 69 -7.355 -4.451 -5.719 1.00 0.00 C ATOM 1100 O LEU A 69 -8.184 -5.031 -6.420 1.00 0.00 O ATOM 1101 CB LEU A 69 -8.837 -2.412 -5.350 1.00 0.00 C ATOM 1102 CG LEU A 69 -9.056 -0.912 -5.125 1.00 0.00 C ATOM 1103 CD1 LEU A 69 -10.553 -0.619 -5.283 1.00 0.00 C ATOM 1104 CD2 LEU A 69 -8.632 -0.530 -3.703 1.00 0.00 C ATOM 0 H LEU A 69 -7.443 -2.245 -7.469 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.851 -2.679 -4.618 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.403 -2.698 -6.236 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.279 -2.940 -4.505 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.467 -0.342 -5.843 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.734 0.444 -5.127 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.875 -0.899 -6.286 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.116 -1.194 -4.548 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -8.791 0.538 -3.550 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.227 -1.092 -2.983 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.577 -0.764 -3.563 1.00 0.00 H new ATOM 1116 N ILE A 70 -6.359 -5.071 -5.102 1.00 0.00 N ATOM 1117 CA ILE A 70 -6.044 -6.485 -5.169 1.00 0.00 C ATOM 1118 C ILE A 70 -6.672 -7.186 -3.956 1.00 0.00 C ATOM 1119 O ILE A 70 -7.192 -6.533 -3.045 1.00 0.00 O ATOM 1120 CB ILE A 70 -4.506 -6.656 -5.262 1.00 0.00 C ATOM 1121 CG1 ILE A 70 -3.748 -6.431 -3.929 1.00 0.00 C ATOM 1122 CG2 ILE A 70 -3.955 -5.787 -6.408 1.00 0.00 C ATOM 1123 CD1 ILE A 70 -2.269 -6.835 -3.968 1.00 0.00 C ATOM 0 H ILE A 70 -5.709 -4.563 -4.503 1.00 0.00 H new ATOM 0 HA ILE A 70 -6.464 -6.953 -6.059 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.320 -7.706 -5.487 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.818 -5.377 -3.658 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.246 -6.996 -3.141 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.874 -5.910 -6.470 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -4.410 -6.095 -7.349 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -4.191 -4.740 -6.217 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.814 -6.645 -2.996 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.188 -7.896 -4.206 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.753 -6.252 -4.730 1.00 0.00 H new ATOM 1135 N THR A 71 -6.630 -8.516 -3.921 1.00 0.00 N ATOM 1136 CA THR A 71 -7.033 -9.267 -2.738 1.00 0.00 C ATOM 1137 C THR A 71 -5.812 -9.604 -1.880 1.00 0.00 C ATOM 1138 O THR A 71 -4.666 -9.496 -2.321 1.00 0.00 O ATOM 1139 CB THR A 71 -7.807 -10.530 -3.143 1.00 0.00 C ATOM 1140 OG1 THR A 71 -7.207 -11.186 -4.248 1.00 0.00 O ATOM 1141 CG2 THR A 71 -9.243 -10.154 -3.516 1.00 0.00 C ATOM 0 H THR A 71 -6.320 -9.095 -4.701 1.00 0.00 H new ATOM 0 HA THR A 71 -7.700 -8.650 -2.136 1.00 0.00 H new ATOM 0 HB THR A 71 -7.794 -11.210 -2.291 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.726 -11.985 -4.475 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.791 -11.051 -3.803 1.00 0.00 H new ATOM 0 HG22 THR A 71 -9.731 -9.689 -2.660 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.230 -9.454 -4.351 1.00 0.00 H new ATOM 1149 N TYR A 72 -6.050 -10.083 -0.659 1.00 0.00 N ATOM 1150 CA TYR A 72 -5.009 -10.507 0.266 1.00 0.00 C ATOM 1151 C TYR A 72 -4.051 -11.511 -0.377 1.00 0.00 C ATOM 1152 O TYR A 72 -2.845 -11.369 -0.224 1.00 0.00 O ATOM 1153 CB TYR A 72 -5.648 -11.079 1.534 1.00 0.00 C ATOM 1154 CG TYR A 72 -6.239 -10.051 2.487 1.00 0.00 C ATOM 1155 CD1 TYR A 72 -5.397 -9.116 3.120 1.00 0.00 C ATOM 1156 CD2 TYR A 72 -7.611 -10.076 2.806 1.00 0.00 C ATOM 1157 CE1 TYR A 72 -5.901 -8.262 4.117 1.00 0.00 C ATOM 1158 CE2 TYR A 72 -8.127 -9.219 3.796 1.00 0.00 C ATOM 1159 CZ TYR A 72 -7.270 -8.312 4.463 1.00 0.00 C ATOM 1160 OH TYR A 72 -7.780 -7.473 5.403 1.00 0.00 O ATOM 0 H TYR A 72 -6.992 -10.188 -0.282 1.00 0.00 H new ATOM 0 HA TYR A 72 -4.412 -9.635 0.534 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.435 -11.774 1.242 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -4.896 -11.657 2.071 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -4.356 -9.055 2.837 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -8.270 -10.757 2.288 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -5.242 -7.568 4.618 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -9.177 -9.254 4.047 1.00 0.00 H new ATOM 0 HH TYR A 72 -7.190 -6.697 5.503 1.00 0.00 H new ATOM 1170 N SER A 73 -4.547 -12.500 -1.122 1.00 0.00 N ATOM 1171 CA SER A 73 -3.685 -13.499 -1.742 1.00 0.00 C ATOM 1172 C SER A 73 -2.742 -12.906 -2.802 1.00 0.00 C ATOM 1173 O SER A 73 -1.667 -13.462 -3.030 1.00 0.00 O ATOM 1174 CB SER A 73 -4.550 -14.585 -2.374 1.00 0.00 C ATOM 1175 OG SER A 73 -5.738 -14.850 -1.632 1.00 0.00 O ATOM 0 H SER A 73 -5.542 -12.628 -1.309 1.00 0.00 H new ATOM 0 HA SER A 73 -3.054 -13.915 -0.956 1.00 0.00 H new ATOM 0 HB2 SER A 73 -4.820 -14.284 -3.386 1.00 0.00 H new ATOM 0 HB3 SER A 73 -3.968 -15.503 -2.458 1.00 0.00 H new ATOM 0 HG SER A 73 -6.255 -15.551 -2.081 1.00 0.00 H new ATOM 1181 N GLU A 74 -3.130 -11.803 -3.450 1.00 0.00 N ATOM 1182 CA GLU A 74 -2.289 -11.105 -4.419 1.00 0.00 C ATOM 1183 C GLU A 74 -1.184 -10.334 -3.688 1.00 0.00 C ATOM 1184 O GLU A 74 -0.049 -10.309 -4.152 1.00 0.00 O ATOM 1185 CB GLU A 74 -3.151 -10.222 -5.333 1.00 0.00 C ATOM 1186 CG GLU A 74 -4.107 -11.063 -6.204 1.00 0.00 C ATOM 1187 CD GLU A 74 -4.269 -10.559 -7.640 1.00 0.00 C ATOM 1188 OE1 GLU A 74 -5.208 -9.776 -7.942 1.00 0.00 O ATOM 1189 OE2 GLU A 74 -3.556 -11.068 -8.533 1.00 0.00 O ATOM 0 H GLU A 74 -4.043 -11.369 -3.314 1.00 0.00 H new ATOM 0 HA GLU A 74 -1.791 -11.823 -5.071 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -3.730 -9.526 -4.726 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -2.505 -9.624 -5.975 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -3.743 -12.090 -6.232 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -5.087 -11.085 -5.728 1.00 0.00 H new ATOM 1196 N PHE A 75 -1.473 -9.784 -2.503 1.00 0.00 N ATOM 1197 CA PHE A 75 -0.456 -9.172 -1.653 1.00 0.00 C ATOM 1198 C PHE A 75 0.596 -10.199 -1.256 1.00 0.00 C ATOM 1199 O PHE A 75 1.784 -9.882 -1.276 1.00 0.00 O ATOM 1200 CB PHE A 75 -1.115 -8.531 -0.426 1.00 0.00 C ATOM 1201 CG PHE A 75 -0.260 -8.276 0.811 1.00 0.00 C ATOM 1202 CD1 PHE A 75 0.999 -7.647 0.724 1.00 0.00 C ATOM 1203 CD2 PHE A 75 -0.769 -8.612 2.081 1.00 0.00 C ATOM 1204 CE1 PHE A 75 1.701 -7.292 1.888 1.00 0.00 C ATOM 1205 CE2 PHE A 75 -0.053 -8.282 3.244 1.00 0.00 C ATOM 1206 CZ PHE A 75 1.171 -7.605 3.150 1.00 0.00 C ATOM 0 H PHE A 75 -2.414 -9.753 -2.112 1.00 0.00 H new ATOM 0 HA PHE A 75 0.052 -8.385 -2.211 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -1.539 -7.576 -0.738 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -1.948 -9.167 -0.127 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.427 -7.437 -0.245 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -1.715 -9.126 2.161 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.648 -6.778 1.812 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -0.447 -8.551 4.213 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.705 -7.325 4.046 1.00 0.00 H new ATOM 1216 N ILE A 76 0.177 -11.422 -0.914 1.00 0.00 N ATOM 1217 CA ILE A 76 1.103 -12.467 -0.497 1.00 0.00 C ATOM 1218 C ILE A 76 2.134 -12.713 -1.590 1.00 0.00 C ATOM 1219 O ILE A 76 3.314 -12.720 -1.268 1.00 0.00 O ATOM 1220 CB ILE A 76 0.352 -13.751 -0.066 1.00 0.00 C ATOM 1221 CG1 ILE A 76 -0.584 -13.530 1.144 1.00 0.00 C ATOM 1222 CG2 ILE A 76 1.342 -14.876 0.274 1.00 0.00 C ATOM 1223 CD1 ILE A 76 -0.009 -12.690 2.292 1.00 0.00 C ATOM 0 H ILE A 76 -0.802 -11.708 -0.920 1.00 0.00 H new ATOM 0 HA ILE A 76 1.644 -12.133 0.389 1.00 0.00 H new ATOM 0 HB ILE A 76 -0.264 -14.033 -0.920 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -1.496 -13.050 0.790 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -0.870 -14.504 1.540 1.00 0.00 H new ATOM 0 HG21 ILE A 76 0.791 -15.767 0.574 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.950 -15.103 -0.602 1.00 0.00 H new ATOM 0 HG23 ILE A 76 1.988 -14.557 1.092 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -0.752 -12.601 3.085 1.00 0.00 H new ATOM 0 HD12 ILE A 76 0.885 -13.174 2.685 1.00 0.00 H new ATOM 0 HD13 ILE A 76 0.249 -11.697 1.923 1.00 0.00 H new ATOM 1235 N ASP A 77 1.723 -12.842 -2.855 1.00 0.00 N ATOM 1236 CA ASP A 77 2.633 -13.056 -3.983 1.00 0.00 C ATOM 1237 C ASP A 77 3.741 -12.013 -4.054 1.00 0.00 C ATOM 1238 O ASP A 77 4.872 -12.339 -4.418 1.00 0.00 O ATOM 1239 CB ASP A 77 1.834 -13.053 -5.287 1.00 0.00 C ATOM 1240 CG ASP A 77 2.690 -12.721 -6.511 1.00 0.00 C ATOM 1241 OD1 ASP A 77 2.830 -11.537 -6.876 1.00 0.00 O ATOM 1242 OD2 ASP A 77 3.171 -13.661 -7.188 1.00 0.00 O ATOM 0 H ASP A 77 0.741 -12.800 -3.127 1.00 0.00 H new ATOM 0 HA ASP A 77 3.116 -14.022 -3.833 1.00 0.00 H new ATOM 0 HB2 ASP A 77 1.373 -14.031 -5.427 1.00 0.00 H new ATOM 0 HB3 ASP A 77 1.024 -12.328 -5.209 1.00 0.00 H new ATOM 1247 N LEU A 78 3.427 -10.764 -3.706 1.00 0.00 N ATOM 1248 CA LEU A 78 4.406 -9.696 -3.757 1.00 0.00 C ATOM 1249 C LEU A 78 5.481 -9.881 -2.693 1.00 0.00 C ATOM 1250 O LEU A 78 6.588 -9.389 -2.901 1.00 0.00 O ATOM 1251 CB LEU A 78 3.734 -8.328 -3.572 1.00 0.00 C ATOM 1252 CG LEU A 78 2.752 -7.979 -4.699 1.00 0.00 C ATOM 1253 CD1 LEU A 78 2.012 -6.692 -4.346 1.00 0.00 C ATOM 1254 CD2 LEU A 78 3.496 -7.802 -6.022 1.00 0.00 C ATOM 0 H LEU A 78 2.502 -10.475 -3.387 1.00 0.00 H new ATOM 0 HA LEU A 78 4.875 -9.734 -4.740 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.203 -8.317 -2.620 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.503 -7.557 -3.517 1.00 0.00 H new ATOM 0 HG LEU A 78 2.037 -8.794 -4.810 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.314 -6.443 -5.145 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.463 -6.832 -3.415 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.730 -5.881 -4.225 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.784 -7.555 -6.810 1.00 0.00 H new ATOM 0 HD22 LEU A 78 4.224 -6.996 -5.925 1.00 0.00 H new ATOM 0 HD23 LEU A 78 4.011 -8.728 -6.276 1.00 0.00 H new ATOM 1266 N LEU A 79 5.164 -10.552 -1.582 1.00 0.00 N ATOM 1267 CA LEU A 79 6.079 -10.841 -0.493 1.00 0.00 C ATOM 1268 C LEU A 79 6.992 -11.984 -0.924 1.00 0.00 C ATOM 1269 O LEU A 79 8.007 -11.740 -1.570 1.00 0.00 O ATOM 1270 CB LEU A 79 5.319 -11.143 0.816 1.00 0.00 C ATOM 1271 CG LEU A 79 4.391 -10.016 1.298 1.00 0.00 C ATOM 1272 CD1 LEU A 79 3.772 -10.425 2.637 1.00 0.00 C ATOM 1273 CD2 LEU A 79 5.158 -8.701 1.440 1.00 0.00 C ATOM 0 H LEU A 79 4.227 -10.919 -1.418 1.00 0.00 H new ATOM 0 HA LEU A 79 6.693 -9.967 -0.276 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.727 -12.047 0.675 1.00 0.00 H new ATOM 0 HB3 LEU A 79 6.045 -11.357 1.600 1.00 0.00 H new ATOM 0 HG LEU A 79 3.602 -9.858 0.562 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.111 -9.633 2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.200 -11.344 2.508 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.563 -10.590 3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 79 4.480 -7.919 1.782 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.963 -8.826 2.164 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.579 -8.419 0.475 1.00 0.00 H new ATOM 1285 N GLU A 80 6.649 -13.221 -0.554 1.00 0.00 N ATOM 1286 CA GLU A 80 7.355 -14.468 -0.832 1.00 0.00 C ATOM 1287 C GLU A 80 8.880 -14.250 -0.913 1.00 0.00 C ATOM 1288 O GLU A 80 9.471 -14.425 -1.982 1.00 0.00 O ATOM 1289 CB GLU A 80 6.767 -15.123 -2.104 1.00 0.00 C ATOM 1290 CG GLU A 80 5.259 -15.403 -2.018 1.00 0.00 C ATOM 1291 CD GLU A 80 4.909 -16.423 -0.933 1.00 0.00 C ATOM 1292 OE1 GLU A 80 5.076 -17.633 -1.200 1.00 0.00 O ATOM 1293 OE2 GLU A 80 4.461 -16.012 0.167 1.00 0.00 O ATOM 0 H GLU A 80 5.803 -13.386 -0.009 1.00 0.00 H new ATOM 0 HA GLU A 80 7.204 -15.160 -0.004 1.00 0.00 H new ATOM 0 HB2 GLU A 80 6.958 -14.473 -2.958 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.291 -16.060 -2.294 1.00 0.00 H new ATOM 0 HG2 GLU A 80 4.731 -14.470 -1.818 1.00 0.00 H new ATOM 0 HG3 GLU A 80 4.906 -15.769 -2.982 1.00 0.00 H new ATOM 1300 N GLY A 81 9.520 -13.875 0.203 1.00 0.00 N ATOM 1301 CA GLY A 81 10.957 -13.582 0.304 1.00 0.00 C ATOM 1302 C GLY A 81 11.246 -12.080 0.428 1.00 0.00 C ATOM 1303 O GLY A 81 12.309 -11.662 0.895 1.00 0.00 O ATOM 0 H GLY A 81 9.034 -13.763 1.093 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.370 -14.100 1.170 1.00 0.00 H new ATOM 0 HA3 GLY A 81 11.467 -13.975 -0.576 1.00 0.00 H new ATOM 1307 N GLU A 82 10.287 -11.226 0.079 1.00 0.00 N ATOM 1308 CA GLU A 82 10.448 -9.782 -0.028 1.00 0.00 C ATOM 1309 C GLU A 82 9.764 -9.125 1.150 1.00 0.00 C ATOM 1310 O GLU A 82 8.929 -8.238 1.056 1.00 0.00 O ATOM 1311 CB GLU A 82 10.043 -9.225 -1.389 1.00 0.00 C ATOM 1312 CG GLU A 82 10.987 -9.695 -2.506 1.00 0.00 C ATOM 1313 CD GLU A 82 12.301 -8.891 -2.514 1.00 0.00 C ATOM 1314 OE1 GLU A 82 13.059 -8.862 -1.513 1.00 0.00 O ATOM 1315 OE2 GLU A 82 12.595 -8.253 -3.552 1.00 0.00 O ATOM 0 H GLU A 82 9.341 -11.535 -0.145 1.00 0.00 H new ATOM 0 HA GLU A 82 11.509 -9.537 0.023 1.00 0.00 H new ATOM 0 HB2 GLU A 82 9.024 -9.537 -1.620 1.00 0.00 H new ATOM 0 HB3 GLU A 82 10.042 -8.136 -1.349 1.00 0.00 H new ATOM 0 HG2 GLU A 82 11.209 -10.754 -2.374 1.00 0.00 H new ATOM 0 HG3 GLU A 82 10.490 -9.591 -3.471 1.00 0.00 H new ATOM 1322 N GLU A 83 10.161 -9.570 2.327 1.00 0.00 N ATOM 1323 CA GLU A 83 9.607 -9.110 3.578 1.00 0.00 C ATOM 1324 C GLU A 83 10.176 -7.771 4.046 1.00 0.00 C ATOM 1325 O GLU A 83 10.815 -7.679 5.097 1.00 0.00 O ATOM 1326 CB GLU A 83 9.722 -10.240 4.617 1.00 0.00 C ATOM 1327 CG GLU A 83 11.124 -10.879 4.559 1.00 0.00 C ATOM 1328 CD GLU A 83 11.573 -11.431 5.910 1.00 0.00 C ATOM 1329 OE1 GLU A 83 10.880 -12.300 6.482 1.00 0.00 O ATOM 1330 OE2 GLU A 83 12.600 -10.944 6.435 1.00 0.00 O ATOM 0 H GLU A 83 10.891 -10.274 2.438 1.00 0.00 H new ATOM 0 HA GLU A 83 8.550 -8.885 3.432 1.00 0.00 H new ATOM 0 HB2 GLU A 83 9.536 -9.845 5.616 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.961 -10.997 4.427 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.122 -11.684 3.824 1.00 0.00 H new ATOM 0 HG3 GLU A 83 11.844 -10.136 4.217 1.00 0.00 H new ATOM 1337 N LYS A 84 9.942 -6.710 3.271 1.00 0.00 N ATOM 1338 CA LYS A 84 10.355 -5.354 3.629 1.00 0.00 C ATOM 1339 C LYS A 84 9.269 -4.331 3.292 1.00 0.00 C ATOM 1340 O LYS A 84 9.608 -3.193 2.968 1.00 0.00 O ATOM 1341 CB LYS A 84 11.647 -5.063 2.830 1.00 0.00 C ATOM 1342 CG LYS A 84 12.894 -5.829 3.296 1.00 0.00 C ATOM 1343 CD LYS A 84 13.534 -6.745 2.237 1.00 0.00 C ATOM 1344 CE LYS A 84 12.804 -8.083 2.089 1.00 0.00 C ATOM 1345 NZ LYS A 84 13.531 -9.041 1.210 1.00 0.00 N ATOM 0 H LYS A 84 9.459 -6.769 2.375 1.00 0.00 H new ATOM 0 HA LYS A 84 10.527 -5.277 4.703 1.00 0.00 H new ATOM 0 HB2 LYS A 84 11.467 -5.299 1.781 1.00 0.00 H new ATOM 0 HB3 LYS A 84 11.856 -3.995 2.885 1.00 0.00 H new ATOM 0 HG2 LYS A 84 13.641 -5.108 3.629 1.00 0.00 H new ATOM 0 HG3 LYS A 84 12.627 -6.434 4.163 1.00 0.00 H new ATOM 0 HD2 LYS A 84 13.540 -6.232 1.275 1.00 0.00 H new ATOM 0 HD3 LYS A 84 14.574 -6.932 2.505 1.00 0.00 H new ATOM 0 HE2 LYS A 84 12.670 -8.530 3.074 1.00 0.00 H new ATOM 0 HE3 LYS A 84 11.809 -7.906 1.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 13.109 -9.987 1.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 13.461 -8.727 0.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 14.532 -9.079 1.491 1.00 0.00 H new ATOM 1359 N PHE A 85 7.995 -4.691 3.466 1.00 0.00 N ATOM 1360 CA PHE A 85 6.836 -3.849 3.108 1.00 0.00 C ATOM 1361 C PHE A 85 5.483 -4.482 3.431 1.00 0.00 C ATOM 1362 O PHE A 85 4.519 -4.407 2.675 1.00 0.00 O ATOM 1363 CB PHE A 85 6.891 -3.391 1.635 1.00 0.00 C ATOM 1364 CG PHE A 85 7.047 -4.524 0.639 1.00 0.00 C ATOM 1365 CD1 PHE A 85 8.333 -4.963 0.292 1.00 0.00 C ATOM 1366 CD2 PHE A 85 5.926 -5.120 0.030 1.00 0.00 C ATOM 1367 CE1 PHE A 85 8.502 -5.983 -0.641 1.00 0.00 C ATOM 1368 CE2 PHE A 85 6.094 -6.174 -0.884 1.00 0.00 C ATOM 1369 CZ PHE A 85 7.386 -6.624 -1.198 1.00 0.00 C ATOM 0 H PHE A 85 7.728 -5.591 3.866 1.00 0.00 H new ATOM 0 HA PHE A 85 6.919 -2.970 3.748 1.00 0.00 H new ATOM 0 HB2 PHE A 85 5.979 -2.841 1.403 1.00 0.00 H new ATOM 0 HB3 PHE A 85 7.722 -2.697 1.512 1.00 0.00 H new ATOM 0 HD1 PHE A 85 9.198 -4.507 0.751 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.933 -4.766 0.266 1.00 0.00 H new ATOM 0 HE1 PHE A 85 9.497 -6.282 -0.937 1.00 0.00 H new ATOM 0 HE2 PHE A 85 5.232 -6.636 -1.343 1.00 0.00 H new ATOM 0 HZ PHE A 85 7.520 -7.461 -1.867 1.00 0.00 H new ATOM 1379 N ILE A 86 5.417 -5.138 4.576 1.00 0.00 N ATOM 1380 CA ILE A 86 4.224 -5.819 5.051 1.00 0.00 C ATOM 1381 C ILE A 86 3.297 -4.762 5.686 1.00 0.00 C ATOM 1382 O ILE A 86 3.737 -3.648 5.985 1.00 0.00 O ATOM 1383 CB ILE A 86 4.742 -6.882 6.040 1.00 0.00 C ATOM 1384 CG1 ILE A 86 5.398 -8.124 5.405 1.00 0.00 C ATOM 1385 CG2 ILE A 86 3.678 -7.492 6.933 1.00 0.00 C ATOM 1386 CD1 ILE A 86 6.561 -7.937 4.454 1.00 0.00 C ATOM 0 H ILE A 86 6.208 -5.214 5.216 1.00 0.00 H new ATOM 0 HA ILE A 86 3.633 -6.312 4.279 1.00 0.00 H new ATOM 0 HB ILE A 86 5.462 -6.273 6.587 1.00 0.00 H new ATOM 0 HG12 ILE A 86 5.737 -8.768 6.217 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.620 -8.669 4.870 1.00 0.00 H new ATOM 0 HG21 ILE A 86 4.136 -8.228 7.594 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.211 -6.709 7.530 1.00 0.00 H new ATOM 0 HG23 ILE A 86 2.921 -7.978 6.317 1.00 0.00 H new ATOM 0 HD11 ILE A 86 6.902 -8.910 4.100 1.00 0.00 H new ATOM 0 HD12 ILE A 86 6.243 -7.333 3.604 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.377 -7.433 4.972 1.00 0.00 H new ATOM 1398 N GLY A 87 2.060 -5.115 6.043 1.00 0.00 N ATOM 1399 CA GLY A 87 1.449 -4.584 7.253 1.00 0.00 C ATOM 1400 C GLY A 87 0.365 -5.506 7.773 1.00 0.00 C ATOM 1401 O GLY A 87 0.129 -6.564 7.144 1.00 0.00 O ATOM 0 H GLY A 87 1.471 -5.759 5.515 1.00 0.00 H new ATOM 0 HA2 GLY A 87 2.212 -4.449 8.019 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.025 -3.601 7.048 1.00 0.00 H new TER 1405 GLY A 87