USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1050 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 29 LYS NZ :NH3+ -169:sc= 0.175 (180deg=0.0819) USER MOD Set 1.2: A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 49:sc= 0.377 USER MOD Single : A 9 TYR OH : rot -115:sc= -0.2 USER MOD Single : A 13 LYS NZ :NH3+ 162:sc= -0.0506 (180deg=-0.33) USER MOD Single : A 16 MET CE :methyl 163:sc= -0.107 (180deg=-0.497) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 179:sc= 0.477 (180deg=0.476) USER MOD Single : A 24 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0827) USER MOD Single : A 35 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0105) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0.705 (180deg=0.705) USER MOD Single : A 41 MET CE :methyl -158:sc= -1.19 (180deg=-2.3!) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 100:sc= -0.249 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 MET CE :methyl -164:sc= -0.0262 (180deg=-0.318) USER MOD Single : A 71 GLN : amide:sc= -0.0527 X(o=-0.053,f=-0.028) USER MOD Single : A 75 THR OG1 : rot 80:sc= 1.17 USER MOD Single : A 83 THR OG1 : rot -120:sc= 0.112 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 173:sc= 0.609 (180deg=0.582) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 MET CE :methyl -169:sc= -2.1 (180deg=-2.41!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 72:sc= 1.22 USER MOD Single : A 106 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0389) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0.75 (180deg=0.75) USER MOD Single : A 110 MET CE :methyl -125:sc= -0.343 (180deg=-1.15) USER MOD Single : A 118 LYS NZ :NH3+ -145:sc= -0.026 (180deg=-0.494) USER MOD Single : A 119 LYS NZ :NH3+ 140:sc= -0.372 (180deg=-1.44) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ -113:sc= 0.525 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= -0.34 K(o=-0.34,f=-7!) USER MOD Single : A 136 TYR OH : rot -123:sc= -1.54! USER MOD ----------------------------------------------------------------- ATOM 29 N LYS A 3 3.704 2.701 -3.745 1.00 0.00 N ATOM 30 CA LYS A 3 3.130 3.653 -4.722 1.00 0.00 C ATOM 31 C LYS A 3 2.529 4.915 -4.053 1.00 0.00 C ATOM 32 O LYS A 3 2.373 5.944 -4.723 1.00 0.00 O ATOM 33 CB LYS A 3 2.034 2.970 -5.582 1.00 0.00 C ATOM 34 CG LYS A 3 0.817 2.433 -4.775 1.00 0.00 C ATOM 35 CD LYS A 3 -0.436 2.184 -5.653 1.00 0.00 C ATOM 36 CE LYS A 3 -1.036 3.486 -6.217 1.00 0.00 C ATOM 37 NZ LYS A 3 -2.242 3.242 -7.047 1.00 0.00 N ATOM 0 HA LYS A 3 3.960 3.969 -5.354 1.00 0.00 H new ATOM 0 HB2 LYS A 3 1.675 3.684 -6.323 1.00 0.00 H new ATOM 0 HB3 LYS A 3 2.484 2.142 -6.129 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.098 1.502 -4.282 1.00 0.00 H new ATOM 0 HG3 LYS A 3 0.567 3.146 -3.990 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -0.170 1.524 -6.479 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.192 1.667 -5.062 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -1.294 4.150 -5.392 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -0.284 3.999 -6.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -2.608 4.148 -7.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.993 2.630 -7.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -2.972 2.777 -6.471 1.00 0.00 H new ATOM 51 N ILE A 4 2.188 4.805 -2.739 1.00 0.00 N ATOM 52 CA ILE A 4 1.491 5.867 -1.969 1.00 0.00 C ATOM 53 C ILE A 4 0.064 6.072 -2.582 1.00 0.00 C ATOM 54 O ILE A 4 -0.412 5.204 -3.325 1.00 0.00 O ATOM 55 CB ILE A 4 2.383 7.206 -1.858 1.00 0.00 C ATOM 56 CG1 ILE A 4 3.852 6.858 -1.427 1.00 0.00 C ATOM 57 CG2 ILE A 4 1.805 8.269 -0.868 1.00 0.00 C ATOM 58 CD1 ILE A 4 3.984 6.192 -0.063 1.00 0.00 C ATOM 0 H ILE A 4 2.391 3.973 -2.185 1.00 0.00 H new ATOM 0 HA ILE A 4 1.354 5.563 -0.931 1.00 0.00 H new ATOM 0 HB ILE A 4 2.368 7.648 -2.854 1.00 0.00 H new ATOM 0 HG12 ILE A 4 4.289 6.201 -2.179 1.00 0.00 H new ATOM 0 HG13 ILE A 4 4.441 7.775 -1.425 1.00 0.00 H new ATOM 0 HG21 ILE A 4 2.459 9.141 -0.847 1.00 0.00 H new ATOM 0 HG22 ILE A 4 0.810 8.570 -1.197 1.00 0.00 H new ATOM 0 HG23 ILE A 4 1.742 7.839 0.132 1.00 0.00 H new ATOM 0 HD11 ILE A 4 5.035 5.992 0.144 1.00 0.00 H new ATOM 0 HD12 ILE A 4 3.583 6.853 0.705 1.00 0.00 H new ATOM 0 HD13 ILE A 4 3.429 5.254 -0.061 1.00 0.00 H new ATOM 70 N VAL A 5 -0.669 7.084 -2.109 1.00 0.00 N ATOM 71 CA VAL A 5 -1.800 7.725 -2.825 1.00 0.00 C ATOM 72 C VAL A 5 -1.893 9.174 -2.324 1.00 0.00 C ATOM 73 O VAL A 5 -2.105 10.106 -3.104 1.00 0.00 O ATOM 74 CB VAL A 5 -3.219 6.999 -2.668 1.00 0.00 C ATOM 75 CG1 VAL A 5 -3.393 5.821 -3.660 1.00 0.00 C ATOM 76 CG2 VAL A 5 -3.478 6.532 -1.219 1.00 0.00 C ATOM 0 H VAL A 5 -0.496 7.499 -1.193 1.00 0.00 H new ATOM 0 HA VAL A 5 -1.583 7.657 -3.891 1.00 0.00 H new ATOM 0 HB VAL A 5 -3.968 7.752 -2.915 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -4.371 5.363 -3.513 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.316 6.192 -4.682 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -2.614 5.079 -3.484 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.452 6.046 -1.162 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.702 5.827 -0.920 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -3.463 7.393 -0.551 1.00 0.00 H new ATOM 86 N GLY A 6 -1.740 9.335 -0.995 1.00 0.00 N ATOM 87 CA GLY A 6 -1.737 10.634 -0.346 1.00 0.00 C ATOM 88 C GLY A 6 -1.301 10.560 1.105 1.00 0.00 C ATOM 89 O GLY A 6 -0.604 9.628 1.513 1.00 0.00 O ATOM 0 H GLY A 6 -1.615 8.555 -0.350 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -1.071 11.305 -0.888 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -2.737 11.065 -0.400 1.00 0.00 H new ATOM 93 N VAL A 7 -1.659 11.584 1.877 1.00 0.00 N ATOM 94 CA VAL A 7 -1.480 11.596 3.339 1.00 0.00 C ATOM 95 C VAL A 7 -2.833 11.924 4.000 1.00 0.00 C ATOM 96 O VAL A 7 -3.696 12.555 3.384 1.00 0.00 O ATOM 97 CB VAL A 7 -0.355 12.623 3.776 1.00 0.00 C ATOM 98 CG1 VAL A 7 -0.762 14.092 3.492 1.00 0.00 C ATOM 99 CG2 VAL A 7 0.069 12.430 5.259 1.00 0.00 C ATOM 0 H VAL A 7 -2.084 12.436 1.510 1.00 0.00 H new ATOM 0 HA VAL A 7 -1.146 10.613 3.671 1.00 0.00 H new ATOM 0 HB VAL A 7 0.517 12.405 3.159 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.040 14.759 3.808 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -0.941 14.220 2.424 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -1.671 14.331 4.044 1.00 0.00 H new ATOM 0 HG21 VAL A 7 0.842 13.155 5.514 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.795 12.578 5.907 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.458 11.421 5.398 1.00 0.00 H new ATOM 109 N THR A 8 -3.030 11.451 5.228 1.00 0.00 N ATOM 110 CA THR A 8 -4.210 11.763 6.039 1.00 0.00 C ATOM 111 C THR A 8 -3.748 12.368 7.368 1.00 0.00 C ATOM 112 O THR A 8 -2.788 11.887 7.984 1.00 0.00 O ATOM 113 CB THR A 8 -5.137 10.506 6.257 1.00 0.00 C ATOM 114 OG1 THR A 8 -6.226 10.820 7.148 1.00 0.00 O ATOM 115 CG2 THR A 8 -4.376 9.279 6.789 1.00 0.00 C ATOM 0 H THR A 8 -2.368 10.832 5.696 1.00 0.00 H new ATOM 0 HA THR A 8 -4.823 12.489 5.505 1.00 0.00 H new ATOM 0 HB THR A 8 -5.527 10.247 5.273 1.00 0.00 H new ATOM 0 HG1 THR A 8 -6.652 11.655 6.863 1.00 0.00 H new ATOM 0 HG21 THR A 8 -5.070 8.448 6.918 1.00 0.00 H new ATOM 0 HG22 THR A 8 -3.599 8.996 6.078 1.00 0.00 H new ATOM 0 HG23 THR A 8 -3.919 9.522 7.748 1.00 0.00 H new ATOM 123 N TYR A 9 -4.404 13.461 7.780 1.00 0.00 N ATOM 124 CA TYR A 9 -4.087 14.180 9.033 1.00 0.00 C ATOM 125 C TYR A 9 -5.357 14.349 9.877 1.00 0.00 C ATOM 126 O TYR A 9 -6.454 14.428 9.321 1.00 0.00 O ATOM 127 CB TYR A 9 -3.418 15.572 8.743 1.00 0.00 C ATOM 128 CG TYR A 9 -1.881 15.569 8.819 1.00 0.00 C ATOM 129 CD1 TYR A 9 -1.088 15.255 7.712 1.00 0.00 C ATOM 130 CD2 TYR A 9 -1.229 15.878 10.017 1.00 0.00 C ATOM 131 CE1 TYR A 9 0.293 15.250 7.803 1.00 0.00 C ATOM 132 CE2 TYR A 9 0.143 15.875 10.107 1.00 0.00 C ATOM 133 CZ TYR A 9 0.901 15.562 9.002 1.00 0.00 C ATOM 134 OH TYR A 9 2.274 15.549 9.109 1.00 0.00 O ATOM 0 H TYR A 9 -5.173 13.877 7.255 1.00 0.00 H new ATOM 0 HA TYR A 9 -3.367 13.585 9.595 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -3.719 15.906 7.750 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -3.803 16.302 9.455 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -1.560 15.013 6.771 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -1.816 16.124 10.890 1.00 0.00 H new ATOM 0 HE1 TYR A 9 0.892 15.003 6.939 1.00 0.00 H new ATOM 0 HE2 TYR A 9 0.625 16.118 11.043 1.00 0.00 H new ATOM 0 HH TYR A 9 2.547 14.839 9.727 1.00 0.00 H new ATOM 144 N PRO A 10 -5.214 14.415 11.245 1.00 0.00 N ATOM 145 CA PRO A 10 -6.349 14.665 12.159 1.00 0.00 C ATOM 146 C PRO A 10 -6.935 16.073 11.972 1.00 0.00 C ATOM 147 O PRO A 10 -8.143 16.261 12.103 1.00 0.00 O ATOM 148 CB PRO A 10 -5.718 14.490 13.565 1.00 0.00 C ATOM 149 CG PRO A 10 -4.275 14.806 13.367 1.00 0.00 C ATOM 150 CD PRO A 10 -3.941 14.242 12.011 1.00 0.00 C ATOM 0 HA PRO A 10 -7.189 13.993 11.983 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -6.175 15.161 14.292 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -5.855 13.475 13.938 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -4.097 15.881 13.403 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -3.661 14.354 14.146 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -3.115 14.778 11.545 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -3.647 13.194 12.072 1.00 0.00 H new ATOM 158 N ILE A 11 -6.035 17.044 11.655 1.00 0.00 N ATOM 159 CA ILE A 11 -6.370 18.466 11.421 1.00 0.00 C ATOM 160 C ILE A 11 -6.849 19.155 12.733 1.00 0.00 C ATOM 161 O ILE A 11 -7.667 18.586 13.477 1.00 0.00 O ATOM 162 CB ILE A 11 -7.448 18.651 10.266 1.00 0.00 C ATOM 163 CG1 ILE A 11 -6.969 17.971 8.947 1.00 0.00 C ATOM 164 CG2 ILE A 11 -7.794 20.145 10.018 1.00 0.00 C ATOM 165 CD1 ILE A 11 -5.719 18.578 8.330 1.00 0.00 C ATOM 0 H ILE A 11 -5.039 16.850 11.554 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.453 18.952 11.089 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.362 18.160 10.601 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.782 16.916 9.147 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.777 18.019 8.217 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.534 20.220 9.221 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -8.199 20.581 10.931 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.892 20.684 9.728 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.465 18.038 7.418 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.903 19.626 8.092 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.892 18.506 9.037 1.00 0.00 H new ATOM 177 N PRO A 12 -6.324 20.381 13.071 1.00 0.00 N ATOM 178 CA PRO A 12 -6.942 21.235 14.108 1.00 0.00 C ATOM 179 C PRO A 12 -8.403 21.546 13.724 1.00 0.00 C ATOM 180 O PRO A 12 -8.641 22.264 12.747 1.00 0.00 O ATOM 181 CB PRO A 12 -6.058 22.518 14.115 1.00 0.00 C ATOM 182 CG PRO A 12 -4.749 22.076 13.524 1.00 0.00 C ATOM 183 CD PRO A 12 -5.093 21.004 12.508 1.00 0.00 C ATOM 0 HA PRO A 12 -6.982 20.769 15.093 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -6.511 23.315 13.525 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -5.927 22.904 15.126 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -4.232 22.911 13.051 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -4.085 21.685 14.295 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -5.273 21.429 11.520 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -4.287 20.278 12.401 1.00 0.00 H new ATOM 191 N LYS A 13 -9.372 20.979 14.481 1.00 0.00 N ATOM 192 CA LYS A 13 -10.817 21.094 14.159 1.00 0.00 C ATOM 193 C LYS A 13 -11.353 22.533 14.348 1.00 0.00 C ATOM 194 O LYS A 13 -12.517 22.824 14.049 1.00 0.00 O ATOM 195 CB LYS A 13 -11.651 20.068 14.968 1.00 0.00 C ATOM 196 CG LYS A 13 -11.712 20.316 16.486 1.00 0.00 C ATOM 197 CD LYS A 13 -12.513 19.221 17.228 1.00 0.00 C ATOM 198 CE LYS A 13 -12.846 19.615 18.665 1.00 0.00 C ATOM 199 NZ LYS A 13 -13.761 20.788 18.717 1.00 0.00 N ATOM 0 H LYS A 13 -9.179 20.435 15.322 1.00 0.00 H new ATOM 0 HA LYS A 13 -10.926 20.859 13.100 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.668 20.063 14.577 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -11.239 19.074 14.796 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -10.699 20.356 16.886 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -12.168 21.288 16.675 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -13.437 19.021 16.686 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -11.939 18.295 17.232 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -13.308 18.770 19.176 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -11.926 19.847 19.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -14.204 20.842 19.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -13.220 21.658 18.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -14.499 20.685 17.992 1.00 0.00 H new ATOM 213 N ARG A 14 -10.467 23.413 14.842 1.00 0.00 N ATOM 214 CA ARG A 14 -10.687 24.859 14.922 1.00 0.00 C ATOM 215 C ARG A 14 -10.749 25.441 13.489 1.00 0.00 C ATOM 216 O ARG A 14 -11.563 26.316 13.189 1.00 0.00 O ATOM 217 CB ARG A 14 -9.532 25.547 15.727 1.00 0.00 C ATOM 218 CG ARG A 14 -9.383 25.153 17.233 1.00 0.00 C ATOM 219 CD ARG A 14 -8.912 23.696 17.473 1.00 0.00 C ATOM 220 NE ARG A 14 -8.586 23.428 18.891 1.00 0.00 N ATOM 221 CZ ARG A 14 -9.276 22.644 19.732 1.00 0.00 C ATOM 222 NH1 ARG A 14 -10.423 22.087 19.367 1.00 0.00 N ATOM 223 NH2 ARG A 14 -8.818 22.441 20.954 1.00 0.00 N ATOM 0 H ARG A 14 -9.557 23.128 15.205 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.627 25.050 15.440 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -8.590 25.326 15.224 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -9.677 26.626 15.672 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -8.674 25.833 17.705 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -10.342 25.298 17.730 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -9.692 23.008 17.147 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -8.034 23.496 16.859 1.00 0.00 H new ATOM 0 HE ARG A 14 -7.754 23.885 19.266 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -10.795 22.252 18.432 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -10.933 21.494 20.022 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -7.946 22.879 21.251 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -9.336 21.846 21.601 1.00 0.00 H new ATOM 237 N PHE A 15 -9.853 24.928 12.617 1.00 0.00 N ATOM 238 CA PHE A 15 -9.720 25.359 11.205 1.00 0.00 C ATOM 239 C PHE A 15 -10.046 24.215 10.217 1.00 0.00 C ATOM 240 O PHE A 15 -9.698 24.302 9.034 1.00 0.00 O ATOM 241 CB PHE A 15 -8.278 25.851 10.951 1.00 0.00 C ATOM 242 CG PHE A 15 -7.814 26.977 11.866 1.00 0.00 C ATOM 243 CD1 PHE A 15 -8.187 28.296 11.619 1.00 0.00 C ATOM 244 CD2 PHE A 15 -6.997 26.717 12.966 1.00 0.00 C ATOM 245 CE1 PHE A 15 -7.760 29.316 12.443 1.00 0.00 C ATOM 246 CE2 PHE A 15 -6.571 27.739 13.789 1.00 0.00 C ATOM 247 CZ PHE A 15 -6.953 29.036 13.526 1.00 0.00 C ATOM 0 H PHE A 15 -9.193 24.194 12.876 1.00 0.00 H new ATOM 0 HA PHE A 15 -10.435 26.164 11.036 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.597 25.007 11.063 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -8.201 26.188 9.917 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -8.818 28.523 10.772 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -6.694 25.702 13.176 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -8.058 30.334 12.240 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -5.939 27.523 14.638 1.00 0.00 H new ATOM 0 HZ PHE A 15 -6.620 29.836 14.170 1.00 0.00 H new ATOM 257 N MET A 16 -10.709 23.155 10.702 1.00 0.00 N ATOM 258 CA MET A 16 -11.090 21.987 9.869 1.00 0.00 C ATOM 259 C MET A 16 -12.050 22.416 8.753 1.00 0.00 C ATOM 260 O MET A 16 -11.842 22.108 7.578 1.00 0.00 O ATOM 261 CB MET A 16 -11.747 20.912 10.763 1.00 0.00 C ATOM 262 CG MET A 16 -12.156 19.609 10.067 1.00 0.00 C ATOM 263 SD MET A 16 -12.837 18.396 11.230 1.00 0.00 S ATOM 264 CE MET A 16 -14.275 19.256 11.877 1.00 0.00 C ATOM 0 H MET A 16 -10.999 23.076 11.677 1.00 0.00 H new ATOM 0 HA MET A 16 -10.196 21.570 9.405 1.00 0.00 H new ATOM 0 HB2 MET A 16 -11.055 20.667 11.569 1.00 0.00 H new ATOM 0 HB3 MET A 16 -12.634 21.346 11.225 1.00 0.00 H new ATOM 0 HG2 MET A 16 -12.896 19.827 9.297 1.00 0.00 H new ATOM 0 HG3 MET A 16 -11.289 19.180 9.564 1.00 0.00 H new ATOM 0 HE1 MET A 16 -14.942 18.540 12.356 1.00 0.00 H new ATOM 0 HE2 MET A 16 -13.956 20.000 12.607 1.00 0.00 H new ATOM 0 HE3 MET A 16 -14.801 19.751 11.061 1.00 0.00 H new ATOM 274 N ASP A 17 -13.061 23.198 9.146 1.00 0.00 N ATOM 275 CA ASP A 17 -14.146 23.646 8.258 1.00 0.00 C ATOM 276 C ASP A 17 -13.690 24.716 7.246 1.00 0.00 C ATOM 277 O ASP A 17 -14.492 25.130 6.417 1.00 0.00 O ATOM 278 CB ASP A 17 -15.331 24.166 9.109 1.00 0.00 C ATOM 279 CG ASP A 17 -15.968 23.057 9.966 1.00 0.00 C ATOM 280 OD1 ASP A 17 -15.368 22.661 10.994 1.00 0.00 O ATOM 281 OD2 ASP A 17 -17.065 22.567 9.612 1.00 0.00 O ATOM 0 H ASP A 17 -13.153 23.544 10.101 1.00 0.00 H new ATOM 0 HA ASP A 17 -14.464 22.785 7.669 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -14.984 24.969 9.759 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -16.088 24.593 8.451 1.00 0.00 H new ATOM 286 N ARG A 18 -12.405 25.152 7.313 1.00 0.00 N ATOM 287 CA ARG A 18 -11.811 26.081 6.316 1.00 0.00 C ATOM 288 C ARG A 18 -11.785 25.430 4.935 1.00 0.00 C ATOM 289 O ARG A 18 -12.295 26.003 3.970 1.00 0.00 O ATOM 290 CB ARG A 18 -10.380 26.510 6.746 1.00 0.00 C ATOM 291 CG ARG A 18 -10.365 27.423 7.989 1.00 0.00 C ATOM 292 CD ARG A 18 -11.004 28.818 7.738 1.00 0.00 C ATOM 293 NE ARG A 18 -9.996 29.885 7.643 1.00 0.00 N ATOM 294 CZ ARG A 18 -10.218 31.183 7.878 1.00 0.00 C ATOM 295 NH1 ARG A 18 -11.439 31.643 8.115 1.00 0.00 N ATOM 296 NH2 ARG A 18 -9.208 32.022 7.845 1.00 0.00 N ATOM 0 H ARG A 18 -11.758 24.873 8.051 1.00 0.00 H new ATOM 0 HA ARG A 18 -12.432 26.976 6.267 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -9.787 25.619 6.951 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -9.899 27.029 5.917 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -10.898 26.928 8.801 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -9.335 27.557 8.320 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.586 28.788 6.817 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.698 29.048 8.546 1.00 0.00 H new ATOM 0 HE ARG A 18 -9.050 29.613 7.376 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -12.233 31.003 8.121 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -11.584 32.637 8.292 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -8.268 31.681 7.642 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -9.363 33.014 8.022 1.00 0.00 H new ATOM 310 N PHE A 19 -11.265 24.194 4.885 1.00 0.00 N ATOM 311 CA PHE A 19 -11.125 23.422 3.634 1.00 0.00 C ATOM 312 C PHE A 19 -12.515 23.160 3.003 1.00 0.00 C ATOM 313 O PHE A 19 -12.660 23.120 1.781 1.00 0.00 O ATOM 314 CB PHE A 19 -10.418 22.061 3.925 1.00 0.00 C ATOM 315 CG PHE A 19 -9.063 22.167 4.636 1.00 0.00 C ATOM 316 CD1 PHE A 19 -8.986 22.327 6.020 1.00 0.00 C ATOM 317 CD2 PHE A 19 -7.869 22.106 3.920 1.00 0.00 C ATOM 318 CE1 PHE A 19 -7.769 22.425 6.659 1.00 0.00 C ATOM 319 CE2 PHE A 19 -6.652 22.203 4.561 1.00 0.00 C ATOM 320 CZ PHE A 19 -6.603 22.364 5.929 1.00 0.00 C ATOM 0 H PHE A 19 -10.928 23.698 5.710 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.522 24.001 2.934 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -11.082 21.448 4.534 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -10.275 21.535 2.981 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -9.896 22.375 6.600 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -7.897 21.981 2.848 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.730 22.550 7.731 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.736 22.153 3.991 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.649 22.442 6.429 1.00 0.00 H new ATOM 330 N PHE A 20 -13.541 23.084 3.872 1.00 0.00 N ATOM 331 CA PHE A 20 -14.925 22.733 3.494 1.00 0.00 C ATOM 332 C PHE A 20 -15.796 23.995 3.294 1.00 0.00 C ATOM 333 O PHE A 20 -16.909 23.908 2.769 1.00 0.00 O ATOM 334 CB PHE A 20 -15.523 21.823 4.595 1.00 0.00 C ATOM 335 CG PHE A 20 -14.659 20.593 4.908 1.00 0.00 C ATOM 336 CD1 PHE A 20 -14.524 19.562 3.985 1.00 0.00 C ATOM 337 CD2 PHE A 20 -13.992 20.465 6.122 1.00 0.00 C ATOM 338 CE1 PHE A 20 -13.757 18.449 4.269 1.00 0.00 C ATOM 339 CE2 PHE A 20 -13.222 19.354 6.401 1.00 0.00 C ATOM 340 CZ PHE A 20 -13.108 18.345 5.474 1.00 0.00 C ATOM 0 H PHE A 20 -13.431 23.267 4.869 1.00 0.00 H new ATOM 0 HA PHE A 20 -14.911 22.203 2.542 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -15.654 22.407 5.506 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -16.514 21.492 4.283 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -15.026 19.632 3.032 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -14.078 21.249 6.860 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -13.668 17.657 3.540 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -12.709 19.277 7.348 1.00 0.00 H new ATOM 0 HZ PHE A 20 -12.510 17.473 5.693 1.00 0.00 H new ATOM 350 N LYS A 21 -15.284 25.156 3.737 1.00 0.00 N ATOM 351 CA LYS A 21 -15.934 26.470 3.543 1.00 0.00 C ATOM 352 C LYS A 21 -15.722 26.936 2.102 1.00 0.00 C ATOM 353 O LYS A 21 -16.665 27.327 1.407 1.00 0.00 O ATOM 354 CB LYS A 21 -15.349 27.502 4.575 1.00 0.00 C ATOM 355 CG LYS A 21 -15.828 28.985 4.456 1.00 0.00 C ATOM 356 CD LYS A 21 -14.962 29.849 3.495 1.00 0.00 C ATOM 357 CE LYS A 21 -15.480 31.289 3.343 1.00 0.00 C ATOM 358 NZ LYS A 21 -14.702 32.056 2.326 1.00 0.00 N ATOM 0 H LYS A 21 -14.401 25.213 4.244 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.007 26.388 3.718 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -15.590 27.149 5.578 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -14.263 27.490 4.485 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.861 28.997 4.109 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.820 29.440 5.446 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -13.937 29.876 3.865 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.935 29.374 2.514 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.531 31.268 3.056 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -15.422 31.799 4.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -15.082 33.021 2.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -13.703 32.098 2.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -14.778 31.584 1.402 1.00 0.00 H new ATOM 372 N LYS A 22 -14.458 26.886 1.677 1.00 0.00 N ATOM 373 CA LYS A 22 -14.004 27.489 0.408 1.00 0.00 C ATOM 374 C LYS A 22 -13.843 26.439 -0.706 1.00 0.00 C ATOM 375 O LYS A 22 -13.768 26.796 -1.886 1.00 0.00 O ATOM 376 CB LYS A 22 -12.674 28.240 0.686 1.00 0.00 C ATOM 377 CG LYS A 22 -11.545 27.346 1.252 1.00 0.00 C ATOM 378 CD LYS A 22 -10.367 28.135 1.880 1.00 0.00 C ATOM 379 CE LYS A 22 -10.731 28.882 3.178 1.00 0.00 C ATOM 380 NZ LYS A 22 -9.542 29.572 3.760 1.00 0.00 N ATOM 0 H LYS A 22 -13.713 26.426 2.200 1.00 0.00 H new ATOM 0 HA LYS A 22 -14.757 28.188 0.045 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.329 28.698 -0.241 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.868 29.050 1.389 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.966 26.681 2.006 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.160 26.715 0.451 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.551 27.443 2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.996 28.855 1.151 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -11.513 29.613 2.972 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.136 28.177 3.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -9.823 30.079 4.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -8.812 28.869 3.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -9.161 30.249 3.069 1.00 0.00 H new ATOM 394 N GLY A 23 -13.785 25.149 -0.325 1.00 0.00 N ATOM 395 CA GLY A 23 -13.664 24.047 -1.296 1.00 0.00 C ATOM 396 C GLY A 23 -12.238 23.795 -1.779 1.00 0.00 C ATOM 397 O GLY A 23 -11.982 22.780 -2.443 1.00 0.00 O ATOM 0 H GLY A 23 -13.820 24.845 0.648 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.049 23.134 -0.843 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.295 24.266 -2.158 1.00 0.00 H new ATOM 401 N LYS A 24 -11.317 24.728 -1.463 1.00 0.00 N ATOM 402 CA LYS A 24 -9.887 24.605 -1.765 1.00 0.00 C ATOM 403 C LYS A 24 -9.085 25.555 -0.849 1.00 0.00 C ATOM 404 O LYS A 24 -9.252 26.778 -0.899 1.00 0.00 O ATOM 405 CB LYS A 24 -9.577 24.874 -3.269 1.00 0.00 C ATOM 406 CG LYS A 24 -10.022 26.249 -3.806 1.00 0.00 C ATOM 407 CD LYS A 24 -9.413 26.564 -5.187 1.00 0.00 C ATOM 408 CE LYS A 24 -9.875 27.921 -5.736 1.00 0.00 C ATOM 409 NZ LYS A 24 -11.337 27.949 -5.989 1.00 0.00 N ATOM 0 H LYS A 24 -11.554 25.597 -0.985 1.00 0.00 H new ATOM 0 HA LYS A 24 -9.584 23.576 -1.569 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.503 24.774 -3.423 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.058 24.098 -3.865 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -11.109 26.274 -3.877 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.731 27.025 -3.098 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -8.326 26.557 -5.111 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -9.689 25.778 -5.890 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -9.615 28.707 -5.027 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -9.342 28.138 -6.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -11.587 28.829 -6.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.603 27.134 -6.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -11.847 27.903 -5.084 1.00 0.00 H new ATOM 423 N ASP A 25 -8.221 24.972 -0.012 1.00 0.00 N ATOM 424 CA ASP A 25 -7.485 25.686 1.057 1.00 0.00 C ATOM 425 C ASP A 25 -5.967 25.443 0.883 1.00 0.00 C ATOM 426 O ASP A 25 -5.561 24.863 -0.112 1.00 0.00 O ATOM 427 CB ASP A 25 -8.037 25.172 2.419 1.00 0.00 C ATOM 428 CG ASP A 25 -7.539 25.921 3.674 1.00 0.00 C ATOM 429 OD1 ASP A 25 -6.499 25.523 4.238 1.00 0.00 O ATOM 430 OD2 ASP A 25 -8.188 26.903 4.100 1.00 0.00 O ATOM 0 H ASP A 25 -8.004 23.976 -0.052 1.00 0.00 H new ATOM 0 HA ASP A 25 -7.630 26.765 1.012 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -9.125 25.230 2.393 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.776 24.119 2.521 1.00 0.00 H new ATOM 435 N VAL A 26 -5.125 25.945 1.803 1.00 0.00 N ATOM 436 CA VAL A 26 -3.672 25.668 1.838 1.00 0.00 C ATOM 437 C VAL A 26 -3.273 25.284 3.281 1.00 0.00 C ATOM 438 O VAL A 26 -3.297 26.125 4.190 1.00 0.00 O ATOM 439 CB VAL A 26 -2.814 26.896 1.323 1.00 0.00 C ATOM 440 CG1 VAL A 26 -1.295 26.681 1.549 1.00 0.00 C ATOM 441 CG2 VAL A 26 -3.102 27.181 -0.173 1.00 0.00 C ATOM 0 H VAL A 26 -5.435 26.562 2.554 1.00 0.00 H new ATOM 0 HA VAL A 26 -3.461 24.841 1.160 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.114 27.764 1.911 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.746 27.548 1.181 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -1.100 26.553 2.614 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.970 25.790 1.011 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.502 28.028 -0.504 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.848 26.302 -0.766 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.159 27.413 -0.302 1.00 0.00 H new ATOM 451 N PHE A 27 -2.924 24.001 3.477 1.00 0.00 N ATOM 452 CA PHE A 27 -2.532 23.453 4.784 1.00 0.00 C ATOM 453 C PHE A 27 -1.010 23.578 4.972 1.00 0.00 C ATOM 454 O PHE A 27 -0.240 22.878 4.308 1.00 0.00 O ATOM 455 CB PHE A 27 -2.975 21.968 4.898 1.00 0.00 C ATOM 456 CG PHE A 27 -2.750 21.339 6.274 1.00 0.00 C ATOM 457 CD1 PHE A 27 -3.428 21.819 7.392 1.00 0.00 C ATOM 458 CD2 PHE A 27 -1.884 20.263 6.450 1.00 0.00 C ATOM 459 CE1 PHE A 27 -3.253 21.252 8.635 1.00 0.00 C ATOM 460 CE2 PHE A 27 -1.710 19.695 7.695 1.00 0.00 C ATOM 461 CZ PHE A 27 -2.393 20.187 8.788 1.00 0.00 C ATOM 0 H PHE A 27 -2.906 23.311 2.726 1.00 0.00 H new ATOM 0 HA PHE A 27 -3.028 24.022 5.570 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.034 21.899 4.650 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -2.435 21.383 4.153 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -4.105 22.653 7.282 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -1.343 19.869 5.603 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -3.789 21.642 9.488 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -1.035 18.860 7.815 1.00 0.00 H new ATOM 0 HZ PHE A 27 -2.254 19.739 9.761 1.00 0.00 H new ATOM 471 N VAL A 28 -0.580 24.478 5.872 1.00 0.00 N ATOM 472 CA VAL A 28 0.844 24.658 6.193 1.00 0.00 C ATOM 473 C VAL A 28 1.298 23.665 7.283 1.00 0.00 C ATOM 474 O VAL A 28 0.643 23.499 8.323 1.00 0.00 O ATOM 475 CB VAL A 28 1.193 26.138 6.614 1.00 0.00 C ATOM 476 CG1 VAL A 28 1.047 27.097 5.408 1.00 0.00 C ATOM 477 CG2 VAL A 28 0.329 26.624 7.799 1.00 0.00 C ATOM 0 H VAL A 28 -1.203 25.095 6.392 1.00 0.00 H new ATOM 0 HA VAL A 28 1.394 24.449 5.276 1.00 0.00 H new ATOM 0 HB VAL A 28 2.231 26.143 6.945 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.292 28.113 5.719 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.725 26.787 4.613 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.021 27.067 5.042 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.604 27.647 8.054 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.724 26.590 7.519 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.497 25.978 8.661 1.00 0.00 H new ATOM 487 N LYS A 29 2.397 22.967 6.987 1.00 0.00 N ATOM 488 CA LYS A 29 3.130 22.117 7.930 1.00 0.00 C ATOM 489 C LYS A 29 4.514 22.735 8.212 1.00 0.00 C ATOM 490 O LYS A 29 5.122 23.286 7.307 1.00 0.00 O ATOM 491 CB LYS A 29 3.294 20.676 7.345 1.00 0.00 C ATOM 492 CG LYS A 29 2.010 19.820 7.387 1.00 0.00 C ATOM 493 CD LYS A 29 1.486 19.602 8.833 1.00 0.00 C ATOM 494 CE LYS A 29 2.489 18.881 9.740 1.00 0.00 C ATOM 495 NZ LYS A 29 1.960 18.674 11.108 1.00 0.00 N ATOM 0 H LYS A 29 2.814 22.978 6.056 1.00 0.00 H new ATOM 0 HA LYS A 29 2.569 22.051 8.862 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.631 20.753 6.311 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.078 20.160 7.898 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.235 20.304 6.793 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.207 18.852 6.926 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.240 20.569 9.272 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.562 19.025 8.794 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.744 17.916 9.301 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.410 19.461 9.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.728 18.356 11.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.568 19.568 11.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 1.211 17.952 11.085 1.00 0.00 H new ATOM 509 N PRO A 30 5.033 22.662 9.474 1.00 0.00 N ATOM 510 CA PRO A 30 6.453 22.995 9.781 1.00 0.00 C ATOM 511 C PRO A 30 7.420 21.845 9.396 1.00 0.00 C ATOM 512 O PRO A 30 8.328 21.521 10.162 1.00 0.00 O ATOM 513 CB PRO A 30 6.411 23.240 11.313 1.00 0.00 C ATOM 514 CG PRO A 30 5.313 22.344 11.806 1.00 0.00 C ATOM 515 CD PRO A 30 4.268 22.328 10.705 1.00 0.00 C ATOM 0 HA PRO A 30 6.830 23.848 9.217 1.00 0.00 H new ATOM 0 HB2 PRO A 30 7.364 22.994 11.781 1.00 0.00 H new ATOM 0 HB3 PRO A 30 6.204 24.285 11.542 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.687 21.340 12.005 1.00 0.00 H new ATOM 0 HG3 PRO A 30 4.892 22.718 12.739 1.00 0.00 H new ATOM 0 HD2 PRO A 30 3.789 21.352 10.624 1.00 0.00 H new ATOM 0 HD3 PRO A 30 3.479 23.056 10.894 1.00 0.00 H new ATOM 523 N ALA A 31 7.232 21.291 8.172 1.00 0.00 N ATOM 524 CA ALA A 31 7.924 20.082 7.666 1.00 0.00 C ATOM 525 C ALA A 31 7.919 18.923 8.693 1.00 0.00 C ATOM 526 O ALA A 31 8.847 18.788 9.503 1.00 0.00 O ATOM 527 CB ALA A 31 9.352 20.416 7.187 1.00 0.00 C ATOM 0 H ALA A 31 6.579 21.683 7.494 1.00 0.00 H new ATOM 0 HA ALA A 31 7.358 19.729 6.804 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.835 19.510 6.822 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.304 21.151 6.383 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.928 20.824 8.017 1.00 0.00 H new ATOM 533 N THR A 32 6.842 18.120 8.677 1.00 0.00 N ATOM 534 CA THR A 32 6.691 16.930 9.553 1.00 0.00 C ATOM 535 C THR A 32 6.475 15.659 8.684 1.00 0.00 C ATOM 536 O THR A 32 6.220 14.563 9.195 1.00 0.00 O ATOM 537 CB THR A 32 5.485 17.145 10.544 1.00 0.00 C ATOM 538 OG1 THR A 32 5.493 18.501 11.039 1.00 0.00 O ATOM 539 CG2 THR A 32 5.512 16.180 11.750 1.00 0.00 C ATOM 0 H THR A 32 6.046 18.272 8.057 1.00 0.00 H new ATOM 0 HA THR A 32 7.599 16.794 10.141 1.00 0.00 H new ATOM 0 HB THR A 32 4.578 16.940 9.975 1.00 0.00 H new ATOM 0 HG1 THR A 32 4.740 18.629 11.653 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.656 16.379 12.394 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.467 15.151 11.394 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.433 16.328 12.314 1.00 0.00 H new ATOM 547 N VAL A 33 6.618 15.826 7.358 1.00 0.00 N ATOM 548 CA VAL A 33 6.377 14.772 6.355 1.00 0.00 C ATOM 549 C VAL A 33 7.597 14.646 5.430 1.00 0.00 C ATOM 550 O VAL A 33 8.307 15.628 5.189 1.00 0.00 O ATOM 551 CB VAL A 33 5.085 15.070 5.501 1.00 0.00 C ATOM 552 CG1 VAL A 33 3.790 14.890 6.330 1.00 0.00 C ATOM 553 CG2 VAL A 33 5.147 16.484 4.878 1.00 0.00 C ATOM 0 H VAL A 33 6.909 16.712 6.945 1.00 0.00 H new ATOM 0 HA VAL A 33 6.219 13.833 6.885 1.00 0.00 H new ATOM 0 HB VAL A 33 5.058 14.339 4.693 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.924 15.105 5.704 1.00 0.00 H new ATOM 0 HG12 VAL A 33 3.730 13.864 6.692 1.00 0.00 H new ATOM 0 HG13 VAL A 33 3.803 15.574 7.178 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.244 16.664 4.294 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.221 17.228 5.671 1.00 0.00 H new ATOM 0 HG23 VAL A 33 6.020 16.558 4.229 1.00 0.00 H new ATOM 563 N TRP A 34 7.825 13.430 4.916 1.00 0.00 N ATOM 564 CA TRP A 34 8.976 13.121 4.044 1.00 0.00 C ATOM 565 C TRP A 34 8.701 13.560 2.588 1.00 0.00 C ATOM 566 O TRP A 34 7.665 14.172 2.290 1.00 0.00 O ATOM 567 CB TRP A 34 9.297 11.600 4.123 1.00 0.00 C ATOM 568 CG TRP A 34 9.446 11.089 5.540 1.00 0.00 C ATOM 569 CD1 TRP A 34 10.206 11.633 6.544 1.00 0.00 C ATOM 570 CD2 TRP A 34 8.816 9.931 6.104 1.00 0.00 C ATOM 571 NE1 TRP A 34 10.062 10.901 7.692 1.00 0.00 N ATOM 572 CE2 TRP A 34 9.220 9.849 7.448 1.00 0.00 C ATOM 573 CE3 TRP A 34 7.947 8.961 5.600 1.00 0.00 C ATOM 574 CZ2 TRP A 34 8.783 8.837 8.294 1.00 0.00 C ATOM 575 CZ3 TRP A 34 7.512 7.956 6.441 1.00 0.00 C ATOM 576 CH2 TRP A 34 7.929 7.902 7.777 1.00 0.00 C ATOM 0 H TRP A 34 7.218 12.629 5.091 1.00 0.00 H new ATOM 0 HA TRP A 34 9.844 13.680 4.392 1.00 0.00 H new ATOM 0 HB2 TRP A 34 8.503 11.043 3.625 1.00 0.00 H new ATOM 0 HB3 TRP A 34 10.218 11.402 3.575 1.00 0.00 H new ATOM 0 HD1 TRP A 34 10.827 12.511 6.444 1.00 0.00 H new ATOM 0 HE1 TRP A 34 10.510 11.106 8.585 1.00 0.00 H new ATOM 0 HE3 TRP A 34 7.621 8.996 4.571 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 9.106 8.790 9.323 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 6.840 7.200 6.063 1.00 0.00 H new ATOM 0 HH2 TRP A 34 7.569 7.106 8.412 1.00 0.00 H new ATOM 587 N LYS A 35 9.621 13.191 1.680 1.00 0.00 N ATOM 588 CA LYS A 35 9.592 13.606 0.258 1.00 0.00 C ATOM 589 C LYS A 35 8.493 12.897 -0.573 1.00 0.00 C ATOM 590 O LYS A 35 8.476 13.026 -1.804 1.00 0.00 O ATOM 591 CB LYS A 35 10.989 13.369 -0.375 1.00 0.00 C ATOM 592 CG LYS A 35 12.133 14.225 0.218 1.00 0.00 C ATOM 593 CD LYS A 35 11.963 15.747 -0.035 1.00 0.00 C ATOM 594 CE LYS A 35 11.823 16.109 -1.530 1.00 0.00 C ATOM 595 NZ LYS A 35 12.941 15.568 -2.351 1.00 0.00 N ATOM 0 H LYS A 35 10.414 12.592 1.910 1.00 0.00 H new ATOM 0 HA LYS A 35 9.341 14.667 0.239 1.00 0.00 H new ATOM 0 HB2 LYS A 35 11.248 12.316 -0.262 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.924 13.568 -1.445 1.00 0.00 H new ATOM 0 HG2 LYS A 35 12.190 14.047 1.292 1.00 0.00 H new ATOM 0 HG3 LYS A 35 13.080 13.897 -0.210 1.00 0.00 H new ATOM 0 HD2 LYS A 35 11.082 16.101 0.501 1.00 0.00 H new ATOM 0 HD3 LYS A 35 12.822 16.275 0.380 1.00 0.00 H new ATOM 0 HE2 LYS A 35 10.877 15.721 -1.908 1.00 0.00 H new ATOM 0 HE3 LYS A 35 11.789 17.193 -1.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 12.821 15.865 -3.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 13.846 15.931 -1.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 12.939 14.529 -2.299 1.00 0.00 H new ATOM 609 N GLU A 36 7.585 12.162 0.093 1.00 0.00 N ATOM 610 CA GLU A 36 6.402 11.569 -0.558 1.00 0.00 C ATOM 611 C GLU A 36 5.391 12.677 -0.916 1.00 0.00 C ATOM 612 O GLU A 36 4.635 12.549 -1.885 1.00 0.00 O ATOM 613 CB GLU A 36 5.735 10.512 0.367 1.00 0.00 C ATOM 614 CG GLU A 36 6.707 9.498 1.009 1.00 0.00 C ATOM 615 CD GLU A 36 7.592 8.779 -0.018 1.00 0.00 C ATOM 616 OE1 GLU A 36 7.085 7.891 -0.729 1.00 0.00 O ATOM 617 OE2 GLU A 36 8.793 9.115 -0.137 1.00 0.00 O ATOM 0 H GLU A 36 7.649 11.963 1.091 1.00 0.00 H new ATOM 0 HA GLU A 36 6.723 11.068 -1.471 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.200 11.033 1.162 1.00 0.00 H new ATOM 0 HB3 GLU A 36 4.991 9.963 -0.211 1.00 0.00 H new ATOM 0 HG2 GLU A 36 7.342 10.017 1.727 1.00 0.00 H new ATOM 0 HG3 GLU A 36 6.134 8.758 1.567 1.00 0.00 H new ATOM 624 N LEU A 37 5.390 13.767 -0.115 1.00 0.00 N ATOM 625 CA LEU A 37 4.501 14.919 -0.329 1.00 0.00 C ATOM 626 C LEU A 37 4.866 15.631 -1.648 1.00 0.00 C ATOM 627 O LEU A 37 5.879 16.331 -1.729 1.00 0.00 O ATOM 628 CB LEU A 37 4.541 15.907 0.896 1.00 0.00 C ATOM 629 CG LEU A 37 3.178 16.140 1.626 1.00 0.00 C ATOM 630 CD1 LEU A 37 2.100 16.675 0.660 1.00 0.00 C ATOM 631 CD2 LEU A 37 2.703 14.858 2.339 1.00 0.00 C ATOM 0 H LEU A 37 6.005 13.867 0.693 1.00 0.00 H new ATOM 0 HA LEU A 37 3.476 14.557 -0.410 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.260 15.527 1.622 1.00 0.00 H new ATOM 0 HB3 LEU A 37 4.916 16.870 0.550 1.00 0.00 H new ATOM 0 HG LEU A 37 3.341 16.904 2.386 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.167 16.825 1.203 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.430 17.624 0.236 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.941 15.955 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.753 15.050 2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.574 14.061 1.607 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.446 14.556 3.077 1.00 0.00 H new ATOM 643 N LYS A 38 4.035 15.426 -2.678 1.00 0.00 N ATOM 644 CA LYS A 38 4.258 15.986 -4.017 1.00 0.00 C ATOM 645 C LYS A 38 2.937 16.568 -4.567 1.00 0.00 C ATOM 646 O LYS A 38 1.858 16.086 -4.193 1.00 0.00 O ATOM 647 CB LYS A 38 4.861 14.872 -4.949 1.00 0.00 C ATOM 648 CG LYS A 38 3.912 13.698 -5.358 1.00 0.00 C ATOM 649 CD LYS A 38 3.100 13.969 -6.655 1.00 0.00 C ATOM 650 CE LYS A 38 3.986 14.266 -7.878 1.00 0.00 C ATOM 651 NZ LYS A 38 3.183 14.537 -9.098 1.00 0.00 N ATOM 0 H LYS A 38 3.186 14.865 -2.606 1.00 0.00 H new ATOM 0 HA LYS A 38 4.975 16.806 -3.975 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.220 15.350 -5.860 1.00 0.00 H new ATOM 0 HB3 LYS A 38 5.731 14.446 -4.449 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.506 12.794 -5.495 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.218 13.503 -4.540 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.474 13.103 -6.871 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.431 14.813 -6.487 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.621 15.126 -7.665 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.647 13.419 -8.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.820 14.732 -9.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.595 13.708 -9.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.571 15.362 -8.934 1.00 0.00 H new ATOM 665 N PRO A 39 2.998 17.584 -5.494 1.00 0.00 N ATOM 666 CA PRO A 39 1.796 18.141 -6.151 1.00 0.00 C ATOM 667 C PRO A 39 1.148 17.104 -7.097 1.00 0.00 C ATOM 668 O PRO A 39 1.611 16.891 -8.229 1.00 0.00 O ATOM 669 CB PRO A 39 2.335 19.377 -6.921 1.00 0.00 C ATOM 670 CG PRO A 39 3.784 19.074 -7.163 1.00 0.00 C ATOM 671 CD PRO A 39 4.241 18.262 -5.968 1.00 0.00 C ATOM 0 HA PRO A 39 1.009 18.408 -5.446 1.00 0.00 H new ATOM 0 HB2 PRO A 39 1.799 19.524 -7.859 1.00 0.00 H new ATOM 0 HB3 PRO A 39 2.213 20.290 -6.338 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.917 18.515 -8.089 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.365 19.991 -7.258 1.00 0.00 H new ATOM 0 HD2 PRO A 39 5.008 17.539 -6.246 1.00 0.00 H new ATOM 0 HD3 PRO A 39 4.669 18.898 -5.193 1.00 0.00 H new ATOM 679 N GLY A 40 0.119 16.413 -6.586 1.00 0.00 N ATOM 680 CA GLY A 40 -0.581 15.367 -7.334 1.00 0.00 C ATOM 681 C GLY A 40 -0.859 14.135 -6.489 1.00 0.00 C ATOM 682 O GLY A 40 -0.664 13.001 -6.946 1.00 0.00 O ATOM 0 H GLY A 40 -0.248 16.565 -5.646 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.523 15.764 -7.713 1.00 0.00 H new ATOM 0 HA3 GLY A 40 0.016 15.082 -8.200 1.00 0.00 H new ATOM 686 N MET A 41 -1.308 14.360 -5.248 1.00 0.00 N ATOM 687 CA MET A 41 -1.740 13.291 -4.324 1.00 0.00 C ATOM 688 C MET A 41 -3.151 13.602 -3.803 1.00 0.00 C ATOM 689 O MET A 41 -3.816 14.514 -4.300 1.00 0.00 O ATOM 690 CB MET A 41 -0.744 13.140 -3.137 1.00 0.00 C ATOM 691 CG MET A 41 0.635 12.567 -3.499 1.00 0.00 C ATOM 692 SD MET A 41 1.443 11.775 -2.085 1.00 0.00 S ATOM 693 CE MET A 41 1.370 13.047 -0.829 1.00 0.00 C ATOM 0 H MET A 41 -1.384 15.295 -4.849 1.00 0.00 H new ATOM 0 HA MET A 41 -1.755 12.346 -4.867 1.00 0.00 H new ATOM 0 HB2 MET A 41 -0.602 14.118 -2.678 1.00 0.00 H new ATOM 0 HB3 MET A 41 -1.199 12.497 -2.383 1.00 0.00 H new ATOM 0 HG2 MET A 41 0.524 11.841 -4.305 1.00 0.00 H new ATOM 0 HG3 MET A 41 1.271 13.368 -3.876 1.00 0.00 H new ATOM 0 HE1 MET A 41 2.140 12.863 -0.079 1.00 0.00 H new ATOM 0 HE2 MET A 41 1.536 14.022 -1.288 1.00 0.00 H new ATOM 0 HE3 MET A 41 0.389 13.033 -0.353 1.00 0.00 H new ATOM 703 N LYS A 42 -3.616 12.819 -2.822 1.00 0.00 N ATOM 704 CA LYS A 42 -4.846 13.117 -2.062 1.00 0.00 C ATOM 705 C LYS A 42 -4.503 13.447 -0.607 1.00 0.00 C ATOM 706 O LYS A 42 -3.444 13.088 -0.109 1.00 0.00 O ATOM 707 CB LYS A 42 -5.867 11.945 -2.123 1.00 0.00 C ATOM 708 CG LYS A 42 -5.274 10.530 -1.975 1.00 0.00 C ATOM 709 CD LYS A 42 -6.360 9.423 -1.871 1.00 0.00 C ATOM 710 CE LYS A 42 -7.403 9.485 -3.013 1.00 0.00 C ATOM 711 NZ LYS A 42 -8.332 8.324 -3.005 1.00 0.00 N ATOM 0 H LYS A 42 -3.153 11.959 -2.529 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.316 13.984 -2.527 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -6.608 12.092 -1.337 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -6.397 11.999 -3.074 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -4.631 10.321 -2.830 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -4.644 10.497 -1.086 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.876 8.446 -1.882 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -6.873 9.515 -0.914 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -7.979 10.406 -2.924 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -6.885 9.524 -3.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -9.009 8.416 -3.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -7.789 7.444 -3.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -8.849 8.299 -2.103 1.00 0.00 H new ATOM 725 N PHE A 43 -5.411 14.144 0.061 1.00 0.00 N ATOM 726 CA PHE A 43 -5.282 14.487 1.478 1.00 0.00 C ATOM 727 C PHE A 43 -6.626 14.232 2.150 1.00 0.00 C ATOM 728 O PHE A 43 -7.549 15.037 2.014 1.00 0.00 O ATOM 729 CB PHE A 43 -4.845 15.961 1.644 1.00 0.00 C ATOM 730 CG PHE A 43 -4.253 16.353 3.009 1.00 0.00 C ATOM 731 CD1 PHE A 43 -4.948 16.127 4.194 1.00 0.00 C ATOM 732 CD2 PHE A 43 -3.003 16.976 3.095 1.00 0.00 C ATOM 733 CE1 PHE A 43 -4.423 16.503 5.406 1.00 0.00 C ATOM 734 CE2 PHE A 43 -2.479 17.347 4.312 1.00 0.00 C ATOM 735 CZ PHE A 43 -3.189 17.111 5.466 1.00 0.00 C ATOM 0 H PHE A 43 -6.269 14.493 -0.366 1.00 0.00 H new ATOM 0 HA PHE A 43 -4.515 13.871 1.947 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -4.106 16.186 0.875 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -5.709 16.597 1.452 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -5.916 15.648 4.160 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -2.441 17.168 2.193 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -4.979 16.321 6.314 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -1.511 17.823 4.361 1.00 0.00 H new ATOM 0 HZ PHE A 43 -2.778 17.403 6.421 1.00 0.00 H new ATOM 745 N VAL A 44 -6.740 13.107 2.852 1.00 0.00 N ATOM 746 CA VAL A 44 -7.967 12.754 3.566 1.00 0.00 C ATOM 747 C VAL A 44 -7.949 13.398 4.963 1.00 0.00 C ATOM 748 O VAL A 44 -6.947 13.323 5.689 1.00 0.00 O ATOM 749 CB VAL A 44 -8.158 11.200 3.642 1.00 0.00 C ATOM 750 CG1 VAL A 44 -9.511 10.827 4.292 1.00 0.00 C ATOM 751 CG2 VAL A 44 -8.030 10.577 2.228 1.00 0.00 C ATOM 0 H VAL A 44 -5.992 12.419 2.942 1.00 0.00 H new ATOM 0 HA VAL A 44 -8.823 13.144 3.015 1.00 0.00 H new ATOM 0 HB VAL A 44 -7.371 10.791 4.276 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.610 9.742 4.329 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.552 11.229 5.304 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -10.326 11.246 3.702 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.164 9.497 2.293 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.793 10.999 1.574 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -7.042 10.796 1.822 1.00 0.00 H new ATOM 761 N PHE A 45 -9.045 14.075 5.306 1.00 0.00 N ATOM 762 CA PHE A 45 -9.183 14.789 6.577 1.00 0.00 C ATOM 763 C PHE A 45 -9.902 13.893 7.590 1.00 0.00 C ATOM 764 O PHE A 45 -11.077 13.558 7.405 1.00 0.00 O ATOM 765 CB PHE A 45 -9.963 16.109 6.370 1.00 0.00 C ATOM 766 CG PHE A 45 -9.328 17.043 5.346 1.00 0.00 C ATOM 767 CD1 PHE A 45 -8.093 17.628 5.591 1.00 0.00 C ATOM 768 CD2 PHE A 45 -9.952 17.323 4.138 1.00 0.00 C ATOM 769 CE1 PHE A 45 -7.502 18.463 4.669 1.00 0.00 C ATOM 770 CE2 PHE A 45 -9.360 18.154 3.220 1.00 0.00 C ATOM 771 CZ PHE A 45 -8.136 18.725 3.481 1.00 0.00 C ATOM 0 H PHE A 45 -9.867 14.144 4.707 1.00 0.00 H new ATOM 0 HA PHE A 45 -8.193 15.036 6.960 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -10.979 15.874 6.053 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -10.039 16.629 7.325 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -7.586 17.424 6.523 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -10.913 16.882 3.918 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -6.542 18.910 4.881 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -9.859 18.361 2.285 1.00 0.00 H new ATOM 0 HZ PHE A 45 -7.676 19.377 2.753 1.00 0.00 H new ATOM 781 N TYR A 46 -9.167 13.481 8.630 1.00 0.00 N ATOM 782 CA TYR A 46 -9.725 12.769 9.789 1.00 0.00 C ATOM 783 C TYR A 46 -10.481 13.774 10.676 1.00 0.00 C ATOM 784 O TYR A 46 -10.142 14.961 10.686 1.00 0.00 O ATOM 785 CB TYR A 46 -8.572 12.056 10.549 1.00 0.00 C ATOM 786 CG TYR A 46 -8.995 11.251 11.784 1.00 0.00 C ATOM 787 CD1 TYR A 46 -9.593 9.999 11.656 1.00 0.00 C ATOM 788 CD2 TYR A 46 -8.797 11.742 13.078 1.00 0.00 C ATOM 789 CE1 TYR A 46 -9.976 9.274 12.765 1.00 0.00 C ATOM 790 CE2 TYR A 46 -9.181 11.016 14.184 1.00 0.00 C ATOM 791 CZ TYR A 46 -9.770 9.784 14.021 1.00 0.00 C ATOM 792 OH TYR A 46 -10.155 9.060 15.121 1.00 0.00 O ATOM 0 H TYR A 46 -8.160 13.633 8.693 1.00 0.00 H new ATOM 0 HA TYR A 46 -10.436 12.004 9.477 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.064 11.385 9.856 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -7.845 12.807 10.858 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -9.760 9.589 10.671 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -8.334 12.709 13.213 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -10.438 8.305 12.644 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -9.020 11.413 15.175 1.00 0.00 H new ATOM 0 HH TYR A 46 -9.938 9.561 15.935 1.00 0.00 H new ATOM 896 N PHE A 54 -13.623 9.921 9.429 1.00 0.00 N ATOM 897 CA PHE A 54 -13.121 11.065 8.650 1.00 0.00 C ATOM 898 C PHE A 54 -14.230 12.122 8.489 1.00 0.00 C ATOM 899 O PHE A 54 -15.416 11.782 8.397 1.00 0.00 O ATOM 900 CB PHE A 54 -12.647 10.612 7.257 1.00 0.00 C ATOM 901 CG PHE A 54 -11.506 9.593 7.217 1.00 0.00 C ATOM 902 CD1 PHE A 54 -10.239 9.921 7.689 1.00 0.00 C ATOM 903 CD2 PHE A 54 -11.690 8.329 6.658 1.00 0.00 C ATOM 904 CE1 PHE A 54 -9.193 9.022 7.614 1.00 0.00 C ATOM 905 CE2 PHE A 54 -10.643 7.433 6.573 1.00 0.00 C ATOM 906 CZ PHE A 54 -9.393 7.780 7.051 1.00 0.00 C ATOM 0 HA PHE A 54 -12.277 11.497 9.188 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -13.501 10.188 6.728 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -12.334 11.495 6.700 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -10.070 10.896 8.122 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.664 8.047 6.287 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -8.220 9.292 7.996 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -10.801 6.460 6.132 1.00 0.00 H new ATOM 0 HZ PHE A 54 -8.574 7.079 6.983 1.00 0.00 H new ATOM 916 N VAL A 55 -13.821 13.398 8.444 1.00 0.00 N ATOM 917 CA VAL A 55 -14.722 14.538 8.174 1.00 0.00 C ATOM 918 C VAL A 55 -14.847 14.780 6.651 1.00 0.00 C ATOM 919 O VAL A 55 -15.897 15.232 6.172 1.00 0.00 O ATOM 920 CB VAL A 55 -14.222 15.836 8.925 1.00 0.00 C ATOM 921 CG1 VAL A 55 -12.734 16.127 8.635 1.00 0.00 C ATOM 922 CG2 VAL A 55 -15.091 17.080 8.616 1.00 0.00 C ATOM 0 H VAL A 55 -12.851 13.674 8.594 1.00 0.00 H new ATOM 0 HA VAL A 55 -15.713 14.296 8.557 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.329 15.625 9.989 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.428 17.027 9.169 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.127 15.284 8.966 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.594 16.276 7.564 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.700 17.941 9.159 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.066 17.284 7.546 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.119 16.892 8.926 1.00 0.00 H new ATOM 932 N GLY A 56 -13.780 14.456 5.898 1.00 0.00 N ATOM 933 CA GLY A 56 -13.775 14.623 4.444 1.00 0.00 C ATOM 934 C GLY A 56 -12.467 14.177 3.804 1.00 0.00 C ATOM 935 O GLY A 56 -11.741 13.363 4.383 1.00 0.00 O ATOM 0 H GLY A 56 -12.913 14.077 6.278 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -14.598 14.052 4.014 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -13.954 15.671 4.202 1.00 0.00 H new ATOM 939 N GLU A 57 -12.186 14.699 2.598 1.00 0.00 N ATOM 940 CA GLU A 57 -10.932 14.448 1.856 1.00 0.00 C ATOM 941 C GLU A 57 -10.657 15.631 0.905 1.00 0.00 C ATOM 942 O GLU A 57 -11.442 16.577 0.863 1.00 0.00 O ATOM 943 CB GLU A 57 -10.990 13.110 1.062 1.00 0.00 C ATOM 944 CG GLU A 57 -11.909 13.127 -0.176 1.00 0.00 C ATOM 945 CD GLU A 57 -11.980 11.781 -0.919 1.00 0.00 C ATOM 946 OE1 GLU A 57 -10.913 11.221 -1.259 1.00 0.00 O ATOM 947 OE2 GLU A 57 -13.093 11.281 -1.171 1.00 0.00 O ATOM 0 H GLU A 57 -12.830 15.315 2.102 1.00 0.00 H new ATOM 0 HA GLU A 57 -10.118 14.359 2.575 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -9.981 12.850 0.743 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.325 12.320 1.734 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.914 13.413 0.134 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -11.558 13.894 -0.866 1.00 0.00 H new ATOM 954 N ALA A 58 -9.529 15.570 0.173 1.00 0.00 N ATOM 955 CA ALA A 58 -9.125 16.598 -0.813 1.00 0.00 C ATOM 956 C ALA A 58 -7.986 16.070 -1.690 1.00 0.00 C ATOM 957 O ALA A 58 -7.651 14.891 -1.632 1.00 0.00 O ATOM 958 CB ALA A 58 -8.703 17.890 -0.112 1.00 0.00 C ATOM 0 H ALA A 58 -8.864 14.800 0.248 1.00 0.00 H new ATOM 0 HA ALA A 58 -9.983 16.821 -1.447 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -8.411 18.630 -0.857 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.537 18.275 0.474 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.860 17.687 0.548 1.00 0.00 H new ATOM 964 N ARG A 59 -7.413 16.949 -2.531 1.00 0.00 N ATOM 965 CA ARG A 59 -6.325 16.604 -3.463 1.00 0.00 C ATOM 966 C ARG A 59 -5.157 17.594 -3.287 1.00 0.00 C ATOM 967 O ARG A 59 -5.349 18.807 -3.354 1.00 0.00 O ATOM 968 CB ARG A 59 -6.850 16.624 -4.924 1.00 0.00 C ATOM 969 CG ARG A 59 -8.077 15.716 -5.176 1.00 0.00 C ATOM 970 CD ARG A 59 -7.784 14.217 -4.983 1.00 0.00 C ATOM 971 NE ARG A 59 -9.026 13.416 -5.041 1.00 0.00 N ATOM 972 CZ ARG A 59 -9.611 12.804 -3.994 1.00 0.00 C ATOM 973 NH1 ARG A 59 -9.065 12.847 -2.786 1.00 0.00 N ATOM 974 NH2 ARG A 59 -10.751 12.161 -4.157 1.00 0.00 N ATOM 0 H ARG A 59 -7.695 17.928 -2.583 1.00 0.00 H new ATOM 0 HA ARG A 59 -5.965 15.599 -3.243 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -7.111 17.649 -5.189 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -6.044 16.318 -5.591 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -8.881 16.010 -4.501 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -8.437 15.880 -6.192 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -7.093 13.877 -5.754 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -7.292 14.061 -4.023 1.00 0.00 H new ATOM 0 HE ARG A 59 -9.477 13.319 -5.951 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -8.189 13.349 -2.640 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.521 12.378 -2.003 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -11.190 12.127 -5.077 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -11.193 11.698 -3.363 1.00 0.00 H new ATOM 988 N ILE A 60 -3.959 17.051 -3.040 1.00 0.00 N ATOM 989 CA ILE A 60 -2.726 17.827 -2.833 1.00 0.00 C ATOM 990 C ILE A 60 -2.197 18.424 -4.154 1.00 0.00 C ATOM 991 O ILE A 60 -2.140 17.752 -5.191 1.00 0.00 O ATOM 992 CB ILE A 60 -1.636 16.929 -2.129 1.00 0.00 C ATOM 993 CG1 ILE A 60 -2.015 16.707 -0.628 1.00 0.00 C ATOM 994 CG2 ILE A 60 -0.199 17.511 -2.255 1.00 0.00 C ATOM 995 CD1 ILE A 60 -1.380 15.491 0.013 1.00 0.00 C ATOM 0 H ILE A 60 -3.815 16.043 -2.977 1.00 0.00 H new ATOM 0 HA ILE A 60 -2.958 18.668 -2.180 1.00 0.00 H new ATOM 0 HB ILE A 60 -1.625 15.970 -2.647 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.727 17.592 -0.060 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -3.099 16.617 -0.551 1.00 0.00 H new ATOM 0 HG21 ILE A 60 0.507 16.850 -1.752 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.069 17.594 -3.308 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.164 18.498 -1.793 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -1.700 15.419 1.052 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -1.687 14.594 -0.525 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -0.295 15.584 -0.027 1.00 0.00 H new ATOM 1007 N LYS A 61 -1.781 19.689 -4.043 1.00 0.00 N ATOM 1008 CA LYS A 61 -1.272 20.544 -5.117 1.00 0.00 C ATOM 1009 C LYS A 61 -0.010 21.261 -4.600 1.00 0.00 C ATOM 1010 O LYS A 61 0.385 21.045 -3.437 1.00 0.00 O ATOM 1011 CB LYS A 61 -2.357 21.583 -5.537 1.00 0.00 C ATOM 1012 CG LYS A 61 -3.585 20.986 -6.249 1.00 0.00 C ATOM 1013 CD LYS A 61 -3.242 20.372 -7.628 1.00 0.00 C ATOM 1014 CE LYS A 61 -2.801 21.425 -8.657 1.00 0.00 C ATOM 1015 NZ LYS A 61 -2.425 20.822 -9.959 1.00 0.00 N ATOM 0 H LYS A 61 -1.792 20.172 -3.145 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.026 19.944 -5.993 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.694 22.115 -4.647 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.897 22.321 -6.194 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -4.029 20.218 -5.615 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.337 21.764 -6.380 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -2.447 19.636 -7.505 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.113 19.840 -8.010 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -3.610 22.139 -8.811 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -1.953 21.984 -8.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -2.135 21.572 -10.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -1.635 20.160 -9.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -3.240 20.311 -10.353 1.00 0.00 H new ATOM 1029 N ARG A 62 0.553 22.152 -5.463 1.00 0.00 N ATOM 1030 CA ARG A 62 1.878 22.819 -5.293 1.00 0.00 C ATOM 1031 C ARG A 62 2.285 23.065 -3.816 1.00 0.00 C ATOM 1032 O ARG A 62 1.645 23.839 -3.090 1.00 0.00 O ATOM 1033 CB ARG A 62 1.886 24.155 -6.095 1.00 0.00 C ATOM 1034 CG ARG A 62 0.715 25.104 -5.755 1.00 0.00 C ATOM 1035 CD ARG A 62 0.742 26.415 -6.553 1.00 0.00 C ATOM 1036 NE ARG A 62 -0.417 27.259 -6.236 1.00 0.00 N ATOM 1037 CZ ARG A 62 -0.734 28.409 -6.837 1.00 0.00 C ATOM 1038 NH1 ARG A 62 0.026 28.916 -7.803 1.00 0.00 N ATOM 1039 NH2 ARG A 62 -1.822 29.050 -6.456 1.00 0.00 N ATOM 0 H ARG A 62 0.084 22.435 -6.323 1.00 0.00 H new ATOM 0 HA ARG A 62 2.628 22.131 -5.684 1.00 0.00 H new ATOM 0 HB2 ARG A 62 2.826 24.674 -5.906 1.00 0.00 H new ATOM 0 HB3 ARG A 62 1.856 23.927 -7.160 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -0.227 24.590 -5.946 1.00 0.00 H new ATOM 0 HG3 ARG A 62 0.741 25.335 -4.690 1.00 0.00 H new ATOM 0 HD2 ARG A 62 1.661 26.958 -6.332 1.00 0.00 H new ATOM 0 HD3 ARG A 62 0.751 26.193 -7.620 1.00 0.00 H new ATOM 0 HE ARG A 62 -1.035 26.939 -5.491 1.00 0.00 H new ATOM 0 HH11 ARG A 62 0.870 28.425 -8.099 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -0.235 29.796 -8.248 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -2.406 28.666 -5.713 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -2.079 29.929 -6.904 1.00 0.00 H new ATOM 1053 N VAL A 63 3.331 22.344 -3.377 1.00 0.00 N ATOM 1054 CA VAL A 63 3.873 22.461 -2.022 1.00 0.00 C ATOM 1055 C VAL A 63 5.002 23.522 -2.024 1.00 0.00 C ATOM 1056 O VAL A 63 6.091 23.311 -2.572 1.00 0.00 O ATOM 1057 CB VAL A 63 4.332 21.054 -1.443 1.00 0.00 C ATOM 1058 CG1 VAL A 63 3.111 20.106 -1.289 1.00 0.00 C ATOM 1059 CG2 VAL A 63 5.434 20.373 -2.308 1.00 0.00 C ATOM 0 H VAL A 63 3.822 21.664 -3.957 1.00 0.00 H new ATOM 0 HA VAL A 63 3.091 22.800 -1.342 1.00 0.00 H new ATOM 0 HB VAL A 63 4.770 21.247 -0.464 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.443 19.147 -0.891 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.388 20.552 -0.606 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.644 19.953 -2.262 1.00 0.00 H new ATOM 0 HG21 VAL A 63 5.707 19.416 -1.863 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.055 20.209 -3.317 1.00 0.00 H new ATOM 0 HG23 VAL A 63 6.313 21.017 -2.351 1.00 0.00 H new ATOM 1069 N VAL A 64 4.704 24.702 -1.455 1.00 0.00 N ATOM 1070 CA VAL A 64 5.618 25.852 -1.451 1.00 0.00 C ATOM 1071 C VAL A 64 6.528 25.758 -0.223 1.00 0.00 C ATOM 1072 O VAL A 64 6.070 25.888 0.909 1.00 0.00 O ATOM 1073 CB VAL A 64 4.823 27.212 -1.445 1.00 0.00 C ATOM 1074 CG1 VAL A 64 5.772 28.438 -1.362 1.00 0.00 C ATOM 1075 CG2 VAL A 64 3.892 27.308 -2.679 1.00 0.00 C ATOM 0 H VAL A 64 3.818 24.884 -0.983 1.00 0.00 H new ATOM 0 HA VAL A 64 6.220 25.830 -2.359 1.00 0.00 H new ATOM 0 HB VAL A 64 4.205 27.226 -0.548 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.183 29.355 -1.360 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.359 28.382 -0.445 1.00 0.00 H new ATOM 0 HG13 VAL A 64 6.442 28.439 -2.222 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.353 28.255 -2.655 1.00 0.00 H new ATOM 0 HG22 VAL A 64 4.488 27.253 -3.590 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.179 26.484 -2.662 1.00 0.00 H new ATOM 1085 N LEU A 65 7.812 25.494 -0.465 1.00 0.00 N ATOM 1086 CA LEU A 65 8.808 25.305 0.591 1.00 0.00 C ATOM 1087 C LEU A 65 9.489 26.645 0.896 1.00 0.00 C ATOM 1088 O LEU A 65 10.098 27.251 0.007 1.00 0.00 O ATOM 1089 CB LEU A 65 9.857 24.248 0.144 1.00 0.00 C ATOM 1090 CG LEU A 65 9.280 22.891 -0.389 1.00 0.00 C ATOM 1091 CD1 LEU A 65 10.398 21.956 -0.898 1.00 0.00 C ATOM 1092 CD2 LEU A 65 8.410 22.187 0.676 1.00 0.00 C ATOM 0 H LEU A 65 8.194 25.404 -1.407 1.00 0.00 H new ATOM 0 HA LEU A 65 8.319 24.944 1.496 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.477 24.688 -0.637 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.512 24.035 0.989 1.00 0.00 H new ATOM 0 HG LEU A 65 8.638 23.129 -1.237 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.958 21.026 -1.259 1.00 0.00 H new ATOM 0 HD12 LEU A 65 10.937 22.442 -1.711 1.00 0.00 H new ATOM 0 HD13 LEU A 65 11.089 21.738 -0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.027 21.250 0.272 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.013 21.981 1.560 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.575 22.833 0.949 1.00 0.00 H new ATOM 1104 N SER A 66 9.369 27.102 2.140 1.00 0.00 N ATOM 1105 CA SER A 66 10.034 28.315 2.619 1.00 0.00 C ATOM 1106 C SER A 66 10.292 28.188 4.118 1.00 0.00 C ATOM 1107 O SER A 66 9.401 27.809 4.885 1.00 0.00 O ATOM 1108 CB SER A 66 9.195 29.579 2.325 1.00 0.00 C ATOM 1109 OG SER A 66 9.846 30.746 2.807 1.00 0.00 O ATOM 0 H SER A 66 8.803 26.638 2.851 1.00 0.00 H new ATOM 0 HA SER A 66 10.980 28.422 2.088 1.00 0.00 H new ATOM 0 HB2 SER A 66 9.029 29.668 1.251 1.00 0.00 H new ATOM 0 HB3 SER A 66 8.215 29.486 2.792 1.00 0.00 H new ATOM 0 HG SER A 66 10.298 31.198 2.065 1.00 0.00 H new ATOM 1115 N GLU A 67 11.513 28.545 4.523 1.00 0.00 N ATOM 1116 CA GLU A 67 11.948 28.519 5.923 1.00 0.00 C ATOM 1117 C GLU A 67 11.347 29.685 6.747 1.00 0.00 C ATOM 1118 O GLU A 67 11.616 29.810 7.949 1.00 0.00 O ATOM 1119 CB GLU A 67 13.489 28.521 5.974 1.00 0.00 C ATOM 1120 CG GLU A 67 14.141 27.219 5.493 1.00 0.00 C ATOM 1121 CD GLU A 67 15.670 27.240 5.549 1.00 0.00 C ATOM 1122 OE1 GLU A 67 16.235 27.117 6.658 1.00 0.00 O ATOM 1123 OE2 GLU A 67 16.316 27.385 4.490 1.00 0.00 O ATOM 0 H GLU A 67 12.237 28.865 3.880 1.00 0.00 H new ATOM 0 HA GLU A 67 11.575 27.605 6.385 1.00 0.00 H new ATOM 0 HB2 GLU A 67 13.859 29.345 5.364 1.00 0.00 H new ATOM 0 HB3 GLU A 67 13.806 28.715 6.999 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.775 26.393 6.103 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.826 27.022 4.468 1.00 0.00 H new ATOM 1130 N ASN A 68 10.551 30.549 6.090 1.00 0.00 N ATOM 1131 CA ASN A 68 9.710 31.545 6.766 1.00 0.00 C ATOM 1132 C ASN A 68 8.242 31.153 6.536 1.00 0.00 C ATOM 1133 O ASN A 68 7.799 31.098 5.378 1.00 0.00 O ATOM 1134 CB ASN A 68 9.952 32.978 6.225 1.00 0.00 C ATOM 1135 CG ASN A 68 11.424 33.363 6.167 1.00 0.00 C ATOM 1136 OD1 ASN A 68 11.967 33.912 7.116 1.00 0.00 O ATOM 1137 ND2 ASN A 68 12.073 33.066 5.052 1.00 0.00 N ATOM 0 H ASN A 68 10.475 30.573 5.073 1.00 0.00 H new ATOM 0 HA ASN A 68 9.961 31.555 7.827 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.524 33.058 5.226 1.00 0.00 H new ATOM 0 HB3 ASN A 68 9.422 33.691 6.857 1.00 0.00 H new ATOM 0 HD21 ASN A 68 13.063 33.295 4.962 1.00 0.00 H new ATOM 0 HD22 ASN A 68 11.583 32.608 4.283 1.00 0.00 H new ATOM 1144 N PRO A 69 7.451 30.891 7.621 1.00 0.00 N ATOM 1145 CA PRO A 69 5.999 30.603 7.495 1.00 0.00 C ATOM 1146 C PRO A 69 5.198 31.827 6.988 1.00 0.00 C ATOM 1147 O PRO A 69 4.114 31.678 6.416 1.00 0.00 O ATOM 1148 CB PRO A 69 5.590 30.216 8.934 1.00 0.00 C ATOM 1149 CG PRO A 69 6.610 30.876 9.818 1.00 0.00 C ATOM 1150 CD PRO A 69 7.903 30.821 9.043 1.00 0.00 C ATOM 0 HA PRO A 69 5.791 29.823 6.763 1.00 0.00 H new ATOM 0 HB2 PRO A 69 4.583 30.564 9.165 1.00 0.00 H new ATOM 0 HB3 PRO A 69 5.592 29.134 9.068 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.329 31.905 10.042 1.00 0.00 H new ATOM 0 HG3 PRO A 69 6.700 30.355 10.771 1.00 0.00 H new ATOM 0 HD2 PRO A 69 8.561 31.652 9.298 1.00 0.00 H new ATOM 0 HD3 PRO A 69 8.455 29.903 9.245 1.00 0.00 H new ATOM 1158 N MET A 70 5.791 33.023 7.155 1.00 0.00 N ATOM 1159 CA MET A 70 5.150 34.314 6.852 1.00 0.00 C ATOM 1160 C MET A 70 5.018 34.524 5.332 1.00 0.00 C ATOM 1161 O MET A 70 4.116 35.240 4.867 1.00 0.00 O ATOM 1162 CB MET A 70 5.974 35.450 7.513 1.00 0.00 C ATOM 1163 CG MET A 70 5.985 35.393 9.053 1.00 0.00 C ATOM 1164 SD MET A 70 7.135 36.566 9.806 1.00 0.00 S ATOM 1165 CE MET A 70 8.724 35.874 9.333 1.00 0.00 C ATOM 0 H MET A 70 6.743 33.120 7.509 1.00 0.00 H new ATOM 0 HA MET A 70 4.139 34.323 7.260 1.00 0.00 H new ATOM 0 HB2 MET A 70 7.000 35.401 7.149 1.00 0.00 H new ATOM 0 HB3 MET A 70 5.569 36.411 7.197 1.00 0.00 H new ATOM 0 HG2 MET A 70 4.980 35.592 9.424 1.00 0.00 H new ATOM 0 HG3 MET A 70 6.247 34.384 9.370 1.00 0.00 H new ATOM 0 HE1 MET A 70 9.510 36.312 9.949 1.00 0.00 H new ATOM 0 HE2 MET A 70 8.709 34.794 9.479 1.00 0.00 H new ATOM 0 HE3 MET A 70 8.919 36.095 8.284 1.00 0.00 H new ATOM 1175 N GLN A 71 5.902 33.847 4.567 1.00 0.00 N ATOM 1176 CA GLN A 71 5.896 33.894 3.092 1.00 0.00 C ATOM 1177 C GLN A 71 4.595 33.327 2.507 1.00 0.00 C ATOM 1178 O GLN A 71 4.157 33.744 1.442 1.00 0.00 O ATOM 1179 CB GLN A 71 7.107 33.126 2.514 1.00 0.00 C ATOM 1180 CG GLN A 71 8.473 33.682 2.936 1.00 0.00 C ATOM 1181 CD GLN A 71 8.712 35.128 2.511 1.00 0.00 C ATOM 1182 OE1 GLN A 71 9.164 35.388 1.397 1.00 0.00 O ATOM 1183 NE2 GLN A 71 8.435 36.074 3.399 1.00 0.00 N ATOM 0 H GLN A 71 6.637 33.255 4.955 1.00 0.00 H new ATOM 0 HA GLN A 71 5.966 34.944 2.806 1.00 0.00 H new ATOM 0 HB2 GLN A 71 7.042 32.083 2.824 1.00 0.00 H new ATOM 0 HB3 GLN A 71 7.044 33.139 1.426 1.00 0.00 H new ATOM 0 HG2 GLN A 71 8.563 33.613 4.020 1.00 0.00 H new ATOM 0 HG3 GLN A 71 9.256 33.055 2.511 1.00 0.00 H new ATOM 0 HE21 GLN A 71 8.061 35.821 4.314 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.596 37.054 3.167 1.00 0.00 H new ATOM 1192 N PHE A 72 3.975 32.390 3.228 1.00 0.00 N ATOM 1193 CA PHE A 72 2.738 31.730 2.780 1.00 0.00 C ATOM 1194 C PHE A 72 1.524 32.649 2.958 1.00 0.00 C ATOM 1195 O PHE A 72 0.493 32.438 2.322 1.00 0.00 O ATOM 1196 CB PHE A 72 2.532 30.408 3.553 1.00 0.00 C ATOM 1197 CG PHE A 72 3.761 29.500 3.556 1.00 0.00 C ATOM 1198 CD1 PHE A 72 4.569 29.367 2.422 1.00 0.00 C ATOM 1199 CD2 PHE A 72 4.108 28.781 4.692 1.00 0.00 C ATOM 1200 CE1 PHE A 72 5.675 28.550 2.438 1.00 0.00 C ATOM 1201 CE2 PHE A 72 5.209 27.965 4.699 1.00 0.00 C ATOM 1202 CZ PHE A 72 5.996 27.848 3.575 1.00 0.00 C ATOM 0 H PHE A 72 4.311 32.066 4.135 1.00 0.00 H new ATOM 0 HA PHE A 72 2.836 31.508 1.717 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.259 30.638 4.583 1.00 0.00 H new ATOM 0 HB3 PHE A 72 1.693 29.868 3.114 1.00 0.00 H new ATOM 0 HD1 PHE A 72 4.321 29.912 1.523 1.00 0.00 H new ATOM 0 HD2 PHE A 72 3.502 28.866 5.582 1.00 0.00 H new ATOM 0 HE1 PHE A 72 6.292 28.460 1.556 1.00 0.00 H new ATOM 0 HE2 PHE A 72 5.461 27.411 5.591 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.864 27.206 3.587 1.00 0.00 H new ATOM 1212 N PHE A 73 1.657 33.670 3.829 1.00 0.00 N ATOM 1213 CA PHE A 73 0.583 34.628 4.102 1.00 0.00 C ATOM 1214 C PHE A 73 0.708 35.868 3.206 1.00 0.00 C ATOM 1215 O PHE A 73 -0.270 36.604 3.043 1.00 0.00 O ATOM 1216 CB PHE A 73 0.574 34.990 5.602 1.00 0.00 C ATOM 1217 CG PHE A 73 0.374 33.759 6.488 1.00 0.00 C ATOM 1218 CD1 PHE A 73 -0.885 33.180 6.643 1.00 0.00 C ATOM 1219 CD2 PHE A 73 1.449 33.167 7.146 1.00 0.00 C ATOM 1220 CE1 PHE A 73 -1.053 32.058 7.426 1.00 0.00 C ATOM 1221 CE2 PHE A 73 1.270 32.044 7.930 1.00 0.00 C ATOM 1222 CZ PHE A 73 0.022 31.492 8.070 1.00 0.00 C ATOM 0 H PHE A 73 2.511 33.847 4.358 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.376 34.168 3.863 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.514 35.476 5.863 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.221 35.710 5.796 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -1.738 33.615 6.144 1.00 0.00 H new ATOM 0 HD2 PHE A 73 2.436 33.592 7.042 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -2.035 31.621 7.534 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.115 31.599 8.434 1.00 0.00 H new ATOM 0 HZ PHE A 73 -0.116 30.615 8.685 1.00 0.00 H new ATOM 1232 N GLU A 74 1.909 36.116 2.636 1.00 0.00 N ATOM 1233 CA GLU A 74 2.060 37.132 1.569 1.00 0.00 C ATOM 1234 C GLU A 74 1.722 36.524 0.188 1.00 0.00 C ATOM 1235 O GLU A 74 1.245 37.234 -0.703 1.00 0.00 O ATOM 1236 CB GLU A 74 3.476 37.777 1.554 1.00 0.00 C ATOM 1237 CG GLU A 74 4.629 36.826 1.198 1.00 0.00 C ATOM 1238 CD GLU A 74 5.958 37.551 0.929 1.00 0.00 C ATOM 1239 OE1 GLU A 74 6.701 37.840 1.886 1.00 0.00 O ATOM 1240 OE2 GLU A 74 6.255 37.845 -0.249 1.00 0.00 O ATOM 0 H GLU A 74 2.773 35.637 2.891 1.00 0.00 H new ATOM 0 HA GLU A 74 1.352 37.931 1.788 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.474 38.601 0.841 1.00 0.00 H new ATOM 0 HB3 GLU A 74 3.672 38.206 2.537 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.769 36.116 2.013 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.354 36.248 0.316 1.00 0.00 H new ATOM 1247 N THR A 75 1.972 35.209 0.019 1.00 0.00 N ATOM 1248 CA THR A 75 1.701 34.496 -1.245 1.00 0.00 C ATOM 1249 C THR A 75 0.208 34.130 -1.353 1.00 0.00 C ATOM 1250 O THR A 75 -0.473 34.536 -2.302 1.00 0.00 O ATOM 1251 CB THR A 75 2.588 33.214 -1.372 1.00 0.00 C ATOM 1252 OG1 THR A 75 3.972 33.583 -1.297 1.00 0.00 O ATOM 1253 CG2 THR A 75 2.346 32.445 -2.687 1.00 0.00 C ATOM 0 H THR A 75 2.365 34.616 0.750 1.00 0.00 H new ATOM 0 HA THR A 75 1.955 35.165 -2.067 1.00 0.00 H new ATOM 0 HB THR A 75 2.313 32.553 -0.550 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.223 33.723 -0.360 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.989 31.566 -2.718 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.303 32.133 -2.740 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.574 33.092 -3.534 1.00 0.00 H new ATOM 1261 N PHE A 76 -0.292 33.353 -0.375 1.00 0.00 N ATOM 1262 CA PHE A 76 -1.702 32.925 -0.338 1.00 0.00 C ATOM 1263 C PHE A 76 -2.485 33.800 0.660 1.00 0.00 C ATOM 1264 O PHE A 76 -3.289 34.642 0.251 1.00 0.00 O ATOM 1265 CB PHE A 76 -1.803 31.429 0.057 1.00 0.00 C ATOM 1266 CG PHE A 76 -1.056 30.468 -0.867 1.00 0.00 C ATOM 1267 CD1 PHE A 76 -1.583 30.118 -2.114 1.00 0.00 C ATOM 1268 CD2 PHE A 76 0.163 29.904 -0.486 1.00 0.00 C ATOM 1269 CE1 PHE A 76 -0.914 29.238 -2.946 1.00 0.00 C ATOM 1270 CE2 PHE A 76 0.828 29.023 -1.318 1.00 0.00 C ATOM 1271 CZ PHE A 76 0.291 28.690 -2.548 1.00 0.00 C ATOM 0 H PHE A 76 0.265 33.007 0.406 1.00 0.00 H new ATOM 0 HA PHE A 76 -2.136 33.046 -1.331 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.418 31.309 1.070 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -2.855 31.144 0.080 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.525 30.540 -2.432 1.00 0.00 H new ATOM 0 HD2 PHE A 76 0.592 30.159 0.472 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -1.333 28.979 -3.907 1.00 0.00 H new ATOM 0 HE2 PHE A 76 1.769 28.594 -1.007 1.00 0.00 H new ATOM 0 HZ PHE A 76 0.813 28.002 -3.197 1.00 0.00 H new ATOM 1281 N GLY A 77 -2.192 33.621 1.969 1.00 0.00 N ATOM 1282 CA GLY A 77 -2.883 34.335 3.049 1.00 0.00 C ATOM 1283 C GLY A 77 -4.319 33.867 3.235 1.00 0.00 C ATOM 1284 O GLY A 77 -4.616 33.073 4.135 1.00 0.00 O ATOM 0 H GLY A 77 -1.471 32.978 2.297 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -2.335 34.194 3.981 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -2.878 35.404 2.834 1.00 0.00 H new ATOM 1288 N ASP A 78 -5.189 34.349 2.338 1.00 0.00 N ATOM 1289 CA ASP A 78 -6.620 33.999 2.283 1.00 0.00 C ATOM 1290 C ASP A 78 -6.823 32.482 2.095 1.00 0.00 C ATOM 1291 O ASP A 78 -7.660 31.872 2.766 1.00 0.00 O ATOM 1292 CB ASP A 78 -7.279 34.784 1.118 1.00 0.00 C ATOM 1293 CG ASP A 78 -8.735 34.380 0.824 1.00 0.00 C ATOM 1294 OD1 ASP A 78 -9.663 34.937 1.448 1.00 0.00 O ATOM 1295 OD2 ASP A 78 -8.957 33.508 -0.045 1.00 0.00 O ATOM 0 H ASP A 78 -4.913 35.010 1.611 1.00 0.00 H new ATOM 0 HA ASP A 78 -7.089 34.271 3.229 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.250 35.848 1.351 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.685 34.639 0.216 1.00 0.00 H new ATOM 1300 N ARG A 79 -6.044 31.888 1.174 1.00 0.00 N ATOM 1301 CA ARG A 79 -6.165 30.451 0.840 1.00 0.00 C ATOM 1302 C ARG A 79 -5.789 29.553 2.039 1.00 0.00 C ATOM 1303 O ARG A 79 -6.336 28.469 2.182 1.00 0.00 O ATOM 1304 CB ARG A 79 -5.288 30.086 -0.387 1.00 0.00 C ATOM 1305 CG ARG A 79 -5.569 30.900 -1.669 1.00 0.00 C ATOM 1306 CD ARG A 79 -7.030 30.796 -2.157 1.00 0.00 C ATOM 1307 NE ARG A 79 -7.211 31.405 -3.493 1.00 0.00 N ATOM 1308 CZ ARG A 79 -7.855 32.557 -3.756 1.00 0.00 C ATOM 1309 NH1 ARG A 79 -8.327 33.319 -2.781 1.00 0.00 N ATOM 1310 NH2 ARG A 79 -8.002 32.954 -5.007 1.00 0.00 N ATOM 0 H ARG A 79 -5.322 32.378 0.645 1.00 0.00 H new ATOM 0 HA ARG A 79 -7.211 30.270 0.592 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -4.241 30.218 -0.116 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -5.428 29.028 -0.611 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -5.330 31.947 -1.485 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -4.904 30.556 -2.461 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -7.327 29.748 -2.193 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.688 31.289 -1.441 1.00 0.00 H new ATOM 0 HE ARG A 79 -6.811 30.906 -4.288 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -8.205 33.036 -1.809 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -8.812 34.188 -3.003 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -7.628 32.388 -5.769 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -8.489 33.826 -5.211 1.00 0.00 H new ATOM 1324 N VAL A 80 -4.872 30.042 2.900 1.00 0.00 N ATOM 1325 CA VAL A 80 -4.349 29.281 4.060 1.00 0.00 C ATOM 1326 C VAL A 80 -5.450 29.082 5.144 1.00 0.00 C ATOM 1327 O VAL A 80 -6.353 29.925 5.273 1.00 0.00 O ATOM 1328 CB VAL A 80 -3.083 30.002 4.673 1.00 0.00 C ATOM 1329 CG1 VAL A 80 -2.411 29.150 5.773 1.00 0.00 C ATOM 1330 CG2 VAL A 80 -2.055 30.376 3.573 1.00 0.00 C ATOM 0 H VAL A 80 -4.472 30.976 2.813 1.00 0.00 H new ATOM 0 HA VAL A 80 -4.046 28.295 3.707 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.439 30.923 5.135 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.545 29.682 6.167 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.123 28.968 6.578 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -2.090 28.198 5.350 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.197 30.870 4.029 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.724 29.472 3.062 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.521 31.049 2.853 1.00 0.00 H new ATOM 1340 N PHE A 81 -5.372 27.956 5.904 1.00 0.00 N ATOM 1341 CA PHE A 81 -6.381 27.601 6.931 1.00 0.00 C ATOM 1342 C PHE A 81 -6.402 28.598 8.098 1.00 0.00 C ATOM 1343 O PHE A 81 -7.473 28.975 8.578 1.00 0.00 O ATOM 1344 CB PHE A 81 -6.198 26.133 7.434 1.00 0.00 C ATOM 1345 CG PHE A 81 -4.958 25.811 8.282 1.00 0.00 C ATOM 1346 CD1 PHE A 81 -3.768 25.417 7.686 1.00 0.00 C ATOM 1347 CD2 PHE A 81 -5.003 25.845 9.678 1.00 0.00 C ATOM 1348 CE1 PHE A 81 -2.671 25.081 8.453 1.00 0.00 C ATOM 1349 CE2 PHE A 81 -3.906 25.504 10.442 1.00 0.00 C ATOM 1350 CZ PHE A 81 -2.737 25.122 9.829 1.00 0.00 C ATOM 0 H PHE A 81 -4.615 27.278 5.821 1.00 0.00 H new ATOM 0 HA PHE A 81 -7.355 27.664 6.447 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -7.080 25.867 8.017 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -6.185 25.480 6.561 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -3.700 25.373 6.609 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.917 26.145 10.170 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.752 24.783 7.970 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -3.966 25.537 11.520 1.00 0.00 H new ATOM 0 HZ PHE A 81 -1.875 24.855 10.422 1.00 0.00 H new ATOM 1360 N LEU A 82 -5.221 29.027 8.546 1.00 0.00 N ATOM 1361 CA LEU A 82 -5.090 30.022 9.631 1.00 0.00 C ATOM 1362 C LEU A 82 -4.579 31.346 9.050 1.00 0.00 C ATOM 1363 O LEU A 82 -4.170 31.400 7.883 1.00 0.00 O ATOM 1364 CB LEU A 82 -4.154 29.504 10.779 1.00 0.00 C ATOM 1365 CG LEU A 82 -2.598 29.575 10.566 1.00 0.00 C ATOM 1366 CD1 LEU A 82 -1.840 29.131 11.836 1.00 0.00 C ATOM 1367 CD2 LEU A 82 -2.138 28.757 9.351 1.00 0.00 C ATOM 0 H LEU A 82 -4.328 28.702 8.175 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.072 30.185 10.076 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.391 30.068 11.681 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.415 28.464 10.976 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.358 30.619 10.365 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -0.766 29.191 11.658 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.107 29.785 12.666 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.111 28.104 12.081 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -1.056 28.838 9.246 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -2.412 27.711 9.492 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.619 29.140 8.451 1.00 0.00 H new ATOM 1379 N THR A 83 -4.621 32.413 9.858 1.00 0.00 N ATOM 1380 CA THR A 83 -4.010 33.704 9.498 1.00 0.00 C ATOM 1381 C THR A 83 -2.632 33.809 10.168 1.00 0.00 C ATOM 1382 O THR A 83 -2.288 32.990 11.031 1.00 0.00 O ATOM 1383 CB THR A 83 -4.929 34.921 9.879 1.00 0.00 C ATOM 1384 OG1 THR A 83 -4.298 36.158 9.515 1.00 0.00 O ATOM 1385 CG2 THR A 83 -5.287 34.955 11.368 1.00 0.00 C ATOM 0 H THR A 83 -5.074 32.409 10.772 1.00 0.00 H new ATOM 0 HA THR A 83 -3.890 33.744 8.415 1.00 0.00 H new ATOM 0 HB THR A 83 -5.856 34.792 9.321 1.00 0.00 H new ATOM 0 HG1 THR A 83 -4.178 36.712 10.315 1.00 0.00 H new ATOM 0 HG21 THR A 83 -5.923 35.817 11.570 1.00 0.00 H new ATOM 0 HG22 THR A 83 -5.819 34.042 11.635 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.375 35.030 11.960 1.00 0.00 H new ATOM 1393 N LYS A 84 -1.839 34.806 9.758 1.00 0.00 N ATOM 1394 CA LYS A 84 -0.469 34.996 10.264 1.00 0.00 C ATOM 1395 C LYS A 84 -0.471 35.413 11.743 1.00 0.00 C ATOM 1396 O LYS A 84 0.501 35.192 12.471 1.00 0.00 O ATOM 1397 CB LYS A 84 0.265 36.026 9.394 1.00 0.00 C ATOM 1398 CG LYS A 84 1.754 36.212 9.743 1.00 0.00 C ATOM 1399 CD LYS A 84 2.527 36.905 8.617 1.00 0.00 C ATOM 1400 CE LYS A 84 1.992 38.297 8.270 1.00 0.00 C ATOM 1401 NZ LYS A 84 2.118 39.263 9.396 1.00 0.00 N ATOM 0 H LYS A 84 -2.124 35.502 9.069 1.00 0.00 H new ATOM 0 HA LYS A 84 0.061 34.045 10.203 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.185 35.724 8.350 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -0.240 36.987 9.487 1.00 0.00 H new ATOM 0 HG2 LYS A 84 1.841 36.800 10.657 1.00 0.00 H new ATOM 0 HG3 LYS A 84 2.203 35.239 9.945 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.575 36.990 8.906 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.492 36.279 7.725 1.00 0.00 H new ATOM 0 HE2 LYS A 84 2.531 38.683 7.405 1.00 0.00 H new ATOM 0 HE3 LYS A 84 0.944 38.217 7.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 1.741 40.187 9.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 1.582 38.913 10.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 3.120 39.365 9.656 1.00 0.00 H new ATOM 1415 N ASP A 85 -1.573 36.034 12.157 1.00 0.00 N ATOM 1416 CA ASP A 85 -1.873 36.286 13.583 1.00 0.00 C ATOM 1417 C ASP A 85 -1.925 34.961 14.366 1.00 0.00 C ATOM 1418 O ASP A 85 -1.230 34.805 15.367 1.00 0.00 O ATOM 1419 CB ASP A 85 -3.208 37.030 13.762 1.00 0.00 C ATOM 1420 CG ASP A 85 -3.304 38.303 12.921 1.00 0.00 C ATOM 1421 OD1 ASP A 85 -2.908 39.379 13.411 1.00 0.00 O ATOM 1422 OD2 ASP A 85 -3.769 38.234 11.758 1.00 0.00 O ATOM 0 H ASP A 85 -2.290 36.381 11.520 1.00 0.00 H new ATOM 0 HA ASP A 85 -1.072 36.914 13.972 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -4.027 36.363 13.495 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -3.336 37.286 14.814 1.00 0.00 H new ATOM 1427 N GLU A 86 -2.734 34.000 13.872 1.00 0.00 N ATOM 1428 CA GLU A 86 -2.835 32.648 14.475 1.00 0.00 C ATOM 1429 C GLU A 86 -1.458 31.962 14.511 1.00 0.00 C ATOM 1430 O GLU A 86 -1.142 31.261 15.464 1.00 0.00 O ATOM 1431 CB GLU A 86 -3.850 31.762 13.713 1.00 0.00 C ATOM 1432 CG GLU A 86 -5.302 32.265 13.748 1.00 0.00 C ATOM 1433 CD GLU A 86 -5.870 32.386 15.169 1.00 0.00 C ATOM 1434 OE1 GLU A 86 -6.114 31.348 15.814 1.00 0.00 O ATOM 1435 OE2 GLU A 86 -6.087 33.518 15.646 1.00 0.00 O ATOM 0 H GLU A 86 -3.330 34.133 13.055 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.194 32.773 15.497 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.533 31.684 12.673 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.819 30.756 14.132 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.354 33.238 13.260 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.929 31.585 13.171 1.00 0.00 H new ATOM 1442 N LEU A 87 -0.650 32.230 13.472 1.00 0.00 N ATOM 1443 CA LEU A 87 0.722 31.722 13.348 1.00 0.00 C ATOM 1444 C LEU A 87 1.623 32.236 14.492 1.00 0.00 C ATOM 1445 O LEU A 87 2.202 31.425 15.216 1.00 0.00 O ATOM 1446 CB LEU A 87 1.327 32.145 11.982 1.00 0.00 C ATOM 1447 CG LEU A 87 2.843 31.832 11.787 1.00 0.00 C ATOM 1448 CD1 LEU A 87 3.083 30.323 11.587 1.00 0.00 C ATOM 1449 CD2 LEU A 87 3.460 32.687 10.657 1.00 0.00 C ATOM 0 H LEU A 87 -0.937 32.813 12.686 1.00 0.00 H new ATOM 0 HA LEU A 87 0.678 30.635 13.410 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.768 31.649 11.189 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.177 33.217 11.856 1.00 0.00 H new ATOM 0 HG LEU A 87 3.362 32.113 12.704 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.149 30.139 11.454 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.727 29.779 12.462 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.543 29.983 10.703 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.517 32.441 10.550 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.943 32.480 9.720 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.356 33.744 10.902 1.00 0.00 H new ATOM 1461 N LYS A 88 1.732 33.584 14.646 1.00 0.00 N ATOM 1462 CA LYS A 88 2.695 34.197 15.594 1.00 0.00 C ATOM 1463 C LYS A 88 2.428 33.764 17.047 1.00 0.00 C ATOM 1464 O LYS A 88 3.366 33.465 17.785 1.00 0.00 O ATOM 1465 CB LYS A 88 2.810 35.760 15.421 1.00 0.00 C ATOM 1466 CG LYS A 88 1.503 36.569 15.327 1.00 0.00 C ATOM 1467 CD LYS A 88 0.743 36.708 16.664 1.00 0.00 C ATOM 1468 CE LYS A 88 -0.276 37.837 16.631 1.00 0.00 C ATOM 1469 NZ LYS A 88 -1.113 37.863 17.854 1.00 0.00 N ATOM 0 H LYS A 88 1.169 34.259 14.129 1.00 0.00 H new ATOM 0 HA LYS A 88 3.680 33.807 15.337 1.00 0.00 H new ATOM 0 HB2 LYS A 88 3.385 36.149 16.261 1.00 0.00 H new ATOM 0 HB3 LYS A 88 3.391 35.956 14.520 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.733 37.565 14.948 1.00 0.00 H new ATOM 0 HG3 LYS A 88 0.847 36.094 14.598 1.00 0.00 H new ATOM 0 HD2 LYS A 88 0.236 35.770 16.891 1.00 0.00 H new ATOM 0 HD3 LYS A 88 1.456 36.888 17.468 1.00 0.00 H new ATOM 0 HE2 LYS A 88 0.242 38.790 16.525 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -0.916 37.723 15.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -1.712 38.713 17.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -1.716 37.016 17.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -0.500 37.878 18.694 1.00 0.00 H new ATOM 1483 N GLU A 89 1.141 33.656 17.419 1.00 0.00 N ATOM 1484 CA GLU A 89 0.735 33.245 18.780 1.00 0.00 C ATOM 1485 C GLU A 89 0.834 31.721 18.962 1.00 0.00 C ATOM 1486 O GLU A 89 1.049 31.264 20.075 1.00 0.00 O ATOM 1487 CB GLU A 89 -0.681 33.762 19.097 1.00 0.00 C ATOM 1488 CG GLU A 89 -1.765 33.333 18.091 1.00 0.00 C ATOM 1489 CD GLU A 89 -3.029 34.202 18.157 1.00 0.00 C ATOM 1490 OE1 GLU A 89 -2.900 35.447 18.030 1.00 0.00 O ATOM 1491 OE2 GLU A 89 -4.140 33.668 18.340 1.00 0.00 O ATOM 0 H GLU A 89 0.358 33.848 16.794 1.00 0.00 H new ATOM 0 HA GLU A 89 1.427 33.695 19.492 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -0.967 33.412 20.089 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -0.654 34.851 19.139 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -1.354 33.377 17.083 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -2.036 32.294 18.279 1.00 0.00 H new ATOM 1498 N TYR A 90 0.692 30.952 17.859 1.00 0.00 N ATOM 1499 CA TYR A 90 0.899 29.481 17.859 1.00 0.00 C ATOM 1500 C TYR A 90 2.376 29.150 18.145 1.00 0.00 C ATOM 1501 O TYR A 90 2.682 28.232 18.913 1.00 0.00 O ATOM 1502 CB TYR A 90 0.453 28.873 16.497 1.00 0.00 C ATOM 1503 CG TYR A 90 0.820 27.393 16.279 1.00 0.00 C ATOM 1504 CD1 TYR A 90 0.175 26.371 16.983 1.00 0.00 C ATOM 1505 CD2 TYR A 90 1.822 27.025 15.370 1.00 0.00 C ATOM 1506 CE1 TYR A 90 0.517 25.044 16.792 1.00 0.00 C ATOM 1507 CE2 TYR A 90 2.164 25.700 15.174 1.00 0.00 C ATOM 1508 CZ TYR A 90 1.510 24.713 15.887 1.00 0.00 C ATOM 1509 OH TYR A 90 1.854 23.389 15.698 1.00 0.00 O ATOM 0 H TYR A 90 0.432 31.328 16.947 1.00 0.00 H new ATOM 0 HA TYR A 90 0.289 29.041 18.648 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.628 28.978 16.409 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.897 29.461 15.694 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.604 26.622 17.688 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.337 27.792 14.811 1.00 0.00 H new ATOM 0 HE1 TYR A 90 0.010 24.269 17.348 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.938 25.438 14.468 1.00 0.00 H new ATOM 0 HH TYR A 90 2.567 23.329 15.028 1.00 0.00 H new ATOM 1519 N MET A 91 3.276 29.930 17.526 1.00 0.00 N ATOM 1520 CA MET A 91 4.733 29.758 17.665 1.00 0.00 C ATOM 1521 C MET A 91 5.206 30.206 19.065 1.00 0.00 C ATOM 1522 O MET A 91 6.181 29.667 19.604 1.00 0.00 O ATOM 1523 CB MET A 91 5.468 30.528 16.534 1.00 0.00 C ATOM 1524 CG MET A 91 5.160 30.011 15.112 1.00 0.00 C ATOM 1525 SD MET A 91 6.151 30.806 13.822 1.00 0.00 S ATOM 1526 CE MET A 91 5.769 32.544 14.047 1.00 0.00 C ATOM 0 H MET A 91 3.014 30.701 16.912 1.00 0.00 H new ATOM 0 HA MET A 91 4.978 28.700 17.566 1.00 0.00 H new ATOM 0 HB2 MET A 91 5.197 31.582 16.592 1.00 0.00 H new ATOM 0 HB3 MET A 91 6.542 30.466 16.706 1.00 0.00 H new ATOM 0 HG2 MET A 91 5.333 28.935 15.080 1.00 0.00 H new ATOM 0 HG3 MET A 91 4.103 30.171 14.897 1.00 0.00 H new ATOM 0 HE1 MET A 91 6.156 33.114 13.202 1.00 0.00 H new ATOM 0 HE2 MET A 91 4.689 32.674 14.108 1.00 0.00 H new ATOM 0 HE3 MET A 91 6.230 32.902 14.968 1.00 0.00 H new ATOM 1536 N LYS A 92 4.489 31.186 19.650 1.00 0.00 N ATOM 1537 CA LYS A 92 4.689 31.600 21.054 1.00 0.00 C ATOM 1538 C LYS A 92 4.113 30.548 22.018 1.00 0.00 C ATOM 1539 O LYS A 92 4.669 30.318 23.090 1.00 0.00 O ATOM 1540 CB LYS A 92 4.051 32.990 21.318 1.00 0.00 C ATOM 1541 CG LYS A 92 4.725 34.168 20.568 1.00 0.00 C ATOM 1542 CD LYS A 92 6.221 34.352 20.929 1.00 0.00 C ATOM 1543 CE LYS A 92 6.448 34.677 22.416 1.00 0.00 C ATOM 1544 NZ LYS A 92 7.890 34.787 22.750 1.00 0.00 N ATOM 0 H LYS A 92 3.759 31.710 19.167 1.00 0.00 H new ATOM 0 HA LYS A 92 5.761 31.680 21.233 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.999 32.951 21.034 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.085 33.192 22.389 1.00 0.00 H new ATOM 0 HG2 LYS A 92 4.636 34.004 19.494 1.00 0.00 H new ATOM 0 HG3 LYS A 92 4.188 35.089 20.796 1.00 0.00 H new ATOM 0 HD2 LYS A 92 6.764 33.442 20.675 1.00 0.00 H new ATOM 0 HD3 LYS A 92 6.640 35.153 20.320 1.00 0.00 H new ATOM 0 HE2 LYS A 92 5.947 35.613 22.663 1.00 0.00 H new ATOM 0 HE3 LYS A 92 5.992 33.900 23.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 7.996 35.007 23.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 8.365 33.886 22.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 8.321 35.546 22.184 1.00 0.00 H new ATOM 1558 N SER A 93 3.010 29.896 21.609 1.00 0.00 N ATOM 1559 CA SER A 93 2.362 28.825 22.393 1.00 0.00 C ATOM 1560 C SER A 93 3.277 27.594 22.528 1.00 0.00 C ATOM 1561 O SER A 93 3.171 26.849 23.508 1.00 0.00 O ATOM 1562 CB SER A 93 1.008 28.432 21.759 1.00 0.00 C ATOM 1563 OG SER A 93 0.078 29.489 21.866 1.00 0.00 O ATOM 0 H SER A 93 2.541 30.096 20.725 1.00 0.00 H new ATOM 0 HA SER A 93 2.177 29.211 23.395 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.154 28.175 20.710 1.00 0.00 H new ATOM 0 HB3 SER A 93 0.614 27.544 22.253 1.00 0.00 H new ATOM 0 HG SER A 93 0.330 30.210 21.252 1.00 0.00 H new ATOM 1798 N LYS A 106 15.907 29.486 11.933 1.00 0.00 N ATOM 1799 CA LYS A 106 14.562 29.296 11.368 1.00 0.00 C ATOM 1800 C LYS A 106 14.351 27.804 11.006 1.00 0.00 C ATOM 1801 O LYS A 106 15.302 27.011 11.033 1.00 0.00 O ATOM 1802 CB LYS A 106 14.350 30.234 10.127 1.00 0.00 C ATOM 1803 CG LYS A 106 15.052 29.807 8.809 1.00 0.00 C ATOM 1804 CD LYS A 106 16.598 29.884 8.820 1.00 0.00 C ATOM 1805 CE LYS A 106 17.145 31.320 8.744 1.00 0.00 C ATOM 1806 NZ LYS A 106 16.913 31.942 7.420 1.00 0.00 N ATOM 0 HA LYS A 106 13.814 29.571 12.112 1.00 0.00 H new ATOM 0 HB2 LYS A 106 13.280 30.309 9.935 1.00 0.00 H new ATOM 0 HB3 LYS A 106 14.697 31.233 10.391 1.00 0.00 H new ATOM 0 HG2 LYS A 106 14.759 28.783 8.577 1.00 0.00 H new ATOM 0 HG3 LYS A 106 14.680 30.436 8.000 1.00 0.00 H new ATOM 0 HD2 LYS A 106 16.970 29.410 9.728 1.00 0.00 H new ATOM 0 HD3 LYS A 106 16.988 29.311 7.979 1.00 0.00 H new ATOM 0 HE2 LYS A 106 16.672 31.927 9.516 1.00 0.00 H new ATOM 0 HE3 LYS A 106 18.214 31.311 8.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 17.358 32.882 7.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 17.327 31.343 6.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 15.891 32.039 7.256 1.00 0.00 H new ATOM 1820 N LYS A 107 13.113 27.433 10.668 1.00 0.00 N ATOM 1821 CA LYS A 107 12.742 26.037 10.337 1.00 0.00 C ATOM 1822 C LYS A 107 12.102 26.039 8.943 1.00 0.00 C ATOM 1823 O LYS A 107 11.410 26.986 8.597 1.00 0.00 O ATOM 1824 CB LYS A 107 11.768 25.476 11.442 1.00 0.00 C ATOM 1825 CG LYS A 107 11.770 23.927 11.620 1.00 0.00 C ATOM 1826 CD LYS A 107 11.119 23.171 10.434 1.00 0.00 C ATOM 1827 CE LYS A 107 11.548 21.700 10.326 1.00 0.00 C ATOM 1828 NZ LYS A 107 10.865 20.824 11.307 1.00 0.00 N ATOM 0 H LYS A 107 12.332 28.087 10.613 1.00 0.00 H new ATOM 0 HA LYS A 107 13.615 25.384 10.320 1.00 0.00 H new ATOM 0 HB2 LYS A 107 12.029 25.934 12.396 1.00 0.00 H new ATOM 0 HB3 LYS A 107 10.754 25.795 11.202 1.00 0.00 H new ATOM 0 HG2 LYS A 107 12.798 23.584 11.740 1.00 0.00 H new ATOM 0 HG3 LYS A 107 11.240 23.673 12.538 1.00 0.00 H new ATOM 0 HD2 LYS A 107 10.035 23.217 10.537 1.00 0.00 H new ATOM 0 HD3 LYS A 107 11.373 23.683 9.506 1.00 0.00 H new ATOM 0 HE2 LYS A 107 11.340 21.340 9.319 1.00 0.00 H new ATOM 0 HE3 LYS A 107 12.626 21.630 10.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 11.194 19.845 11.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 11.083 21.146 12.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 9.837 20.865 11.153 1.00 0.00 H new ATOM 1842 N LEU A 108 12.347 24.979 8.154 1.00 0.00 N ATOM 1843 CA LEU A 108 11.700 24.777 6.842 1.00 0.00 C ATOM 1844 C LEU A 108 10.206 24.487 7.058 1.00 0.00 C ATOM 1845 O LEU A 108 9.838 23.430 7.559 1.00 0.00 O ATOM 1846 CB LEU A 108 12.409 23.614 6.052 1.00 0.00 C ATOM 1847 CG LEU A 108 12.090 23.433 4.511 1.00 0.00 C ATOM 1848 CD1 LEU A 108 10.681 22.872 4.235 1.00 0.00 C ATOM 1849 CD2 LEU A 108 12.310 24.743 3.726 1.00 0.00 C ATOM 0 H LEU A 108 12.999 24.236 8.406 1.00 0.00 H new ATOM 0 HA LEU A 108 11.795 25.680 6.239 1.00 0.00 H new ATOM 0 HB2 LEU A 108 13.485 23.755 6.152 1.00 0.00 H new ATOM 0 HB3 LEU A 108 12.163 22.677 6.552 1.00 0.00 H new ATOM 0 HG LEU A 108 12.800 22.686 4.156 1.00 0.00 H new ATOM 0 HD11 LEU A 108 10.532 22.775 3.160 1.00 0.00 H new ATOM 0 HD12 LEU A 108 10.580 21.894 4.705 1.00 0.00 H new ATOM 0 HD13 LEU A 108 9.933 23.550 4.645 1.00 0.00 H new ATOM 0 HD21 LEU A 108 12.081 24.579 2.673 1.00 0.00 H new ATOM 0 HD22 LEU A 108 11.656 25.519 4.123 1.00 0.00 H new ATOM 0 HD23 LEU A 108 13.349 25.057 3.827 1.00 0.00 H new ATOM 1861 N TRP A 109 9.360 25.450 6.712 1.00 0.00 N ATOM 1862 CA TRP A 109 7.906 25.260 6.639 1.00 0.00 C ATOM 1863 C TRP A 109 7.518 24.976 5.178 1.00 0.00 C ATOM 1864 O TRP A 109 8.283 25.257 4.244 1.00 0.00 O ATOM 1865 CB TRP A 109 7.150 26.494 7.192 1.00 0.00 C ATOM 1866 CG TRP A 109 7.285 26.713 8.680 1.00 0.00 C ATOM 1867 CD1 TRP A 109 8.436 26.930 9.368 1.00 0.00 C ATOM 1868 CD2 TRP A 109 6.229 26.762 9.653 1.00 0.00 C ATOM 1869 NE1 TRP A 109 8.178 27.111 10.693 1.00 0.00 N ATOM 1870 CE2 TRP A 109 6.829 27.017 10.899 1.00 0.00 C ATOM 1871 CE3 TRP A 109 4.836 26.617 9.590 1.00 0.00 C ATOM 1872 CZ2 TRP A 109 6.092 27.135 12.075 1.00 0.00 C ATOM 1873 CZ3 TRP A 109 4.102 26.737 10.759 1.00 0.00 C ATOM 1874 CH2 TRP A 109 4.733 26.996 11.989 1.00 0.00 C ATOM 0 H TRP A 109 9.661 26.394 6.471 1.00 0.00 H new ATOM 0 HA TRP A 109 7.620 24.412 7.261 1.00 0.00 H new ATOM 0 HB2 TRP A 109 7.511 27.383 6.675 1.00 0.00 H new ATOM 0 HB3 TRP A 109 6.092 26.391 6.950 1.00 0.00 H new ATOM 0 HD1 TRP A 109 9.421 26.956 8.925 1.00 0.00 H new ATOM 0 HE1 TRP A 109 8.877 27.288 11.414 1.00 0.00 H new ATOM 0 HE3 TRP A 109 4.345 26.416 8.649 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 6.576 27.329 13.021 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 3.028 26.630 10.725 1.00 0.00 H new ATOM 0 HH2 TRP A 109 4.134 27.087 12.883 1.00 0.00 H new ATOM 1885 N MET A 110 6.335 24.408 4.996 1.00 0.00 N ATOM 1886 CA MET A 110 5.839 23.964 3.690 1.00 0.00 C ATOM 1887 C MET A 110 4.333 24.207 3.605 1.00 0.00 C ATOM 1888 O MET A 110 3.589 23.852 4.511 1.00 0.00 O ATOM 1889 CB MET A 110 6.183 22.463 3.471 1.00 0.00 C ATOM 1890 CG MET A 110 5.845 21.536 4.651 1.00 0.00 C ATOM 1891 SD MET A 110 6.069 19.789 4.268 1.00 0.00 S ATOM 1892 CE MET A 110 4.773 19.539 3.056 1.00 0.00 C ATOM 0 H MET A 110 5.679 24.238 5.758 1.00 0.00 H new ATOM 0 HA MET A 110 6.324 24.537 2.899 1.00 0.00 H new ATOM 0 HB2 MET A 110 5.651 22.110 2.588 1.00 0.00 H new ATOM 0 HB3 MET A 110 7.248 22.378 3.256 1.00 0.00 H new ATOM 0 HG2 MET A 110 6.473 21.798 5.502 1.00 0.00 H new ATOM 0 HG3 MET A 110 4.812 21.705 4.953 1.00 0.00 H new ATOM 0 HE1 MET A 110 4.130 18.719 3.375 1.00 0.00 H new ATOM 0 HE2 MET A 110 4.181 20.449 2.964 1.00 0.00 H new ATOM 0 HE3 MET A 110 5.219 19.297 2.091 1.00 0.00 H new ATOM 1902 N ALA A 111 3.899 24.822 2.508 1.00 0.00 N ATOM 1903 CA ALA A 111 2.496 25.134 2.260 1.00 0.00 C ATOM 1904 C ALA A 111 1.940 24.152 1.234 1.00 0.00 C ATOM 1905 O ALA A 111 2.195 24.290 0.038 1.00 0.00 O ATOM 1906 CB ALA A 111 2.376 26.580 1.761 1.00 0.00 C ATOM 0 H ALA A 111 4.521 25.121 1.757 1.00 0.00 H new ATOM 0 HA ALA A 111 1.919 25.040 3.180 1.00 0.00 H new ATOM 0 HB1 ALA A 111 1.328 26.815 1.575 1.00 0.00 H new ATOM 0 HB2 ALA A 111 2.772 27.259 2.516 1.00 0.00 H new ATOM 0 HB3 ALA A 111 2.943 26.694 0.837 1.00 0.00 H new ATOM 1912 N ILE A 112 1.190 23.159 1.714 1.00 0.00 N ATOM 1913 CA ILE A 112 0.523 22.180 0.849 1.00 0.00 C ATOM 1914 C ILE A 112 -0.750 22.824 0.313 1.00 0.00 C ATOM 1915 O ILE A 112 -1.596 23.226 1.114 1.00 0.00 O ATOM 1916 CB ILE A 112 0.128 20.869 1.635 1.00 0.00 C ATOM 1917 CG1 ILE A 112 1.328 20.310 2.454 1.00 0.00 C ATOM 1918 CG2 ILE A 112 -0.438 19.795 0.669 1.00 0.00 C ATOM 1919 CD1 ILE A 112 0.980 19.132 3.359 1.00 0.00 C ATOM 0 H ILE A 112 1.027 23.009 2.710 1.00 0.00 H new ATOM 0 HA ILE A 112 1.208 21.898 0.050 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.656 21.133 2.345 1.00 0.00 H new ATOM 0 HG12 ILE A 112 2.112 20.002 1.762 1.00 0.00 H new ATOM 0 HG13 ILE A 112 1.740 21.113 3.065 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.703 18.901 1.234 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.325 20.185 0.170 1.00 0.00 H new ATOM 0 HG23 ILE A 112 0.316 19.543 -0.077 1.00 0.00 H new ATOM 0 HD11 ILE A 112 1.873 18.806 3.892 1.00 0.00 H new ATOM 0 HD12 ILE A 112 0.220 19.438 4.078 1.00 0.00 H new ATOM 0 HD13 ILE A 112 0.598 18.309 2.755 1.00 0.00 H new ATOM 1931 N GLU A 113 -0.898 22.954 -1.015 1.00 0.00 N ATOM 1932 CA GLU A 113 -2.149 23.489 -1.572 1.00 0.00 C ATOM 1933 C GLU A 113 -3.161 22.342 -1.685 1.00 0.00 C ATOM 1934 O GLU A 113 -2.803 21.216 -1.998 1.00 0.00 O ATOM 1935 CB GLU A 113 -1.936 24.212 -2.923 1.00 0.00 C ATOM 1936 CG GLU A 113 -3.225 24.842 -3.497 1.00 0.00 C ATOM 1937 CD GLU A 113 -2.980 25.701 -4.742 1.00 0.00 C ATOM 1938 OE1 GLU A 113 -2.733 25.137 -5.826 1.00 0.00 O ATOM 1939 OE2 GLU A 113 -3.008 26.954 -4.639 1.00 0.00 O ATOM 0 H GLU A 113 -0.190 22.704 -1.705 1.00 0.00 H new ATOM 0 HA GLU A 113 -2.539 24.253 -0.899 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -1.186 24.993 -2.794 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -1.535 23.502 -3.646 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -3.929 24.048 -3.745 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -3.694 25.455 -2.728 1.00 0.00 H new ATOM 1946 N LEU A 114 -4.404 22.631 -1.349 1.00 0.00 N ATOM 1947 CA LEU A 114 -5.506 21.668 -1.332 1.00 0.00 C ATOM 1948 C LEU A 114 -6.598 22.144 -2.288 1.00 0.00 C ATOM 1949 O LEU A 114 -7.087 23.255 -2.153 1.00 0.00 O ATOM 1950 CB LEU A 114 -6.059 21.491 0.129 1.00 0.00 C ATOM 1951 CG LEU A 114 -5.349 20.411 1.010 1.00 0.00 C ATOM 1952 CD1 LEU A 114 -5.351 19.061 0.295 1.00 0.00 C ATOM 1953 CD2 LEU A 114 -3.917 20.801 1.419 1.00 0.00 C ATOM 0 H LEU A 114 -4.691 23.569 -1.071 1.00 0.00 H new ATOM 0 HA LEU A 114 -5.149 20.693 -1.664 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -5.989 22.451 0.641 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -7.118 21.240 0.066 1.00 0.00 H new ATOM 0 HG LEU A 114 -5.922 20.338 1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -4.854 18.318 0.919 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -6.379 18.749 0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -4.822 19.151 -0.654 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -3.484 20.008 2.028 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -3.310 20.945 0.525 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -3.942 21.727 1.994 1.00 0.00 H new ATOM 1965 N GLU A 115 -6.925 21.313 -3.282 1.00 0.00 N ATOM 1966 CA GLU A 115 -8.075 21.516 -4.182 1.00 0.00 C ATOM 1967 C GLU A 115 -9.098 20.398 -3.941 1.00 0.00 C ATOM 1968 O GLU A 115 -8.807 19.441 -3.212 1.00 0.00 O ATOM 1969 CB GLU A 115 -7.627 21.493 -5.674 1.00 0.00 C ATOM 1970 CG GLU A 115 -7.162 20.099 -6.176 1.00 0.00 C ATOM 1971 CD GLU A 115 -7.030 19.954 -7.704 1.00 0.00 C ATOM 1972 OE1 GLU A 115 -7.705 20.690 -8.457 1.00 0.00 O ATOM 1973 OE2 GLU A 115 -6.272 19.076 -8.163 1.00 0.00 O ATOM 0 H GLU A 115 -6.394 20.467 -3.491 1.00 0.00 H new ATOM 0 HA GLU A 115 -8.518 22.490 -3.972 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.455 21.833 -6.296 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -6.813 22.206 -5.809 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -6.197 19.872 -5.722 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.867 19.349 -5.817 1.00 0.00 H new ATOM 1980 N ASP A 116 -10.285 20.549 -4.561 1.00 0.00 N ATOM 1981 CA ASP A 116 -11.297 19.472 -4.708 1.00 0.00 C ATOM 1982 C ASP A 116 -11.638 18.801 -3.353 1.00 0.00 C ATOM 1983 O ASP A 116 -11.677 17.568 -3.221 1.00 0.00 O ATOM 1984 CB ASP A 116 -10.785 18.447 -5.774 1.00 0.00 C ATOM 1985 CG ASP A 116 -11.847 17.440 -6.246 1.00 0.00 C ATOM 1986 OD1 ASP A 116 -12.841 17.870 -6.873 1.00 0.00 O ATOM 1987 OD2 ASP A 116 -11.697 16.221 -6.007 1.00 0.00 O ATOM 0 H ASP A 116 -10.576 21.432 -4.981 1.00 0.00 H new ATOM 0 HA ASP A 116 -12.236 19.904 -5.056 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -10.412 18.996 -6.639 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -9.941 17.898 -5.357 1.00 0.00 H new ATOM 1992 N VAL A 117 -11.872 19.649 -2.344 1.00 0.00 N ATOM 1993 CA VAL A 117 -12.119 19.201 -0.975 1.00 0.00 C ATOM 1994 C VAL A 117 -13.542 18.616 -0.845 1.00 0.00 C ATOM 1995 O VAL A 117 -14.531 19.348 -0.918 1.00 0.00 O ATOM 1996 CB VAL A 117 -11.905 20.358 0.065 1.00 0.00 C ATOM 1997 CG1 VAL A 117 -12.109 19.842 1.500 1.00 0.00 C ATOM 1998 CG2 VAL A 117 -10.508 21.023 -0.088 1.00 0.00 C ATOM 0 H VAL A 117 -11.895 20.662 -2.457 1.00 0.00 H new ATOM 0 HA VAL A 117 -11.394 18.419 -0.751 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.653 21.124 -0.139 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.956 20.659 2.205 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -13.122 19.455 1.607 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -11.393 19.046 1.706 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.401 21.818 0.650 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.730 20.276 0.068 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.412 21.442 -1.090 1.00 0.00 H new ATOM 2008 N LYS A 118 -13.618 17.286 -0.697 1.00 0.00 N ATOM 2009 CA LYS A 118 -14.884 16.543 -0.554 1.00 0.00 C ATOM 2010 C LYS A 118 -15.288 16.456 0.930 1.00 0.00 C ATOM 2011 O LYS A 118 -14.433 16.495 1.815 1.00 0.00 O ATOM 2012 CB LYS A 118 -14.730 15.103 -1.165 1.00 0.00 C ATOM 2013 CG LYS A 118 -15.889 14.648 -2.082 1.00 0.00 C ATOM 2014 CD LYS A 118 -15.983 15.492 -3.376 1.00 0.00 C ATOM 2015 CE LYS A 118 -14.704 15.399 -4.240 1.00 0.00 C ATOM 2016 NZ LYS A 118 -14.764 16.283 -5.428 1.00 0.00 N ATOM 0 H LYS A 118 -12.794 16.686 -0.673 1.00 0.00 H new ATOM 0 HA LYS A 118 -15.669 17.073 -1.094 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -13.801 15.065 -1.735 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -14.632 14.388 -0.348 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.751 13.599 -2.345 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -16.830 14.719 -1.536 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -16.839 15.157 -3.963 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -16.165 16.534 -3.113 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -13.838 15.666 -3.634 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -14.561 14.368 -4.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -14.279 15.825 -6.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -15.758 16.458 -5.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -14.298 17.187 -5.212 1.00 0.00 H new ATOM 2030 N LYS A 119 -16.596 16.322 1.179 1.00 0.00 N ATOM 2031 CA LYS A 119 -17.156 16.102 2.528 1.00 0.00 C ATOM 2032 C LYS A 119 -17.669 14.664 2.665 1.00 0.00 C ATOM 2033 O LYS A 119 -18.318 14.136 1.758 1.00 0.00 O ATOM 2034 CB LYS A 119 -18.308 17.119 2.825 1.00 0.00 C ATOM 2035 CG LYS A 119 -17.871 18.386 3.594 1.00 0.00 C ATOM 2036 CD LYS A 119 -17.396 18.093 5.046 1.00 0.00 C ATOM 2037 CE LYS A 119 -18.439 17.367 5.909 1.00 0.00 C ATOM 2038 NZ LYS A 119 -18.038 17.312 7.335 1.00 0.00 N ATOM 0 H LYS A 119 -17.306 16.363 0.447 1.00 0.00 H new ATOM 0 HA LYS A 119 -16.361 16.262 3.257 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -18.759 17.422 1.880 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -19.083 16.611 3.400 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -17.064 18.874 3.047 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -18.704 19.088 3.627 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -16.489 17.490 5.006 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -17.132 19.034 5.528 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -19.399 17.875 5.822 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -18.579 16.354 5.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -18.871 17.475 7.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -17.636 16.377 7.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -17.326 18.046 7.524 1.00 0.00 H new ATOM 2052 N TYR A 120 -17.364 14.045 3.815 1.00 0.00 N ATOM 2053 CA TYR A 120 -17.900 12.731 4.199 1.00 0.00 C ATOM 2054 C TYR A 120 -19.126 12.932 5.103 1.00 0.00 C ATOM 2055 O TYR A 120 -19.032 12.882 6.334 1.00 0.00 O ATOM 2056 CB TYR A 120 -16.817 11.866 4.907 1.00 0.00 C ATOM 2057 CG TYR A 120 -15.647 11.368 4.030 1.00 0.00 C ATOM 2058 CD1 TYR A 120 -15.487 11.728 2.686 1.00 0.00 C ATOM 2059 CD2 TYR A 120 -14.691 10.521 4.570 1.00 0.00 C ATOM 2060 CE1 TYR A 120 -14.423 11.258 1.939 1.00 0.00 C ATOM 2061 CE2 TYR A 120 -13.626 10.052 3.829 1.00 0.00 C ATOM 2062 CZ TYR A 120 -13.493 10.419 2.519 1.00 0.00 C ATOM 2063 OH TYR A 120 -12.431 9.934 1.783 1.00 0.00 O ATOM 0 H TYR A 120 -16.734 14.445 4.510 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.202 12.192 3.301 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -16.402 12.447 5.731 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -17.308 10.997 5.345 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -16.209 12.385 2.224 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -14.783 10.219 5.603 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -14.320 11.547 0.903 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -12.898 9.396 4.283 1.00 0.00 H new ATOM 0 HH TYR A 120 -11.875 9.359 2.350 1.00 0.00 H new ATOM 2073 N ASP A 121 -20.260 13.248 4.461 1.00 0.00 N ATOM 2074 CA ASP A 121 -21.592 13.262 5.103 1.00 0.00 C ATOM 2075 C ASP A 121 -22.034 11.820 5.427 1.00 0.00 C ATOM 2076 O ASP A 121 -22.861 11.590 6.316 1.00 0.00 O ATOM 2077 CB ASP A 121 -22.624 13.945 4.169 1.00 0.00 C ATOM 2078 CG ASP A 121 -22.270 15.409 3.851 1.00 0.00 C ATOM 2079 OD1 ASP A 121 -21.425 15.650 2.958 1.00 0.00 O ATOM 2080 OD2 ASP A 121 -22.816 16.324 4.504 1.00 0.00 O ATOM 0 H ASP A 121 -20.284 13.504 3.474 1.00 0.00 H new ATOM 0 HA ASP A 121 -21.534 13.828 6.032 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -22.691 13.383 3.238 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -23.608 13.908 4.635 1.00 0.00 H new ATOM 2085 N LYS A 122 -21.478 10.865 4.660 1.00 0.00 N ATOM 2086 CA LYS A 122 -21.617 9.424 4.900 1.00 0.00 C ATOM 2087 C LYS A 122 -20.594 8.981 5.989 1.00 0.00 C ATOM 2088 O LYS A 122 -19.487 9.546 6.061 1.00 0.00 O ATOM 2089 CB LYS A 122 -21.385 8.661 3.559 1.00 0.00 C ATOM 2090 CG LYS A 122 -19.981 8.869 2.942 1.00 0.00 C ATOM 2091 CD LYS A 122 -19.801 8.186 1.568 1.00 0.00 C ATOM 2092 CE LYS A 122 -20.637 8.831 0.447 1.00 0.00 C ATOM 2093 NZ LYS A 122 -20.342 8.218 -0.871 1.00 0.00 N ATOM 0 H LYS A 122 -20.909 11.081 3.841 1.00 0.00 H new ATOM 0 HA LYS A 122 -22.619 9.192 5.261 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -21.540 7.596 3.729 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -22.137 8.981 2.838 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -19.796 9.938 2.834 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -19.230 8.483 3.631 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -18.748 8.219 1.290 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -20.075 7.134 1.655 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -21.698 8.720 0.672 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -20.430 9.900 0.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -20.921 8.675 -1.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -19.335 8.346 -1.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -20.563 7.202 -0.839 1.00 0.00 H new ATOM 2107 N PRO A 123 -20.948 7.985 6.864 1.00 0.00 N ATOM 2108 CA PRO A 123 -20.069 7.534 7.972 1.00 0.00 C ATOM 2109 C PRO A 123 -18.920 6.601 7.497 1.00 0.00 C ATOM 2110 O PRO A 123 -18.992 5.367 7.628 1.00 0.00 O ATOM 2111 CB PRO A 123 -21.069 6.823 8.923 1.00 0.00 C ATOM 2112 CG PRO A 123 -22.103 6.245 8.000 1.00 0.00 C ATOM 2113 CD PRO A 123 -22.235 7.232 6.852 1.00 0.00 C ATOM 0 HA PRO A 123 -19.530 8.353 8.449 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -20.578 6.046 9.509 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -21.513 7.523 9.631 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -21.798 5.263 7.638 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -23.055 6.114 8.514 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -22.387 6.719 5.902 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -23.087 7.897 6.995 1.00 0.00 H new ATOM 2121 N ILE A 124 -17.877 7.208 6.897 1.00 0.00 N ATOM 2122 CA ILE A 124 -16.651 6.489 6.508 1.00 0.00 C ATOM 2123 C ILE A 124 -15.689 6.452 7.705 1.00 0.00 C ATOM 2124 O ILE A 124 -15.374 7.492 8.305 1.00 0.00 O ATOM 2125 CB ILE A 124 -15.947 7.134 5.249 1.00 0.00 C ATOM 2126 CG1 ILE A 124 -16.883 7.043 3.997 1.00 0.00 C ATOM 2127 CG2 ILE A 124 -14.566 6.478 4.960 1.00 0.00 C ATOM 2128 CD1 ILE A 124 -16.287 7.586 2.699 1.00 0.00 C ATOM 0 H ILE A 124 -17.861 8.202 6.671 1.00 0.00 H new ATOM 0 HA ILE A 124 -16.930 5.475 6.221 1.00 0.00 H new ATOM 0 HB ILE A 124 -15.763 8.185 5.472 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -17.157 5.999 3.843 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -17.803 7.586 4.211 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -14.115 6.950 4.087 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -13.913 6.611 5.822 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -14.702 5.414 4.768 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -17.012 7.478 1.892 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -16.039 8.640 2.825 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -15.384 7.028 2.452 1.00 0.00 H new ATOM 2140 N LYS A 125 -15.224 5.242 8.028 1.00 0.00 N ATOM 2141 CA LYS A 125 -14.334 4.983 9.166 1.00 0.00 C ATOM 2142 C LYS A 125 -12.927 4.629 8.644 1.00 0.00 C ATOM 2143 O LYS A 125 -12.802 4.031 7.563 1.00 0.00 O ATOM 2144 CB LYS A 125 -14.906 3.855 10.095 1.00 0.00 C ATOM 2145 CG LYS A 125 -14.966 2.409 9.517 1.00 0.00 C ATOM 2146 CD LYS A 125 -16.042 2.192 8.421 1.00 0.00 C ATOM 2147 CE LYS A 125 -17.470 2.548 8.879 1.00 0.00 C ATOM 2148 NZ LYS A 125 -18.452 2.429 7.773 1.00 0.00 N ATOM 0 H LYS A 125 -15.458 4.402 7.499 1.00 0.00 H new ATOM 0 HA LYS A 125 -14.266 5.884 9.775 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -14.304 3.830 11.003 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -15.915 4.142 10.390 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -13.990 2.157 9.103 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -15.155 1.713 10.335 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -15.788 2.796 7.550 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -16.020 1.149 8.104 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -17.763 1.890 9.697 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -17.483 3.566 9.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -18.818 3.372 7.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -17.988 2.013 6.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -19.239 1.818 8.072 1.00 0.00 H new ATOM 2162 N PRO A 126 -11.841 5.014 9.380 1.00 0.00 N ATOM 2163 CA PRO A 126 -10.453 4.736 8.965 1.00 0.00 C ATOM 2164 C PRO A 126 -10.077 3.259 9.135 1.00 0.00 C ATOM 2165 O PRO A 126 -10.548 2.598 10.064 1.00 0.00 O ATOM 2166 CB PRO A 126 -9.598 5.645 9.900 1.00 0.00 C ATOM 2167 CG PRO A 126 -10.581 6.541 10.583 1.00 0.00 C ATOM 2168 CD PRO A 126 -11.857 5.752 10.657 1.00 0.00 C ATOM 0 HA PRO A 126 -10.296 4.941 7.906 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -9.039 5.051 10.623 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -8.870 6.222 9.330 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -10.233 6.819 11.578 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -10.723 7.466 10.024 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -11.871 5.080 11.515 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -12.731 6.398 10.743 1.00 0.00 H new ATOM 2176 N LYS A 127 -9.212 2.768 8.234 1.00 0.00 N ATOM 2177 CA LYS A 127 -8.621 1.414 8.318 1.00 0.00 C ATOM 2178 C LYS A 127 -7.616 1.365 9.505 1.00 0.00 C ATOM 2179 O LYS A 127 -7.384 0.308 10.101 1.00 0.00 O ATOM 2180 CB LYS A 127 -7.932 1.056 6.945 1.00 0.00 C ATOM 2181 CG LYS A 127 -7.994 -0.441 6.519 1.00 0.00 C ATOM 2182 CD LYS A 127 -7.191 -1.391 7.436 1.00 0.00 C ATOM 2183 CE LYS A 127 -7.317 -2.863 7.021 1.00 0.00 C ATOM 2184 NZ LYS A 127 -6.567 -3.762 7.930 1.00 0.00 N ATOM 0 H LYS A 127 -8.898 3.298 7.421 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.395 0.670 8.504 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.396 1.655 6.162 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -6.885 1.355 6.998 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.036 -0.761 6.505 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -7.619 -0.534 5.500 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -6.140 -1.102 7.420 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -7.538 -1.277 8.463 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.369 -3.149 7.015 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -6.947 -2.986 6.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -6.678 -4.747 7.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -5.559 -3.506 7.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -6.937 -3.665 8.897 1.00 0.00 H new ATOM 2198 N ARG A 128 -7.055 2.541 9.842 1.00 0.00 N ATOM 2199 CA ARG A 128 -6.073 2.709 10.926 1.00 0.00 C ATOM 2200 C ARG A 128 -6.295 4.062 11.610 1.00 0.00 C ATOM 2201 O ARG A 128 -6.848 4.988 11.011 1.00 0.00 O ATOM 2202 CB ARG A 128 -4.633 2.625 10.354 1.00 0.00 C ATOM 2203 CG ARG A 128 -4.271 3.773 9.377 1.00 0.00 C ATOM 2204 CD ARG A 128 -2.904 3.581 8.708 1.00 0.00 C ATOM 2205 NE ARG A 128 -1.800 3.590 9.685 1.00 0.00 N ATOM 2206 CZ ARG A 128 -0.668 2.875 9.586 1.00 0.00 C ATOM 2207 NH1 ARG A 128 -0.491 2.012 8.590 1.00 0.00 N ATOM 2208 NH2 ARG A 128 0.277 3.022 10.499 1.00 0.00 N ATOM 0 H ARG A 128 -7.275 3.413 9.361 1.00 0.00 H new ATOM 0 HA ARG A 128 -6.202 1.913 11.659 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -3.924 2.630 11.182 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -4.514 1.672 9.838 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -5.039 3.844 8.607 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -4.275 4.719 9.919 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -2.897 2.637 8.163 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -2.745 4.373 7.976 1.00 0.00 H new ATOM 0 HE ARG A 128 -1.905 4.189 10.504 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -1.221 1.886 7.888 1.00 0.00 H new ATOM 0 HH12 ARG A 128 0.374 1.476 8.528 1.00 0.00 H new ATOM 0 HH21 ARG A 128 0.143 3.675 11.271 1.00 0.00 H new ATOM 0 HH22 ARG A 128 1.140 2.483 10.431 1.00 0.00 H new ATOM 2222 N LEU A 129 -5.800 4.181 12.841 1.00 0.00 N ATOM 2223 CA LEU A 129 -5.983 5.378 13.666 1.00 0.00 C ATOM 2224 C LEU A 129 -5.009 6.449 13.163 1.00 0.00 C ATOM 2225 O LEU A 129 -3.833 6.151 12.921 1.00 0.00 O ATOM 2226 CB LEU A 129 -5.749 5.032 15.178 1.00 0.00 C ATOM 2227 CG LEU A 129 -6.426 5.963 16.250 1.00 0.00 C ATOM 2228 CD1 LEU A 129 -5.785 7.367 16.328 1.00 0.00 C ATOM 2229 CD2 LEU A 129 -7.953 6.051 16.010 1.00 0.00 C ATOM 0 H LEU A 129 -5.258 3.447 13.298 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.002 5.757 13.585 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -6.099 4.014 15.348 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.674 5.034 15.361 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.252 5.501 17.222 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.298 7.959 17.086 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -4.732 7.272 16.593 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -5.873 7.861 15.360 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.403 6.700 16.762 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.142 6.460 15.018 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.390 5.055 16.081 1.00 0.00 H new ATOM 2241 N VAL A 130 -5.518 7.681 12.983 1.00 0.00 N ATOM 2242 CA VAL A 130 -4.719 8.826 12.521 1.00 0.00 C ATOM 2243 C VAL A 130 -4.458 9.778 13.717 1.00 0.00 C ATOM 2244 O VAL A 130 -5.326 10.593 14.060 1.00 0.00 O ATOM 2245 CB VAL A 130 -5.428 9.600 11.338 1.00 0.00 C ATOM 2246 CG1 VAL A 130 -4.481 10.661 10.719 1.00 0.00 C ATOM 2247 CG2 VAL A 130 -5.953 8.620 10.257 1.00 0.00 C ATOM 0 H VAL A 130 -6.497 7.909 13.155 1.00 0.00 H new ATOM 0 HA VAL A 130 -3.772 8.452 12.133 1.00 0.00 H new ATOM 0 HB VAL A 130 -6.289 10.123 11.754 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -4.994 11.178 9.908 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -4.193 11.382 11.484 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -3.589 10.170 10.329 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.435 9.184 9.458 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.119 8.050 9.847 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.674 7.937 10.705 1.00 0.00 H new ATOM 2257 N PRO A 131 -3.273 9.645 14.415 1.00 0.00 N ATOM 2258 CA PRO A 131 -2.882 10.549 15.529 1.00 0.00 C ATOM 2259 C PRO A 131 -2.364 11.906 15.015 1.00 0.00 C ATOM 2260 O PRO A 131 -2.350 12.150 13.807 1.00 0.00 O ATOM 2261 CB PRO A 131 -1.769 9.745 16.243 1.00 0.00 C ATOM 2262 CG PRO A 131 -1.115 8.976 15.136 1.00 0.00 C ATOM 2263 CD PRO A 131 -2.237 8.598 14.188 1.00 0.00 C ATOM 0 HA PRO A 131 -3.715 10.808 16.182 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.060 10.403 16.746 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -2.181 9.080 17.003 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -0.361 9.580 14.631 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -0.609 8.090 15.519 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -1.898 8.591 13.152 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -2.623 7.602 14.404 1.00 0.00 H new ATOM 2271 N VAL A 132 -1.899 12.752 15.951 1.00 0.00 N ATOM 2272 CA VAL A 132 -1.468 14.141 15.680 1.00 0.00 C ATOM 2273 C VAL A 132 -0.334 14.251 14.626 1.00 0.00 C ATOM 2274 O VAL A 132 -0.223 15.279 13.948 1.00 0.00 O ATOM 2275 CB VAL A 132 -1.042 14.849 17.017 1.00 0.00 C ATOM 2276 CG1 VAL A 132 -2.248 14.979 17.988 1.00 0.00 C ATOM 2277 CG2 VAL A 132 0.137 14.098 17.695 1.00 0.00 C ATOM 0 H VAL A 132 -1.809 12.489 16.932 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.331 14.648 15.249 1.00 0.00 H new ATOM 0 HB VAL A 132 -0.701 15.854 16.768 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -1.925 15.472 18.905 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -3.033 15.569 17.516 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.632 13.987 18.226 1.00 0.00 H new ATOM 0 HG21 VAL A 132 0.411 14.609 18.618 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -0.166 13.076 17.923 1.00 0.00 H new ATOM 0 HG23 VAL A 132 0.993 14.081 17.021 1.00 0.00 H new ATOM 2287 N GLY A 133 0.485 13.187 14.496 1.00 0.00 N ATOM 2288 CA GLY A 133 1.590 13.153 13.527 1.00 0.00 C ATOM 2289 C GLY A 133 1.134 12.919 12.086 1.00 0.00 C ATOM 2290 O GLY A 133 1.855 13.266 11.143 1.00 0.00 O ATOM 0 H GLY A 133 0.398 12.338 15.055 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.136 14.095 13.578 1.00 0.00 H new ATOM 0 HA3 GLY A 133 2.287 12.365 13.811 1.00 0.00 H new ATOM 2294 N GLY A 134 -0.070 12.329 11.927 1.00 0.00 N ATOM 2295 CA GLY A 134 -0.633 12.012 10.610 1.00 0.00 C ATOM 2296 C GLY A 134 -0.105 10.690 10.055 1.00 0.00 C ATOM 2297 O GLY A 134 1.024 10.289 10.362 1.00 0.00 O ATOM 0 H GLY A 134 -0.671 12.063 12.707 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -1.719 11.964 10.684 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -0.396 12.816 9.913 1.00 0.00 H new ATOM 2301 N GLN A 135 -0.934 9.987 9.260 1.00 0.00 N ATOM 2302 CA GLN A 135 -0.563 8.701 8.625 1.00 0.00 C ATOM 2303 C GLN A 135 -0.381 8.899 7.122 1.00 0.00 C ATOM 2304 O GLN A 135 -1.191 9.566 6.485 1.00 0.00 O ATOM 2305 CB GLN A 135 -1.654 7.615 8.881 1.00 0.00 C ATOM 2306 CG GLN A 135 -1.977 7.371 10.362 1.00 0.00 C ATOM 2307 CD GLN A 135 -0.789 6.854 11.177 1.00 0.00 C ATOM 2308 OE1 GLN A 135 -0.582 5.654 11.312 1.00 0.00 O ATOM 2309 NE2 GLN A 135 -0.003 7.766 11.727 1.00 0.00 N ATOM 0 H GLN A 135 -1.882 10.292 9.038 1.00 0.00 H new ATOM 0 HA GLN A 135 0.374 8.361 9.067 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -2.569 7.909 8.367 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -1.326 6.676 8.435 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -2.332 8.302 10.805 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -2.794 6.653 10.432 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -0.203 8.758 11.596 1.00 0.00 H new ATOM 0 HE22 GLN A 135 0.802 7.477 12.282 1.00 0.00 H new ATOM 2318 N TYR A 136 0.682 8.320 6.563 1.00 0.00 N ATOM 2319 CA TYR A 136 0.893 8.293 5.107 1.00 0.00 C ATOM 2320 C TYR A 136 -0.035 7.239 4.486 1.00 0.00 C ATOM 2321 O TYR A 136 0.153 6.034 4.698 1.00 0.00 O ATOM 2322 CB TYR A 136 2.390 8.031 4.734 1.00 0.00 C ATOM 2323 CG TYR A 136 3.173 9.309 4.373 1.00 0.00 C ATOM 2324 CD1 TYR A 136 2.726 10.140 3.337 1.00 0.00 C ATOM 2325 CD2 TYR A 136 4.346 9.678 5.038 1.00 0.00 C ATOM 2326 CE1 TYR A 136 3.419 11.277 2.982 1.00 0.00 C ATOM 2327 CE2 TYR A 136 5.039 10.824 4.683 1.00 0.00 C ATOM 2328 CZ TYR A 136 4.571 11.615 3.655 1.00 0.00 C ATOM 2329 OH TYR A 136 5.270 12.740 3.280 1.00 0.00 O ATOM 0 H TYR A 136 1.418 7.859 7.098 1.00 0.00 H new ATOM 0 HA TYR A 136 0.648 9.274 4.700 1.00 0.00 H new ATOM 0 HB2 TYR A 136 2.883 7.538 5.572 1.00 0.00 H new ATOM 0 HB3 TYR A 136 2.430 7.341 3.891 1.00 0.00 H new ATOM 0 HD1 TYR A 136 1.821 9.884 2.806 1.00 0.00 H new ATOM 0 HD2 TYR A 136 4.718 9.060 5.842 1.00 0.00 H new ATOM 0 HE1 TYR A 136 3.059 11.901 2.178 1.00 0.00 H new ATOM 0 HE2 TYR A 136 5.942 11.097 5.209 1.00 0.00 H new ATOM 0 HH TYR A 136 6.190 12.492 3.049 1.00 0.00 H new ATOM 2339 N LEU A 137 -1.049 7.714 3.748 1.00 0.00 N ATOM 2340 CA LEU A 137 -2.029 6.848 3.093 1.00 0.00 C ATOM 2341 C LEU A 137 -1.387 6.309 1.802 1.00 0.00 C ATOM 2342 O LEU A 137 -1.084 7.068 0.881 1.00 0.00 O ATOM 2343 CB LEU A 137 -3.360 7.625 2.787 1.00 0.00 C ATOM 2344 CG LEU A 137 -4.705 6.810 2.904 1.00 0.00 C ATOM 2345 CD1 LEU A 137 -5.903 7.658 2.429 1.00 0.00 C ATOM 2346 CD2 LEU A 137 -4.662 5.451 2.156 1.00 0.00 C ATOM 0 H LEU A 137 -1.209 8.709 3.591 1.00 0.00 H new ATOM 0 HA LEU A 137 -2.298 6.021 3.750 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -3.419 8.476 3.465 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -3.294 8.027 1.776 1.00 0.00 H new ATOM 0 HG LEU A 137 -4.832 6.577 3.961 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -6.820 7.075 2.519 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -5.981 8.554 3.044 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -5.756 7.945 1.388 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -5.617 4.940 2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -4.473 5.625 1.097 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -3.865 4.833 2.570 1.00 0.00 H new ATOM 2358 N ARG A 138 -1.161 5.002 1.758 1.00 0.00 N ATOM 2359 CA ARG A 138 -0.623 4.318 0.576 1.00 0.00 C ATOM 2360 C ARG A 138 -1.565 3.179 0.210 1.00 0.00 C ATOM 2361 O ARG A 138 -2.082 2.507 1.111 1.00 0.00 O ATOM 2362 CB ARG A 138 0.838 3.810 0.822 1.00 0.00 C ATOM 2363 CG ARG A 138 1.019 2.539 1.691 1.00 0.00 C ATOM 2364 CD ARG A 138 0.600 2.711 3.163 1.00 0.00 C ATOM 2365 NE ARG A 138 0.691 1.439 3.897 1.00 0.00 N ATOM 2366 CZ ARG A 138 -0.252 0.480 3.913 1.00 0.00 C ATOM 2367 NH1 ARG A 138 -1.416 0.646 3.282 1.00 0.00 N ATOM 2368 NH2 ARG A 138 -0.020 -0.648 4.561 1.00 0.00 N ATOM 0 H ARG A 138 -1.345 4.378 2.543 1.00 0.00 H new ATOM 0 HA ARG A 138 -0.563 5.018 -0.257 1.00 0.00 H new ATOM 0 HB2 ARG A 138 1.296 3.621 -0.149 1.00 0.00 H new ATOM 0 HB3 ARG A 138 1.401 4.619 1.288 1.00 0.00 H new ATOM 0 HG2 ARG A 138 0.438 1.728 1.253 1.00 0.00 H new ATOM 0 HG3 ARG A 138 2.065 2.236 1.657 1.00 0.00 H new ATOM 0 HD2 ARG A 138 1.238 3.455 3.640 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -0.421 3.089 3.211 1.00 0.00 H new ATOM 0 HE ARG A 138 1.539 1.271 4.438 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -1.603 1.512 2.776 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -2.119 -0.093 3.306 1.00 0.00 H new ATOM 0 HH21 ARG A 138 0.868 -0.786 5.043 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -0.729 -1.381 4.579 1.00 0.00 H new ATOM 2382 N GLU A 139 -1.830 2.974 -1.094 1.00 0.00 N ATOM 2383 CA GLU A 139 -2.710 1.870 -1.516 1.00 0.00 C ATOM 2384 C GLU A 139 -1.852 0.616 -1.831 1.00 0.00 C ATOM 2385 O GLU A 139 -1.483 -0.108 -0.877 1.00 0.00 O ATOM 2386 CB GLU A 139 -3.610 2.296 -2.711 1.00 0.00 C ATOM 2387 CG GLU A 139 -4.806 1.352 -2.969 1.00 0.00 C ATOM 2388 CD GLU A 139 -5.821 1.302 -1.805 1.00 0.00 C ATOM 2389 OE1 GLU A 139 -6.727 2.169 -1.755 1.00 0.00 O ATOM 2390 OE2 GLU A 139 -5.725 0.399 -0.940 1.00 0.00 O ATOM 2391 OXT GLU A 139 -1.510 0.386 -3.012 1.00 0.00 O ATOM 0 H GLU A 139 -1.458 3.542 -1.855 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.389 1.615 -0.702 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -3.988 3.302 -2.527 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -2.999 2.345 -3.612 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -5.321 1.672 -3.875 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -4.430 0.346 -3.155 1.00 0.00 H new