USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=27 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 Single : A 3 LYS NZ :NH3+ 169:sc= 0.697 (180deg=0.618) USER MOD Single : A 8 THR OG1 : rot 47:sc= 0.23 USER MOD Single : A 9 TYR OH : rot -118:sc= 0.142 USER MOD Single : A 13 LYS NZ :NH3+ 160:sc= 1.16 (180deg=0.852) USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ -178:sc= 0.0657 (180deg=0.0441) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -134:sc= 0.571 (180deg=-0.3) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0369) USER MOD Single : A 38 LYS NZ :NH3+ 178:sc= 0.184 (180deg=0.183) USER MOD Single : A 41 MET CE :methyl -149:sc= -0.374 (180deg=-2.15!) USER MOD Single : A 42 LYS NZ :NH3+ 143:sc= 0.382 (180deg=0.0141) USER MOD Single : A 46 TYR OH : rot 180:sc= -0.862 USER MOD Single : A 61 LYS NZ :NH3+ -124:sc= 0.539 (180deg=-0.126) USER MOD Single : A 66 SER OG : rot -115:sc= -0.817 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 70 MET CE :methyl -157:sc= -0.173 (180deg=-0.808) USER MOD Single : A 71 GLN : amide:sc= -0.143 K(o=-0.14,f=-3.1!) USER MOD Single : A 75 THR OG1 : rot 87:sc= 1.08 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.0548 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 173:sc= 0.199 (180deg=0.182) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 MET CE :methyl -168:sc= -1.59 (180deg=-1.76) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -153:sc= 0.984 (180deg=0.236) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 MET CE :methyl -120:sc= -0.43 (180deg=-1.12) USER MOD Single : A 118 LYS NZ :NH3+ 143:sc= 0.668 (180deg=0.32) USER MOD Single : A 119 LYS NZ :NH3+ 164:sc= -0.565 (180deg=-0.952) USER MOD Single : A 120 TYR OH : rot 17:sc= 0.195 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.2) USER MOD Single : A 136 TYR OH : rot 0:sc= 0.448 USER MOD ----------------------------------------------------------------- ATOM 29 N LYS A 3 3.660 2.734 -3.710 1.00 0.00 N ATOM 30 CA LYS A 3 3.024 3.601 -4.721 1.00 0.00 C ATOM 31 C LYS A 3 2.371 4.855 -4.084 1.00 0.00 C ATOM 32 O LYS A 3 2.254 5.886 -4.748 1.00 0.00 O ATOM 33 CB LYS A 3 1.966 2.796 -5.515 1.00 0.00 C ATOM 34 CG LYS A 3 0.817 2.209 -4.656 1.00 0.00 C ATOM 35 CD LYS A 3 -0.198 1.386 -5.479 1.00 0.00 C ATOM 36 CE LYS A 3 -1.005 2.249 -6.464 1.00 0.00 C ATOM 37 NZ LYS A 3 -2.046 1.454 -7.167 1.00 0.00 N ATOM 0 HA LYS A 3 3.805 3.947 -5.397 1.00 0.00 H new ATOM 0 HB2 LYS A 3 1.535 3.443 -6.279 1.00 0.00 H new ATOM 0 HB3 LYS A 3 2.466 1.979 -6.035 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.241 1.576 -3.877 1.00 0.00 H new ATOM 0 HG3 LYS A 3 0.294 3.024 -4.155 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.333 0.611 -6.032 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -0.884 0.880 -4.800 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -1.477 3.071 -5.926 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -0.330 2.693 -7.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -2.686 2.095 -7.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.591 0.808 -7.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -2.589 0.902 -6.473 1.00 0.00 H new ATOM 51 N ILE A 4 1.951 4.733 -2.791 1.00 0.00 N ATOM 52 CA ILE A 4 1.264 5.807 -2.026 1.00 0.00 C ATOM 53 C ILE A 4 -0.126 6.112 -2.682 1.00 0.00 C ATOM 54 O ILE A 4 -0.583 5.344 -3.538 1.00 0.00 O ATOM 55 CB ILE A 4 2.214 7.099 -1.844 1.00 0.00 C ATOM 56 CG1 ILE A 4 3.641 6.668 -1.348 1.00 0.00 C ATOM 57 CG2 ILE A 4 1.635 8.170 -0.867 1.00 0.00 C ATOM 58 CD1 ILE A 4 3.669 5.949 -0.001 1.00 0.00 C ATOM 0 H ILE A 4 2.083 3.878 -2.250 1.00 0.00 H new ATOM 0 HA ILE A 4 1.061 5.469 -1.010 1.00 0.00 H new ATOM 0 HB ILE A 4 2.275 7.561 -2.829 1.00 0.00 H new ATOM 0 HG12 ILE A 4 4.088 6.017 -2.099 1.00 0.00 H new ATOM 0 HG13 ILE A 4 4.269 7.556 -1.281 1.00 0.00 H new ATOM 0 HG21 ILE A 4 2.327 9.009 -0.795 1.00 0.00 H new ATOM 0 HG22 ILE A 4 0.675 8.524 -1.242 1.00 0.00 H new ATOM 0 HG23 ILE A 4 1.498 7.727 0.119 1.00 0.00 H new ATOM 0 HD11 ILE A 4 4.698 5.693 0.254 1.00 0.00 H new ATOM 0 HD12 ILE A 4 3.256 6.602 0.768 1.00 0.00 H new ATOM 0 HD13 ILE A 4 3.073 5.038 -0.062 1.00 0.00 H new ATOM 70 N VAL A 5 -0.863 7.093 -2.135 1.00 0.00 N ATOM 71 CA VAL A 5 -1.950 7.830 -2.835 1.00 0.00 C ATOM 72 C VAL A 5 -2.033 9.250 -2.258 1.00 0.00 C ATOM 73 O VAL A 5 -2.245 10.211 -2.996 1.00 0.00 O ATOM 74 CB VAL A 5 -3.394 7.160 -2.770 1.00 0.00 C ATOM 75 CG1 VAL A 5 -3.570 6.060 -3.839 1.00 0.00 C ATOM 76 CG2 VAL A 5 -3.704 6.610 -1.360 1.00 0.00 C ATOM 0 H VAL A 5 -0.724 7.409 -1.175 1.00 0.00 H new ATOM 0 HA VAL A 5 -1.676 7.819 -3.890 1.00 0.00 H new ATOM 0 HB VAL A 5 -4.114 7.949 -2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -4.569 5.631 -3.758 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.440 6.493 -4.831 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -2.826 5.279 -3.684 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.697 6.161 -1.355 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.963 5.856 -1.093 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -3.671 7.424 -0.636 1.00 0.00 H new ATOM 86 N GLY A 6 -1.866 9.362 -0.927 1.00 0.00 N ATOM 87 CA GLY A 6 -1.988 10.631 -0.228 1.00 0.00 C ATOM 88 C GLY A 6 -1.488 10.574 1.210 1.00 0.00 C ATOM 89 O GLY A 6 -0.756 9.655 1.595 1.00 0.00 O ATOM 0 H GLY A 6 -1.644 8.573 -0.319 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -1.428 11.393 -0.771 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -3.033 10.941 -0.231 1.00 0.00 H new ATOM 93 N VAL A 7 -1.879 11.575 2.000 1.00 0.00 N ATOM 94 CA VAL A 7 -1.577 11.644 3.446 1.00 0.00 C ATOM 95 C VAL A 7 -2.837 12.111 4.202 1.00 0.00 C ATOM 96 O VAL A 7 -3.592 12.948 3.702 1.00 0.00 O ATOM 97 CB VAL A 7 -0.343 12.597 3.733 1.00 0.00 C ATOM 98 CG1 VAL A 7 -0.607 14.046 3.257 1.00 0.00 C ATOM 99 CG2 VAL A 7 0.087 12.562 5.227 1.00 0.00 C ATOM 0 H VAL A 7 -2.419 12.371 1.660 1.00 0.00 H new ATOM 0 HA VAL A 7 -1.296 10.652 3.800 1.00 0.00 H new ATOM 0 HB VAL A 7 0.491 12.210 3.148 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.264 14.664 3.473 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -0.796 14.048 2.183 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -1.476 14.448 3.779 1.00 0.00 H new ATOM 0 HG21 VAL A 7 0.935 13.230 5.377 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.745 12.886 5.853 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.372 11.546 5.500 1.00 0.00 H new ATOM 109 N THR A 8 -3.079 11.532 5.384 1.00 0.00 N ATOM 110 CA THR A 8 -4.226 11.879 6.237 1.00 0.00 C ATOM 111 C THR A 8 -3.738 12.533 7.542 1.00 0.00 C ATOM 112 O THR A 8 -2.725 12.119 8.122 1.00 0.00 O ATOM 113 CB THR A 8 -5.134 10.628 6.534 1.00 0.00 C ATOM 114 OG1 THR A 8 -6.213 10.990 7.416 1.00 0.00 O ATOM 115 CG2 THR A 8 -4.352 9.447 7.135 1.00 0.00 C ATOM 0 H THR A 8 -2.482 10.805 5.779 1.00 0.00 H new ATOM 0 HA THR A 8 -4.842 12.597 5.696 1.00 0.00 H new ATOM 0 HB THR A 8 -5.530 10.299 5.573 1.00 0.00 H new ATOM 0 HG1 THR A 8 -6.630 11.819 7.100 1.00 0.00 H new ATOM 0 HG21 THR A 8 -5.032 8.615 7.317 1.00 0.00 H new ATOM 0 HG22 THR A 8 -3.574 9.134 6.439 1.00 0.00 H new ATOM 0 HG23 THR A 8 -3.894 9.754 8.075 1.00 0.00 H new ATOM 123 N TYR A 9 -4.458 13.577 7.976 1.00 0.00 N ATOM 124 CA TYR A 9 -4.171 14.307 9.229 1.00 0.00 C ATOM 125 C TYR A 9 -5.462 14.472 10.042 1.00 0.00 C ATOM 126 O TYR A 9 -6.523 14.703 9.457 1.00 0.00 O ATOM 127 CB TYR A 9 -3.523 15.705 8.944 1.00 0.00 C ATOM 128 CG TYR A 9 -1.989 15.706 8.972 1.00 0.00 C ATOM 129 CD1 TYR A 9 -1.232 15.425 7.833 1.00 0.00 C ATOM 130 CD2 TYR A 9 -1.302 15.981 10.157 1.00 0.00 C ATOM 131 CE1 TYR A 9 0.148 15.420 7.876 1.00 0.00 C ATOM 132 CE2 TYR A 9 0.075 15.979 10.201 1.00 0.00 C ATOM 133 CZ TYR A 9 0.796 15.697 9.062 1.00 0.00 C ATOM 134 OH TYR A 9 2.173 15.683 9.117 1.00 0.00 O ATOM 0 H TYR A 9 -5.262 13.945 7.468 1.00 0.00 H new ATOM 0 HA TYR A 9 -3.453 13.723 9.806 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -3.857 16.055 7.968 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -3.889 16.419 9.681 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -1.735 15.208 6.902 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -1.861 16.199 11.055 1.00 0.00 H new ATOM 0 HE1 TYR A 9 0.718 15.200 6.985 1.00 0.00 H new ATOM 0 HE2 TYR A 9 0.588 16.198 11.126 1.00 0.00 H new ATOM 0 HH TYR A 9 2.468 14.996 9.751 1.00 0.00 H new ATOM 144 N PRO A 10 -5.379 14.395 11.413 1.00 0.00 N ATOM 145 CA PRO A 10 -6.548 14.583 12.304 1.00 0.00 C ATOM 146 C PRO A 10 -6.978 16.057 12.402 1.00 0.00 C ATOM 147 O PRO A 10 -8.087 16.351 12.865 1.00 0.00 O ATOM 148 CB PRO A 10 -6.036 14.056 13.662 1.00 0.00 C ATOM 149 CG PRO A 10 -4.577 14.377 13.637 1.00 0.00 C ATOM 150 CD PRO A 10 -4.142 14.133 12.209 1.00 0.00 C ATOM 0 HA PRO A 10 -7.437 14.065 11.943 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -6.539 14.544 14.497 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -6.209 12.985 13.767 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -4.396 15.410 13.933 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -4.023 13.745 14.331 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -3.330 14.799 11.918 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -3.783 13.113 12.068 1.00 0.00 H new ATOM 158 N ILE A 11 -6.076 16.952 11.940 1.00 0.00 N ATOM 159 CA ILE A 11 -6.214 18.405 12.035 1.00 0.00 C ATOM 160 C ILE A 11 -6.478 18.815 13.511 1.00 0.00 C ATOM 161 O ILE A 11 -7.639 18.882 13.947 1.00 0.00 O ATOM 162 CB ILE A 11 -7.315 18.995 11.059 1.00 0.00 C ATOM 163 CG1 ILE A 11 -7.143 18.437 9.602 1.00 0.00 C ATOM 164 CG2 ILE A 11 -7.285 20.548 11.057 1.00 0.00 C ATOM 165 CD1 ILE A 11 -5.842 18.816 8.904 1.00 0.00 C ATOM 0 H ILE A 11 -5.212 16.666 11.480 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.271 18.843 11.706 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.288 18.673 11.430 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.213 17.350 9.637 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.977 18.790 8.995 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.050 20.926 10.379 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -7.478 20.917 12.064 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.305 20.893 10.726 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.825 18.380 7.905 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.773 19.901 8.828 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.997 18.438 9.479 1.00 0.00 H new ATOM 177 N PRO A 12 -5.397 19.085 14.322 1.00 0.00 N ATOM 178 CA PRO A 12 -5.537 19.484 15.755 1.00 0.00 C ATOM 179 C PRO A 12 -5.941 20.977 15.926 1.00 0.00 C ATOM 180 O PRO A 12 -5.685 21.597 16.965 1.00 0.00 O ATOM 181 CB PRO A 12 -4.123 19.190 16.320 1.00 0.00 C ATOM 182 CG PRO A 12 -3.206 19.457 15.161 1.00 0.00 C ATOM 183 CD PRO A 12 -3.961 19.002 13.921 1.00 0.00 C ATOM 0 HA PRO A 12 -6.333 18.948 16.272 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -3.891 19.833 17.169 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -4.038 18.160 16.667 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -2.953 20.515 15.098 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -2.269 18.911 15.270 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -3.748 19.643 13.066 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -3.684 17.987 13.635 1.00 0.00 H new ATOM 191 N LYS A 13 -6.582 21.525 14.879 1.00 0.00 N ATOM 192 CA LYS A 13 -7.071 22.904 14.807 1.00 0.00 C ATOM 193 C LYS A 13 -8.524 22.882 14.284 1.00 0.00 C ATOM 194 O LYS A 13 -8.943 21.917 13.633 1.00 0.00 O ATOM 195 CB LYS A 13 -6.165 23.731 13.837 1.00 0.00 C ATOM 196 CG LYS A 13 -4.653 23.853 14.225 1.00 0.00 C ATOM 197 CD LYS A 13 -4.292 25.133 15.037 1.00 0.00 C ATOM 198 CE LYS A 13 -4.919 25.196 16.441 1.00 0.00 C ATOM 199 NZ LYS A 13 -4.429 24.115 17.341 1.00 0.00 N ATOM 0 H LYS A 13 -6.779 20.995 14.030 1.00 0.00 H new ATOM 0 HA LYS A 13 -7.041 23.367 15.793 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.227 23.282 12.846 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.579 24.736 13.758 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -4.369 22.977 14.808 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -4.055 23.836 13.314 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -3.208 25.193 15.134 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -4.610 26.009 14.471 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -4.697 26.164 16.890 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -6.003 25.126 16.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -4.600 24.384 18.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -4.935 23.231 17.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -3.410 23.974 17.191 1.00 0.00 H new ATOM 213 N ARG A 14 -9.273 23.966 14.544 1.00 0.00 N ATOM 214 CA ARG A 14 -10.666 24.135 14.056 1.00 0.00 C ATOM 215 C ARG A 14 -10.694 24.474 12.542 1.00 0.00 C ATOM 216 O ARG A 14 -11.735 24.376 11.880 1.00 0.00 O ATOM 217 CB ARG A 14 -11.343 25.269 14.861 1.00 0.00 C ATOM 218 CG ARG A 14 -12.860 25.456 14.604 1.00 0.00 C ATOM 219 CD ARG A 14 -13.365 26.827 15.077 1.00 0.00 C ATOM 220 NE ARG A 14 -13.141 27.056 16.518 1.00 0.00 N ATOM 221 CZ ARG A 14 -13.689 28.050 17.236 1.00 0.00 C ATOM 222 NH1 ARG A 14 -14.527 28.918 16.675 1.00 0.00 N ATOM 223 NH2 ARG A 14 -13.393 28.173 18.522 1.00 0.00 N ATOM 0 H ARG A 14 -8.937 24.754 15.098 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.205 23.198 14.198 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.193 25.076 15.923 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.835 26.206 14.633 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -13.063 25.344 13.539 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -13.413 24.670 15.118 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -12.863 27.609 14.508 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -14.430 26.910 14.862 1.00 0.00 H new ATOM 0 HE ARG A 14 -12.522 26.409 17.006 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -14.762 28.834 15.686 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -14.935 29.667 17.234 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -12.751 27.514 18.963 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -13.807 28.927 19.071 1.00 0.00 H new ATOM 237 N PHE A 15 -9.517 24.823 12.006 1.00 0.00 N ATOM 238 CA PHE A 15 -9.350 25.338 10.633 1.00 0.00 C ATOM 239 C PHE A 15 -9.532 24.256 9.538 1.00 0.00 C ATOM 240 O PHE A 15 -9.292 24.532 8.363 1.00 0.00 O ATOM 241 CB PHE A 15 -7.960 25.980 10.496 1.00 0.00 C ATOM 242 CG PHE A 15 -7.652 27.105 11.486 1.00 0.00 C ATOM 243 CD1 PHE A 15 -8.390 28.283 11.478 1.00 0.00 C ATOM 244 CD2 PHE A 15 -6.615 26.989 12.412 1.00 0.00 C ATOM 245 CE1 PHE A 15 -8.104 29.302 12.360 1.00 0.00 C ATOM 246 CE2 PHE A 15 -6.331 28.010 13.293 1.00 0.00 C ATOM 247 CZ PHE A 15 -7.075 29.166 13.266 1.00 0.00 C ATOM 0 H PHE A 15 -8.638 24.756 12.519 1.00 0.00 H new ATOM 0 HA PHE A 15 -10.138 26.074 10.475 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.206 25.201 10.613 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -7.859 26.373 9.484 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -9.198 28.401 10.771 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -6.025 26.085 12.439 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -8.688 30.210 12.341 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -5.525 27.902 14.004 1.00 0.00 H new ATOM 0 HZ PHE A 15 -6.853 29.967 13.955 1.00 0.00 H new ATOM 257 N MET A 16 -9.953 23.031 9.925 1.00 0.00 N ATOM 258 CA MET A 16 -10.484 22.026 8.965 1.00 0.00 C ATOM 259 C MET A 16 -11.684 22.618 8.186 1.00 0.00 C ATOM 260 O MET A 16 -11.856 22.360 6.990 1.00 0.00 O ATOM 261 CB MET A 16 -10.862 20.702 9.706 1.00 0.00 C ATOM 262 CG MET A 16 -11.715 20.860 10.986 1.00 0.00 C ATOM 263 SD MET A 16 -13.409 21.410 10.671 1.00 0.00 S ATOM 264 CE MET A 16 -14.030 21.692 12.332 1.00 0.00 C ATOM 0 H MET A 16 -9.937 22.711 10.893 1.00 0.00 H new ATOM 0 HA MET A 16 -9.708 21.778 8.241 1.00 0.00 H new ATOM 0 HB2 MET A 16 -11.403 20.061 9.010 1.00 0.00 H new ATOM 0 HB3 MET A 16 -9.941 20.181 9.969 1.00 0.00 H new ATOM 0 HG2 MET A 16 -11.745 19.906 11.512 1.00 0.00 H new ATOM 0 HG3 MET A 16 -11.228 21.575 11.650 1.00 0.00 H new ATOM 0 HE1 MET A 16 -15.064 22.034 12.281 1.00 0.00 H new ATOM 0 HE2 MET A 16 -13.983 20.763 12.901 1.00 0.00 H new ATOM 0 HE3 MET A 16 -13.421 22.450 12.824 1.00 0.00 H new ATOM 274 N ASP A 17 -12.450 23.468 8.900 1.00 0.00 N ATOM 275 CA ASP A 17 -13.599 24.245 8.375 1.00 0.00 C ATOM 276 C ASP A 17 -13.256 24.995 7.076 1.00 0.00 C ATOM 277 O ASP A 17 -14.061 25.031 6.149 1.00 0.00 O ATOM 278 CB ASP A 17 -14.037 25.261 9.465 1.00 0.00 C ATOM 279 CG ASP A 17 -15.120 26.261 9.005 1.00 0.00 C ATOM 280 OD1 ASP A 17 -16.308 25.895 8.967 1.00 0.00 O ATOM 281 OD2 ASP A 17 -14.787 27.430 8.702 1.00 0.00 O ATOM 0 H ASP A 17 -12.283 23.640 9.891 1.00 0.00 H new ATOM 0 HA ASP A 17 -14.404 23.550 8.137 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -14.411 24.711 10.328 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.162 25.819 9.797 1.00 0.00 H new ATOM 286 N ARG A 18 -12.050 25.581 7.048 1.00 0.00 N ATOM 287 CA ARG A 18 -11.541 26.381 5.917 1.00 0.00 C ATOM 288 C ARG A 18 -11.588 25.613 4.586 1.00 0.00 C ATOM 289 O ARG A 18 -12.101 26.126 3.580 1.00 0.00 O ATOM 290 CB ARG A 18 -10.091 26.824 6.219 1.00 0.00 C ATOM 291 CG ARG A 18 -9.961 27.946 7.267 1.00 0.00 C ATOM 292 CD ARG A 18 -10.653 29.254 6.807 1.00 0.00 C ATOM 293 NE ARG A 18 -9.960 30.464 7.278 1.00 0.00 N ATOM 294 CZ ARG A 18 -8.807 30.920 6.767 1.00 0.00 C ATOM 295 NH1 ARG A 18 -8.149 30.209 5.859 1.00 0.00 N ATOM 296 NH2 ARG A 18 -8.305 32.075 7.181 1.00 0.00 N ATOM 0 H ARG A 18 -11.388 25.513 7.821 1.00 0.00 H new ATOM 0 HA ARG A 18 -12.189 27.251 5.807 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -9.526 25.958 6.563 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -9.628 27.158 5.291 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -10.400 27.615 8.208 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -8.906 28.142 7.459 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -10.702 29.270 5.718 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.680 29.264 7.172 1.00 0.00 H new ATOM 0 HE ARG A 18 -10.384 30.990 8.042 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -8.520 29.312 5.547 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -7.272 30.560 5.473 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -8.796 32.620 7.890 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -7.428 32.419 6.790 1.00 0.00 H new ATOM 310 N PHE A 19 -11.084 24.369 4.620 1.00 0.00 N ATOM 311 CA PHE A 19 -10.986 23.506 3.432 1.00 0.00 C ATOM 312 C PHE A 19 -12.391 23.120 2.931 1.00 0.00 C ATOM 313 O PHE A 19 -12.602 22.968 1.733 1.00 0.00 O ATOM 314 CB PHE A 19 -10.167 22.223 3.761 1.00 0.00 C ATOM 315 CG PHE A 19 -8.767 22.474 4.330 1.00 0.00 C ATOM 316 CD1 PHE A 19 -8.568 22.643 5.700 1.00 0.00 C ATOM 317 CD2 PHE A 19 -7.647 22.515 3.497 1.00 0.00 C ATOM 318 CE1 PHE A 19 -7.304 22.847 6.215 1.00 0.00 C ATOM 319 CE2 PHE A 19 -6.384 22.724 4.013 1.00 0.00 C ATOM 320 CZ PHE A 19 -6.212 22.889 5.373 1.00 0.00 C ATOM 0 H PHE A 19 -10.733 23.933 5.473 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.473 24.059 2.646 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.731 21.624 4.476 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -10.072 21.628 2.852 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -9.416 22.614 6.368 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -7.771 22.381 2.433 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.169 22.974 7.279 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.530 22.758 3.353 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.224 23.051 5.777 1.00 0.00 H new ATOM 330 N PHE A 20 -13.366 23.060 3.859 1.00 0.00 N ATOM 331 CA PHE A 20 -14.752 22.658 3.545 1.00 0.00 C ATOM 332 C PHE A 20 -15.624 23.879 3.186 1.00 0.00 C ATOM 333 O PHE A 20 -16.681 23.730 2.570 1.00 0.00 O ATOM 334 CB PHE A 20 -15.364 21.886 4.747 1.00 0.00 C ATOM 335 CG PHE A 20 -14.585 20.627 5.146 1.00 0.00 C ATOM 336 CD1 PHE A 20 -14.290 19.645 4.207 1.00 0.00 C ATOM 337 CD2 PHE A 20 -14.146 20.430 6.453 1.00 0.00 C ATOM 338 CE1 PHE A 20 -13.584 18.512 4.555 1.00 0.00 C ATOM 339 CE2 PHE A 20 -13.436 19.298 6.801 1.00 0.00 C ATOM 340 CZ PHE A 20 -13.157 18.339 5.849 1.00 0.00 C ATOM 0 H PHE A 20 -13.217 23.287 4.842 1.00 0.00 H new ATOM 0 HA PHE A 20 -14.728 22.003 2.674 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -15.416 22.555 5.606 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -16.387 21.604 4.500 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -14.620 19.772 3.186 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -14.364 21.174 7.205 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -13.367 17.761 3.810 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -13.099 19.163 7.818 1.00 0.00 H new ATOM 0 HZ PHE A 20 -12.603 17.453 6.121 1.00 0.00 H new ATOM 350 N LYS A 21 -15.173 25.087 3.584 1.00 0.00 N ATOM 351 CA LYS A 21 -15.913 26.343 3.358 1.00 0.00 C ATOM 352 C LYS A 21 -15.758 26.772 1.894 1.00 0.00 C ATOM 353 O LYS A 21 -16.741 26.868 1.154 1.00 0.00 O ATOM 354 CB LYS A 21 -15.402 27.437 4.357 1.00 0.00 C ATOM 355 CG LYS A 21 -15.991 28.880 4.198 1.00 0.00 C ATOM 356 CD LYS A 21 -15.130 29.804 3.284 1.00 0.00 C ATOM 357 CE LYS A 21 -15.624 31.265 3.251 1.00 0.00 C ATOM 358 NZ LYS A 21 -17.005 31.387 2.711 1.00 0.00 N ATOM 0 H LYS A 21 -14.286 25.217 4.071 1.00 0.00 H new ATOM 0 HA LYS A 21 -16.977 26.198 3.546 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -15.614 27.095 5.370 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -14.318 27.502 4.262 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.998 28.810 3.786 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.081 29.338 5.183 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -14.097 29.785 3.631 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -15.133 29.404 2.270 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -15.594 31.678 4.259 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -14.945 31.861 2.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.290 32.387 2.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -17.032 31.018 1.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.660 30.841 3.306 1.00 0.00 H new ATOM 372 N LYS A 22 -14.504 26.991 1.481 1.00 0.00 N ATOM 373 CA LYS A 22 -14.173 27.514 0.137 1.00 0.00 C ATOM 374 C LYS A 22 -13.914 26.368 -0.859 1.00 0.00 C ATOM 375 O LYS A 22 -13.791 26.606 -2.064 1.00 0.00 O ATOM 376 CB LYS A 22 -12.941 28.447 0.256 1.00 0.00 C ATOM 377 CG LYS A 22 -11.671 27.742 0.779 1.00 0.00 C ATOM 378 CD LYS A 22 -10.571 28.714 1.262 1.00 0.00 C ATOM 379 CE LYS A 22 -10.983 29.515 2.510 1.00 0.00 C ATOM 380 NZ LYS A 22 -9.867 30.344 3.028 1.00 0.00 N ATOM 0 H LYS A 22 -13.686 26.813 2.064 1.00 0.00 H new ATOM 0 HA LYS A 22 -15.019 28.081 -0.250 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.728 28.879 -0.722 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -13.187 29.274 0.923 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.946 27.082 1.602 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.264 27.112 -0.012 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.665 28.149 1.482 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -10.327 29.407 0.457 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -11.830 30.157 2.266 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.317 28.829 3.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -10.174 30.842 3.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -9.056 29.733 3.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -9.587 31.039 2.307 1.00 0.00 H new ATOM 394 N GLY A 23 -13.813 25.130 -0.332 1.00 0.00 N ATOM 395 CA GLY A 23 -13.632 23.926 -1.153 1.00 0.00 C ATOM 396 C GLY A 23 -12.217 23.760 -1.711 1.00 0.00 C ATOM 397 O GLY A 23 -11.952 22.798 -2.443 1.00 0.00 O ATOM 0 H GLY A 23 -13.855 24.943 0.670 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.880 23.050 -0.554 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.338 23.955 -1.983 1.00 0.00 H new ATOM 401 N LYS A 24 -11.308 24.686 -1.337 1.00 0.00 N ATOM 402 CA LYS A 24 -9.922 24.727 -1.833 1.00 0.00 C ATOM 403 C LYS A 24 -9.093 25.717 -0.984 1.00 0.00 C ATOM 404 O LYS A 24 -9.153 26.940 -1.165 1.00 0.00 O ATOM 405 CB LYS A 24 -9.884 25.094 -3.348 1.00 0.00 C ATOM 406 CG LYS A 24 -10.676 26.364 -3.723 1.00 0.00 C ATOM 407 CD LYS A 24 -10.643 26.657 -5.232 1.00 0.00 C ATOM 408 CE LYS A 24 -11.385 27.952 -5.587 1.00 0.00 C ATOM 409 NZ LYS A 24 -11.311 28.254 -7.036 1.00 0.00 N ATOM 0 H LYS A 24 -11.521 25.432 -0.675 1.00 0.00 H new ATOM 0 HA LYS A 24 -9.478 23.737 -1.733 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.845 25.228 -3.650 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.277 24.254 -3.921 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -11.711 26.250 -3.401 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -10.266 27.217 -3.182 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -9.607 26.731 -5.563 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -11.092 25.823 -5.772 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -12.429 27.865 -5.287 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -10.959 28.781 -5.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -11.825 29.136 -7.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -10.316 28.362 -7.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -11.741 27.475 -7.575 1.00 0.00 H new ATOM 423 N ASP A 25 -8.319 25.169 -0.051 1.00 0.00 N ATOM 424 CA ASP A 25 -7.554 25.946 0.949 1.00 0.00 C ATOM 425 C ASP A 25 -6.081 25.452 0.923 1.00 0.00 C ATOM 426 O ASP A 25 -5.716 24.737 0.016 1.00 0.00 O ATOM 427 CB ASP A 25 -8.279 25.763 2.309 1.00 0.00 C ATOM 428 CG ASP A 25 -7.777 26.655 3.447 1.00 0.00 C ATOM 429 OD1 ASP A 25 -8.224 27.828 3.564 1.00 0.00 O ATOM 430 OD2 ASP A 25 -6.936 26.188 4.229 1.00 0.00 O ATOM 0 H ASP A 25 -8.197 24.161 0.042 1.00 0.00 H new ATOM 0 HA ASP A 25 -7.514 27.016 0.745 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -9.342 25.954 2.163 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.181 24.722 2.616 1.00 0.00 H new ATOM 435 N VAL A 26 -5.222 25.864 1.862 1.00 0.00 N ATOM 436 CA VAL A 26 -3.778 25.534 1.858 1.00 0.00 C ATOM 437 C VAL A 26 -3.363 25.065 3.257 1.00 0.00 C ATOM 438 O VAL A 26 -3.458 25.828 4.225 1.00 0.00 O ATOM 439 CB VAL A 26 -2.883 26.770 1.410 1.00 0.00 C ATOM 440 CG1 VAL A 26 -1.364 26.486 1.567 1.00 0.00 C ATOM 441 CG2 VAL A 26 -3.207 27.201 -0.041 1.00 0.00 C ATOM 0 H VAL A 26 -5.504 26.440 2.655 1.00 0.00 H new ATOM 0 HA VAL A 26 -3.616 24.738 1.131 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.132 27.593 2.080 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.796 27.360 1.248 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -1.140 26.269 2.612 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -1.088 25.630 0.952 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.579 28.048 -0.318 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -3.015 26.370 -0.719 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.256 27.490 -0.109 1.00 0.00 H new ATOM 451 N PHE A 27 -2.911 23.802 3.350 1.00 0.00 N ATOM 452 CA PHE A 27 -2.400 23.220 4.595 1.00 0.00 C ATOM 453 C PHE A 27 -0.887 23.458 4.689 1.00 0.00 C ATOM 454 O PHE A 27 -0.114 22.837 3.958 1.00 0.00 O ATOM 455 CB PHE A 27 -2.717 21.698 4.668 1.00 0.00 C ATOM 456 CG PHE A 27 -2.278 21.040 5.975 1.00 0.00 C ATOM 457 CD1 PHE A 27 -3.039 21.188 7.131 1.00 0.00 C ATOM 458 CD2 PHE A 27 -1.099 20.293 6.052 1.00 0.00 C ATOM 459 CE1 PHE A 27 -2.642 20.612 8.317 1.00 0.00 C ATOM 460 CE2 PHE A 27 -0.704 19.717 7.238 1.00 0.00 C ATOM 461 CZ PHE A 27 -1.474 19.877 8.374 1.00 0.00 C ATOM 0 H PHE A 27 -2.891 23.158 2.559 1.00 0.00 H new ATOM 0 HA PHE A 27 -2.893 23.704 5.438 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -3.790 21.553 4.541 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -2.227 21.194 3.835 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -3.953 21.762 7.097 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.490 20.166 5.169 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -3.245 20.735 9.204 1.00 0.00 H new ATOM 0 HE2 PHE A 27 0.208 19.140 7.281 1.00 0.00 H new ATOM 0 HZ PHE A 27 -1.163 19.428 9.306 1.00 0.00 H new ATOM 471 N VAL A 28 -0.468 24.370 5.578 1.00 0.00 N ATOM 472 CA VAL A 28 0.957 24.618 5.843 1.00 0.00 C ATOM 473 C VAL A 28 1.461 23.660 6.938 1.00 0.00 C ATOM 474 O VAL A 28 0.735 23.323 7.888 1.00 0.00 O ATOM 475 CB VAL A 28 1.255 26.117 6.228 1.00 0.00 C ATOM 476 CG1 VAL A 28 0.977 27.047 5.025 1.00 0.00 C ATOM 477 CG2 VAL A 28 0.460 26.569 7.477 1.00 0.00 C ATOM 0 H VAL A 28 -1.100 24.951 6.129 1.00 0.00 H new ATOM 0 HA VAL A 28 1.498 24.426 4.916 1.00 0.00 H new ATOM 0 HB VAL A 28 2.312 26.186 6.486 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.187 28.079 5.307 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.616 26.761 4.189 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.068 26.957 4.730 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.698 27.608 7.703 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.608 26.476 7.282 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.730 25.942 8.327 1.00 0.00 H new ATOM 487 N LYS A 29 2.702 23.210 6.766 1.00 0.00 N ATOM 488 CA LYS A 29 3.353 22.233 7.635 1.00 0.00 C ATOM 489 C LYS A 29 4.784 22.721 7.935 1.00 0.00 C ATOM 490 O LYS A 29 5.498 23.067 7.000 1.00 0.00 O ATOM 491 CB LYS A 29 3.373 20.833 6.926 1.00 0.00 C ATOM 492 CG LYS A 29 3.890 19.639 7.788 1.00 0.00 C ATOM 493 CD LYS A 29 2.786 18.924 8.633 1.00 0.00 C ATOM 494 CE LYS A 29 2.120 19.813 9.702 1.00 0.00 C ATOM 495 NZ LYS A 29 1.121 19.080 10.510 1.00 0.00 N ATOM 0 H LYS A 29 3.297 23.523 5.999 1.00 0.00 H new ATOM 0 HA LYS A 29 2.808 22.130 8.573 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.362 20.603 6.591 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.995 20.908 6.034 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.357 18.907 7.129 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.666 20.003 8.461 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.016 18.551 7.958 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.227 18.057 9.124 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.887 20.219 10.361 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.637 20.660 9.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.256 19.652 10.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.895 18.177 10.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 1.509 18.896 11.457 1.00 0.00 H new ATOM 509 N PRO A 30 5.223 22.803 9.232 1.00 0.00 N ATOM 510 CA PRO A 30 6.641 23.087 9.585 1.00 0.00 C ATOM 511 C PRO A 30 7.544 21.842 9.382 1.00 0.00 C ATOM 512 O PRO A 30 8.197 21.387 10.325 1.00 0.00 O ATOM 513 CB PRO A 30 6.543 23.510 11.077 1.00 0.00 C ATOM 514 CG PRO A 30 5.358 22.754 11.602 1.00 0.00 C ATOM 515 CD PRO A 30 4.372 22.693 10.449 1.00 0.00 C ATOM 0 HA PRO A 30 7.100 23.851 8.958 1.00 0.00 H new ATOM 0 HB2 PRO A 30 7.451 23.254 11.623 1.00 0.00 H new ATOM 0 HB3 PRO A 30 6.404 24.586 11.177 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.644 21.754 11.927 1.00 0.00 H new ATOM 0 HG3 PRO A 30 4.922 23.258 12.465 1.00 0.00 H new ATOM 0 HD2 PRO A 30 3.808 21.761 10.457 1.00 0.00 H new ATOM 0 HD3 PRO A 30 3.647 23.505 10.502 1.00 0.00 H new ATOM 523 N ALA A 31 7.572 21.346 8.119 1.00 0.00 N ATOM 524 CA ALA A 31 8.269 20.108 7.685 1.00 0.00 C ATOM 525 C ALA A 31 8.157 18.946 8.705 1.00 0.00 C ATOM 526 O ALA A 31 8.983 18.817 9.614 1.00 0.00 O ATOM 527 CB ALA A 31 9.738 20.396 7.321 1.00 0.00 C ATOM 0 H ALA A 31 7.094 21.813 7.348 1.00 0.00 H new ATOM 0 HA ALA A 31 7.751 19.768 6.788 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.223 19.472 7.007 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.776 21.120 6.507 1.00 0.00 H new ATOM 0 HB3 ALA A 31 10.256 20.800 8.191 1.00 0.00 H new ATOM 533 N THR A 32 7.111 18.123 8.567 1.00 0.00 N ATOM 534 CA THR A 32 6.865 16.960 9.454 1.00 0.00 C ATOM 535 C THR A 32 6.657 15.693 8.605 1.00 0.00 C ATOM 536 O THR A 32 7.006 14.580 9.015 1.00 0.00 O ATOM 537 CB THR A 32 5.628 17.232 10.379 1.00 0.00 C ATOM 538 OG1 THR A 32 5.809 18.495 11.050 1.00 0.00 O ATOM 539 CG2 THR A 32 5.402 16.130 11.432 1.00 0.00 C ATOM 0 H THR A 32 6.406 18.237 7.839 1.00 0.00 H new ATOM 0 HA THR A 32 7.733 16.806 10.095 1.00 0.00 H new ATOM 0 HB THR A 32 4.747 17.246 9.737 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.038 18.672 11.629 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.531 16.379 12.039 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.234 15.177 10.931 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.281 16.053 12.073 1.00 0.00 H new ATOM 547 N VAL A 33 6.090 15.894 7.408 1.00 0.00 N ATOM 548 CA VAL A 33 5.959 14.845 6.386 1.00 0.00 C ATOM 549 C VAL A 33 7.293 14.660 5.630 1.00 0.00 C ATOM 550 O VAL A 33 8.070 15.612 5.469 1.00 0.00 O ATOM 551 CB VAL A 33 4.803 15.182 5.375 1.00 0.00 C ATOM 552 CG1 VAL A 33 3.414 15.122 6.063 1.00 0.00 C ATOM 553 CG2 VAL A 33 5.030 16.565 4.713 1.00 0.00 C ATOM 0 H VAL A 33 5.707 16.794 7.119 1.00 0.00 H new ATOM 0 HA VAL A 33 5.708 13.912 6.891 1.00 0.00 H new ATOM 0 HB VAL A 33 4.819 14.423 4.592 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.637 15.360 5.336 1.00 0.00 H new ATOM 0 HG12 VAL A 33 3.247 14.120 6.458 1.00 0.00 H new ATOM 0 HG13 VAL A 33 3.381 15.844 6.879 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.216 16.774 4.018 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.057 17.337 5.482 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.976 16.559 4.172 1.00 0.00 H new ATOM 563 N TRP A 34 7.541 13.421 5.195 1.00 0.00 N ATOM 564 CA TRP A 34 8.755 13.032 4.451 1.00 0.00 C ATOM 565 C TRP A 34 8.556 13.241 2.920 1.00 0.00 C ATOM 566 O TRP A 34 7.605 13.911 2.494 1.00 0.00 O ATOM 567 CB TRP A 34 9.100 11.554 4.778 1.00 0.00 C ATOM 568 CG TRP A 34 9.294 11.264 6.249 1.00 0.00 C ATOM 569 CD1 TRP A 34 8.331 10.889 7.147 1.00 0.00 C ATOM 570 CD2 TRP A 34 10.527 11.320 6.990 1.00 0.00 C ATOM 571 NE1 TRP A 34 8.886 10.711 8.385 1.00 0.00 N ATOM 572 CE2 TRP A 34 10.229 10.967 8.317 1.00 0.00 C ATOM 573 CE3 TRP A 34 11.851 11.634 6.656 1.00 0.00 C ATOM 574 CZ2 TRP A 34 11.202 10.921 9.314 1.00 0.00 C ATOM 575 CZ3 TRP A 34 12.816 11.584 7.645 1.00 0.00 C ATOM 576 CH2 TRP A 34 12.488 11.226 8.959 1.00 0.00 C ATOM 0 H TRP A 34 6.898 12.644 5.349 1.00 0.00 H new ATOM 0 HA TRP A 34 9.587 13.666 4.757 1.00 0.00 H new ATOM 0 HB2 TRP A 34 8.303 10.916 4.397 1.00 0.00 H new ATOM 0 HB3 TRP A 34 10.010 11.280 4.244 1.00 0.00 H new ATOM 0 HD1 TRP A 34 7.286 10.753 6.912 1.00 0.00 H new ATOM 0 HE1 TRP A 34 8.379 10.432 9.225 1.00 0.00 H new ATOM 0 HE3 TRP A 34 12.113 11.910 5.645 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 10.950 10.654 10.330 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 13.840 11.825 7.400 1.00 0.00 H new ATOM 0 HH2 TRP A 34 13.266 11.190 9.707 1.00 0.00 H new ATOM 587 N LYS A 35 9.444 12.626 2.103 1.00 0.00 N ATOM 588 CA LYS A 35 9.540 12.871 0.639 1.00 0.00 C ATOM 589 C LYS A 35 8.346 12.321 -0.185 1.00 0.00 C ATOM 590 O LYS A 35 8.321 12.499 -1.410 1.00 0.00 O ATOM 591 CB LYS A 35 10.860 12.263 0.094 1.00 0.00 C ATOM 592 CG LYS A 35 12.145 12.836 0.726 1.00 0.00 C ATOM 593 CD LYS A 35 13.430 12.185 0.157 1.00 0.00 C ATOM 594 CE LYS A 35 13.594 12.401 -1.359 1.00 0.00 C ATOM 595 NZ LYS A 35 13.666 13.841 -1.718 1.00 0.00 N ATOM 0 H LYS A 35 10.120 11.941 2.441 1.00 0.00 H new ATOM 0 HA LYS A 35 9.521 13.954 0.518 1.00 0.00 H new ATOM 0 HB2 LYS A 35 10.841 11.185 0.256 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.899 12.423 -0.984 1.00 0.00 H new ATOM 0 HG2 LYS A 35 12.181 13.912 0.555 1.00 0.00 H new ATOM 0 HG3 LYS A 35 12.113 12.686 1.805 1.00 0.00 H new ATOM 0 HD2 LYS A 35 14.298 12.596 0.673 1.00 0.00 H new ATOM 0 HD3 LYS A 35 13.412 11.115 0.366 1.00 0.00 H new ATOM 0 HE2 LYS A 35 14.499 11.898 -1.700 1.00 0.00 H new ATOM 0 HE3 LYS A 35 12.757 11.940 -1.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 13.844 13.936 -2.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.766 14.304 -1.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 14.439 14.293 -1.188 1.00 0.00 H new ATOM 609 N GLU A 36 7.379 11.650 0.466 1.00 0.00 N ATOM 610 CA GLU A 36 6.160 11.133 -0.212 1.00 0.00 C ATOM 611 C GLU A 36 5.317 12.292 -0.779 1.00 0.00 C ATOM 612 O GLU A 36 4.648 12.133 -1.809 1.00 0.00 O ATOM 613 CB GLU A 36 5.294 10.282 0.760 1.00 0.00 C ATOM 614 CG GLU A 36 5.851 8.883 1.118 1.00 0.00 C ATOM 615 CD GLU A 36 7.264 8.894 1.723 1.00 0.00 C ATOM 616 OE1 GLU A 36 7.444 9.455 2.824 1.00 0.00 O ATOM 617 OE2 GLU A 36 8.206 8.363 1.095 1.00 0.00 O ATOM 0 H GLU A 36 7.412 11.449 1.465 1.00 0.00 H new ATOM 0 HA GLU A 36 6.488 10.496 -1.034 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.161 10.845 1.684 1.00 0.00 H new ATOM 0 HB3 GLU A 36 4.306 10.155 0.318 1.00 0.00 H new ATOM 0 HG2 GLU A 36 5.171 8.405 1.824 1.00 0.00 H new ATOM 0 HG3 GLU A 36 5.860 8.268 0.218 1.00 0.00 H new ATOM 624 N LEU A 37 5.367 13.452 -0.096 1.00 0.00 N ATOM 625 CA LEU A 37 4.598 14.644 -0.480 1.00 0.00 C ATOM 626 C LEU A 37 5.053 15.198 -1.845 1.00 0.00 C ATOM 627 O LEU A 37 6.208 15.599 -2.017 1.00 0.00 O ATOM 628 CB LEU A 37 4.661 15.747 0.635 1.00 0.00 C ATOM 629 CG LEU A 37 3.339 15.970 1.429 1.00 0.00 C ATOM 630 CD1 LEU A 37 2.219 16.479 0.504 1.00 0.00 C ATOM 631 CD2 LEU A 37 2.912 14.690 2.175 1.00 0.00 C ATOM 0 H LEU A 37 5.942 13.586 0.736 1.00 0.00 H new ATOM 0 HA LEU A 37 3.557 14.340 -0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.448 15.482 1.341 1.00 0.00 H new ATOM 0 HB3 LEU A 37 4.951 16.691 0.173 1.00 0.00 H new ATOM 0 HG LEU A 37 3.526 16.739 2.179 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.308 16.626 1.083 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.520 17.425 0.055 1.00 0.00 H new ATOM 0 HD13 LEU A 37 2.035 15.746 -0.282 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.987 14.878 2.719 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.754 13.886 1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.694 14.400 2.877 1.00 0.00 H new ATOM 643 N LYS A 38 4.119 15.186 -2.808 1.00 0.00 N ATOM 644 CA LYS A 38 4.305 15.786 -4.131 1.00 0.00 C ATOM 645 C LYS A 38 2.963 16.396 -4.594 1.00 0.00 C ATOM 646 O LYS A 38 1.897 15.871 -4.226 1.00 0.00 O ATOM 647 CB LYS A 38 4.862 14.718 -5.136 1.00 0.00 C ATOM 648 CG LYS A 38 3.886 13.594 -5.603 1.00 0.00 C ATOM 649 CD LYS A 38 3.077 13.960 -6.880 1.00 0.00 C ATOM 650 CE LYS A 38 3.971 14.253 -8.103 1.00 0.00 C ATOM 651 NZ LYS A 38 3.172 14.558 -9.322 1.00 0.00 N ATOM 0 H LYS A 38 3.204 14.753 -2.685 1.00 0.00 H new ATOM 0 HA LYS A 38 5.043 16.587 -4.088 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.219 15.243 -6.022 1.00 0.00 H new ATOM 0 HB3 LYS A 38 5.728 14.242 -4.676 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.457 12.685 -5.793 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.190 13.370 -4.794 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.400 13.140 -7.121 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.459 14.833 -6.673 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.626 15.095 -7.879 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.613 13.393 -8.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.813 14.782 -10.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.591 13.732 -9.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.554 15.373 -9.137 1.00 0.00 H new ATOM 665 N PRO A 39 2.981 17.493 -5.419 1.00 0.00 N ATOM 666 CA PRO A 39 1.745 18.101 -5.963 1.00 0.00 C ATOM 667 C PRO A 39 1.048 17.144 -6.966 1.00 0.00 C ATOM 668 O PRO A 39 1.513 16.964 -8.100 1.00 0.00 O ATOM 669 CB PRO A 39 2.247 19.405 -6.640 1.00 0.00 C ATOM 670 CG PRO A 39 3.685 19.138 -6.973 1.00 0.00 C ATOM 671 CD PRO A 39 4.198 18.215 -5.885 1.00 0.00 C ATOM 0 HA PRO A 39 0.991 18.301 -5.202 1.00 0.00 H new ATOM 0 HB2 PRO A 39 1.670 19.632 -7.536 1.00 0.00 H new ATOM 0 HB3 PRO A 39 2.148 20.260 -5.972 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.779 18.675 -7.955 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.258 20.065 -7.002 1.00 0.00 H new ATOM 0 HD2 PRO A 39 4.949 17.524 -6.269 1.00 0.00 H new ATOM 0 HD3 PRO A 39 4.665 18.775 -5.074 1.00 0.00 H new ATOM 679 N GLY A 40 -0.018 16.478 -6.491 1.00 0.00 N ATOM 680 CA GLY A 40 -0.785 15.519 -7.298 1.00 0.00 C ATOM 681 C GLY A 40 -1.336 14.344 -6.488 1.00 0.00 C ATOM 682 O GLY A 40 -1.977 13.449 -7.054 1.00 0.00 O ATOM 0 H GLY A 40 -0.370 16.590 -5.540 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.614 16.040 -7.777 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.148 15.134 -8.094 1.00 0.00 H new ATOM 686 N MET A 41 -1.075 14.328 -5.163 1.00 0.00 N ATOM 687 CA MET A 41 -1.599 13.282 -4.253 1.00 0.00 C ATOM 688 C MET A 41 -2.976 13.688 -3.677 1.00 0.00 C ATOM 689 O MET A 41 -3.600 14.636 -4.154 1.00 0.00 O ATOM 690 CB MET A 41 -0.592 12.998 -3.105 1.00 0.00 C ATOM 691 CG MET A 41 0.764 12.433 -3.552 1.00 0.00 C ATOM 692 SD MET A 41 1.595 11.499 -2.246 1.00 0.00 S ATOM 693 CE MET A 41 1.474 12.599 -0.831 1.00 0.00 C ATOM 0 H MET A 41 -0.502 15.031 -4.696 1.00 0.00 H new ATOM 0 HA MET A 41 -1.729 12.368 -4.832 1.00 0.00 H new ATOM 0 HB2 MET A 41 -0.419 13.924 -2.557 1.00 0.00 H new ATOM 0 HB3 MET A 41 -1.049 12.296 -2.408 1.00 0.00 H new ATOM 0 HG2 MET A 41 0.616 11.787 -4.417 1.00 0.00 H new ATOM 0 HG3 MET A 41 1.407 13.253 -3.872 1.00 0.00 H new ATOM 0 HE1 MET A 41 2.339 12.456 -0.184 1.00 0.00 H new ATOM 0 HE2 MET A 41 1.446 13.633 -1.175 1.00 0.00 H new ATOM 0 HE3 MET A 41 0.564 12.377 -0.274 1.00 0.00 H new ATOM 703 N LYS A 42 -3.466 12.927 -2.673 1.00 0.00 N ATOM 704 CA LYS A 42 -4.702 13.258 -1.923 1.00 0.00 C ATOM 705 C LYS A 42 -4.333 13.726 -0.511 1.00 0.00 C ATOM 706 O LYS A 42 -3.258 13.404 -0.009 1.00 0.00 O ATOM 707 CB LYS A 42 -5.666 12.029 -1.787 1.00 0.00 C ATOM 708 CG LYS A 42 -5.499 10.915 -2.835 1.00 0.00 C ATOM 709 CD LYS A 42 -6.580 9.810 -2.699 1.00 0.00 C ATOM 710 CE LYS A 42 -8.016 10.372 -2.783 1.00 0.00 C ATOM 711 NZ LYS A 42 -9.064 9.329 -2.630 1.00 0.00 N ATOM 0 H LYS A 42 -3.017 12.067 -2.359 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.214 14.040 -2.483 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -5.527 11.592 -0.798 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -6.693 12.392 -1.834 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -5.550 11.349 -3.834 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -4.510 10.468 -2.732 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -6.437 9.068 -3.485 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -6.450 9.295 -1.747 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -8.149 11.128 -2.009 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -8.148 10.872 -3.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -9.864 9.718 -2.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -9.393 9.027 -3.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -8.669 8.512 -2.122 1.00 0.00 H new ATOM 725 N PHE A 43 -5.251 14.436 0.144 1.00 0.00 N ATOM 726 CA PHE A 43 -5.127 14.759 1.578 1.00 0.00 C ATOM 727 C PHE A 43 -6.475 14.503 2.237 1.00 0.00 C ATOM 728 O PHE A 43 -7.414 15.276 2.048 1.00 0.00 O ATOM 729 CB PHE A 43 -4.683 16.221 1.774 1.00 0.00 C ATOM 730 CG PHE A 43 -4.206 16.608 3.177 1.00 0.00 C ATOM 731 CD1 PHE A 43 -5.103 16.745 4.236 1.00 0.00 C ATOM 732 CD2 PHE A 43 -2.858 16.858 3.430 1.00 0.00 C ATOM 733 CE1 PHE A 43 -4.672 17.113 5.493 1.00 0.00 C ATOM 734 CE2 PHE A 43 -2.430 17.228 4.685 1.00 0.00 C ATOM 735 CZ PHE A 43 -3.337 17.354 5.715 1.00 0.00 C ATOM 0 H PHE A 43 -6.096 14.804 -0.293 1.00 0.00 H new ATOM 0 HA PHE A 43 -4.365 14.131 2.039 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -3.878 16.430 1.070 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -5.517 16.870 1.506 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -6.154 16.560 4.069 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -2.139 16.760 2.630 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -5.382 17.212 6.301 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -1.382 17.420 4.863 1.00 0.00 H new ATOM 0 HZ PHE A 43 -2.998 17.643 6.699 1.00 0.00 H new ATOM 745 N VAL A 44 -6.571 13.406 2.989 1.00 0.00 N ATOM 746 CA VAL A 44 -7.813 13.008 3.645 1.00 0.00 C ATOM 747 C VAL A 44 -7.878 13.617 5.052 1.00 0.00 C ATOM 748 O VAL A 44 -6.983 13.411 5.881 1.00 0.00 O ATOM 749 CB VAL A 44 -7.959 11.449 3.666 1.00 0.00 C ATOM 750 CG1 VAL A 44 -9.284 11.014 4.336 1.00 0.00 C ATOM 751 CG2 VAL A 44 -7.863 10.893 2.223 1.00 0.00 C ATOM 0 H VAL A 44 -5.791 12.771 3.159 1.00 0.00 H new ATOM 0 HA VAL A 44 -8.659 13.394 3.076 1.00 0.00 H new ATOM 0 HB VAL A 44 -7.144 11.036 4.261 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.353 9.926 4.334 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.308 11.377 5.364 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -10.125 11.432 3.784 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.965 9.808 2.244 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.660 11.321 1.614 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -6.897 11.158 1.794 1.00 0.00 H new ATOM 761 N PHE A 45 -8.927 14.410 5.286 1.00 0.00 N ATOM 762 CA PHE A 45 -9.161 15.075 6.563 1.00 0.00 C ATOM 763 C PHE A 45 -9.849 14.104 7.524 1.00 0.00 C ATOM 764 O PHE A 45 -11.024 13.768 7.352 1.00 0.00 O ATOM 765 CB PHE A 45 -10.007 16.356 6.357 1.00 0.00 C ATOM 766 CG PHE A 45 -9.343 17.345 5.413 1.00 0.00 C ATOM 767 CD1 PHE A 45 -8.320 18.175 5.859 1.00 0.00 C ATOM 768 CD2 PHE A 45 -9.712 17.417 4.074 1.00 0.00 C ATOM 769 CE1 PHE A 45 -7.689 19.041 4.996 1.00 0.00 C ATOM 770 CE2 PHE A 45 -9.084 18.287 3.219 1.00 0.00 C ATOM 771 CZ PHE A 45 -8.071 19.096 3.673 1.00 0.00 C ATOM 0 H PHE A 45 -9.642 14.608 4.586 1.00 0.00 H new ATOM 0 HA PHE A 45 -8.207 15.376 6.997 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -10.985 16.082 5.962 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -10.175 16.836 7.321 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -8.017 18.139 6.895 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -10.502 16.781 3.703 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -6.894 19.678 5.355 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -9.388 18.336 2.184 1.00 0.00 H new ATOM 0 HZ PHE A 45 -7.575 19.774 2.994 1.00 0.00 H new ATOM 781 N TYR A 46 -9.067 13.609 8.478 1.00 0.00 N ATOM 782 CA TYR A 46 -9.552 12.848 9.622 1.00 0.00 C ATOM 783 C TYR A 46 -10.090 13.864 10.638 1.00 0.00 C ATOM 784 O TYR A 46 -9.409 14.838 10.941 1.00 0.00 O ATOM 785 CB TYR A 46 -8.362 12.021 10.192 1.00 0.00 C ATOM 786 CG TYR A 46 -8.661 11.062 11.359 1.00 0.00 C ATOM 787 CD1 TYR A 46 -8.615 11.488 12.689 1.00 0.00 C ATOM 788 CD2 TYR A 46 -8.937 9.715 11.128 1.00 0.00 C ATOM 789 CE1 TYR A 46 -8.833 10.611 13.733 1.00 0.00 C ATOM 790 CE2 TYR A 46 -9.161 8.840 12.165 1.00 0.00 C ATOM 791 CZ TYR A 46 -9.107 9.288 13.464 1.00 0.00 C ATOM 792 OH TYR A 46 -9.320 8.405 14.499 1.00 0.00 O ATOM 0 H TYR A 46 -8.054 13.729 8.476 1.00 0.00 H new ATOM 0 HA TYR A 46 -10.349 12.151 9.363 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -7.936 11.437 9.376 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -7.592 12.720 10.519 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -8.405 12.525 12.905 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -8.976 9.351 10.112 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -8.789 10.960 14.754 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -9.379 7.802 11.959 1.00 0.00 H new ATOM 0 HH TYR A 46 -9.501 7.513 14.136 1.00 0.00 H new ATOM 896 N PHE A 54 -12.983 9.932 9.467 1.00 0.00 N ATOM 897 CA PHE A 54 -12.697 10.889 8.389 1.00 0.00 C ATOM 898 C PHE A 54 -13.923 11.782 8.095 1.00 0.00 C ATOM 899 O PHE A 54 -15.013 11.276 7.802 1.00 0.00 O ATOM 900 CB PHE A 54 -12.278 10.116 7.119 1.00 0.00 C ATOM 901 CG PHE A 54 -11.056 9.206 7.283 1.00 0.00 C ATOM 902 CD1 PHE A 54 -9.791 9.743 7.503 1.00 0.00 C ATOM 903 CD2 PHE A 54 -11.167 7.818 7.189 1.00 0.00 C ATOM 904 CE1 PHE A 54 -8.680 8.928 7.622 1.00 0.00 C ATOM 905 CE2 PHE A 54 -10.055 7.007 7.312 1.00 0.00 C ATOM 906 CZ PHE A 54 -8.811 7.562 7.528 1.00 0.00 C ATOM 0 HA PHE A 54 -11.883 11.541 8.706 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -13.121 9.510 6.787 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -12.072 10.835 6.327 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -9.675 10.814 7.582 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.135 7.372 7.018 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -7.707 9.365 7.789 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -10.160 5.935 7.239 1.00 0.00 H new ATOM 0 HZ PHE A 54 -7.943 6.926 7.623 1.00 0.00 H new ATOM 916 N VAL A 55 -13.719 13.112 8.170 1.00 0.00 N ATOM 917 CA VAL A 55 -14.755 14.126 7.865 1.00 0.00 C ATOM 918 C VAL A 55 -14.812 14.416 6.349 1.00 0.00 C ATOM 919 O VAL A 55 -15.894 14.666 5.796 1.00 0.00 O ATOM 920 CB VAL A 55 -14.517 15.453 8.701 1.00 0.00 C ATOM 921 CG1 VAL A 55 -13.055 15.952 8.605 1.00 0.00 C ATOM 922 CG2 VAL A 55 -15.502 16.585 8.325 1.00 0.00 C ATOM 0 H VAL A 55 -12.825 13.519 8.446 1.00 0.00 H new ATOM 0 HA VAL A 55 -15.723 13.721 8.161 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.714 15.182 9.738 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.942 16.862 9.194 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.383 15.185 8.990 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.809 16.160 7.564 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.291 17.467 8.930 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.387 16.832 7.270 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.524 16.255 8.510 1.00 0.00 H new ATOM 932 N GLY A 56 -13.647 14.353 5.683 1.00 0.00 N ATOM 933 CA GLY A 56 -13.559 14.616 4.244 1.00 0.00 C ATOM 934 C GLY A 56 -12.215 14.223 3.656 1.00 0.00 C ATOM 935 O GLY A 56 -11.427 13.535 4.305 1.00 0.00 O ATOM 0 H GLY A 56 -12.755 14.122 6.121 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -14.349 14.069 3.730 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -13.735 15.676 4.061 1.00 0.00 H new ATOM 939 N GLU A 57 -11.974 14.647 2.411 1.00 0.00 N ATOM 940 CA GLU A 57 -10.695 14.474 1.708 1.00 0.00 C ATOM 941 C GLU A 57 -10.482 15.659 0.769 1.00 0.00 C ATOM 942 O GLU A 57 -11.322 16.553 0.711 1.00 0.00 O ATOM 943 CB GLU A 57 -10.618 13.145 0.904 1.00 0.00 C ATOM 944 CG GLU A 57 -11.599 13.035 -0.288 1.00 0.00 C ATOM 945 CD GLU A 57 -11.191 11.961 -1.316 1.00 0.00 C ATOM 946 OE1 GLU A 57 -11.282 10.750 -1.009 1.00 0.00 O ATOM 947 OE2 GLU A 57 -10.741 12.327 -2.423 1.00 0.00 O ATOM 0 H GLU A 57 -12.676 15.130 1.851 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.909 14.429 2.462 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -9.602 13.025 0.529 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -10.806 12.316 1.586 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.595 12.806 0.090 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -11.662 14.001 -0.788 1.00 0.00 H new ATOM 954 N ALA A 58 -9.347 15.657 0.058 1.00 0.00 N ATOM 955 CA ALA A 58 -8.998 16.693 -0.920 1.00 0.00 C ATOM 956 C ALA A 58 -7.862 16.218 -1.827 1.00 0.00 C ATOM 957 O ALA A 58 -7.471 15.045 -1.798 1.00 0.00 O ATOM 958 CB ALA A 58 -8.621 17.989 -0.206 1.00 0.00 C ATOM 0 H ALA A 58 -8.639 14.928 0.147 1.00 0.00 H new ATOM 0 HA ALA A 58 -9.868 16.888 -1.547 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -8.364 18.749 -0.944 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.465 18.334 0.392 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.765 17.810 0.444 1.00 0.00 H new ATOM 964 N ARG A 59 -7.355 17.146 -2.651 1.00 0.00 N ATOM 965 CA ARG A 59 -6.312 16.891 -3.645 1.00 0.00 C ATOM 966 C ARG A 59 -5.129 17.841 -3.405 1.00 0.00 C ATOM 967 O ARG A 59 -5.289 19.067 -3.438 1.00 0.00 O ATOM 968 CB ARG A 59 -6.910 17.104 -5.055 1.00 0.00 C ATOM 969 CG ARG A 59 -8.081 16.148 -5.390 1.00 0.00 C ATOM 970 CD ARG A 59 -7.606 14.704 -5.617 1.00 0.00 C ATOM 971 NE ARG A 59 -6.596 14.643 -6.694 1.00 0.00 N ATOM 972 CZ ARG A 59 -5.559 13.801 -6.751 1.00 0.00 C ATOM 973 NH1 ARG A 59 -5.398 12.847 -5.845 1.00 0.00 N ATOM 974 NH2 ARG A 59 -4.696 13.910 -7.741 1.00 0.00 N ATOM 0 H ARG A 59 -7.669 18.117 -2.642 1.00 0.00 H new ATOM 0 HA ARG A 59 -5.949 15.867 -3.561 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -7.258 18.133 -5.140 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -6.122 16.972 -5.797 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -8.806 16.166 -4.577 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -8.594 16.504 -6.283 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -7.183 14.307 -4.694 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -8.457 14.074 -5.875 1.00 0.00 H new ATOM 0 HE ARG A 59 -6.699 15.304 -7.464 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -6.072 12.745 -5.086 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -4.600 12.215 -5.906 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -4.824 14.630 -8.452 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.900 13.274 -7.796 1.00 0.00 H new ATOM 988 N ILE A 60 -3.964 17.251 -3.126 1.00 0.00 N ATOM 989 CA ILE A 60 -2.704 17.972 -2.914 1.00 0.00 C ATOM 990 C ILE A 60 -2.174 18.540 -4.237 1.00 0.00 C ATOM 991 O ILE A 60 -2.107 17.840 -5.248 1.00 0.00 O ATOM 992 CB ILE A 60 -1.638 17.031 -2.231 1.00 0.00 C ATOM 993 CG1 ILE A 60 -1.980 16.834 -0.717 1.00 0.00 C ATOM 994 CG2 ILE A 60 -0.177 17.533 -2.413 1.00 0.00 C ATOM 995 CD1 ILE A 60 -1.221 15.711 -0.043 1.00 0.00 C ATOM 0 H ILE A 60 -3.867 16.239 -3.039 1.00 0.00 H new ATOM 0 HA ILE A 60 -2.894 18.810 -2.244 1.00 0.00 H new ATOM 0 HB ILE A 60 -1.692 16.068 -2.738 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.774 17.764 -0.187 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -3.049 16.642 -0.621 1.00 0.00 H new ATOM 0 HG21 ILE A 60 0.509 16.843 -1.921 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.060 17.584 -3.476 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.075 18.524 -1.970 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -1.520 15.646 1.003 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -1.445 14.769 -0.543 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -0.151 15.908 -0.103 1.00 0.00 H new ATOM 1007 N LYS A 61 -1.810 19.820 -4.176 1.00 0.00 N ATOM 1008 CA LYS A 61 -1.305 20.633 -5.291 1.00 0.00 C ATOM 1009 C LYS A 61 -0.127 21.485 -4.759 1.00 0.00 C ATOM 1010 O LYS A 61 0.369 21.193 -3.655 1.00 0.00 O ATOM 1011 CB LYS A 61 -2.464 21.507 -5.864 1.00 0.00 C ATOM 1012 CG LYS A 61 -3.619 20.710 -6.497 1.00 0.00 C ATOM 1013 CD LYS A 61 -3.195 19.858 -7.717 1.00 0.00 C ATOM 1014 CE LYS A 61 -2.765 20.711 -8.916 1.00 0.00 C ATOM 1015 NZ LYS A 61 -3.861 21.594 -9.391 1.00 0.00 N ATOM 0 H LYS A 61 -1.860 20.349 -3.305 1.00 0.00 H new ATOM 0 HA LYS A 61 -0.942 20.012 -6.110 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.865 22.126 -5.061 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -2.054 22.184 -6.614 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -4.053 20.055 -5.741 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.401 21.404 -6.805 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -2.373 19.203 -7.429 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.025 19.216 -8.012 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -1.904 21.319 -8.638 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -2.446 20.059 -9.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -4.040 21.414 -10.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -4.725 21.399 -8.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -3.587 22.589 -9.261 1.00 0.00 H new ATOM 1029 N ARG A 62 0.249 22.565 -5.505 1.00 0.00 N ATOM 1030 CA ARG A 62 1.571 23.255 -5.402 1.00 0.00 C ATOM 1031 C ARG A 62 2.094 23.377 -3.942 1.00 0.00 C ATOM 1032 O ARG A 62 1.435 23.955 -3.067 1.00 0.00 O ATOM 1033 CB ARG A 62 1.515 24.651 -6.114 1.00 0.00 C ATOM 1034 CG ARG A 62 0.896 25.819 -5.300 1.00 0.00 C ATOM 1035 CD ARG A 62 0.683 27.101 -6.125 1.00 0.00 C ATOM 1036 NE ARG A 62 -0.487 27.001 -7.014 1.00 0.00 N ATOM 1037 CZ ARG A 62 -0.985 27.993 -7.763 1.00 0.00 C ATOM 1038 NH1 ARG A 62 -0.341 29.146 -7.896 1.00 0.00 N ATOM 1039 NH2 ARG A 62 -2.136 27.814 -8.391 1.00 0.00 N ATOM 0 H ARG A 62 -0.365 22.986 -6.203 1.00 0.00 H new ATOM 0 HA ARG A 62 2.296 22.625 -5.918 1.00 0.00 H new ATOM 0 HB2 ARG A 62 2.530 24.931 -6.395 1.00 0.00 H new ATOM 0 HB3 ARG A 62 0.947 24.540 -7.038 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -0.061 25.498 -4.890 1.00 0.00 H new ATOM 0 HG3 ARG A 62 1.545 26.045 -4.454 1.00 0.00 H new ATOM 0 HD2 ARG A 62 0.554 27.948 -5.451 1.00 0.00 H new ATOM 0 HD3 ARG A 62 1.574 27.300 -6.720 1.00 0.00 H new ATOM 0 HE ARG A 62 -0.959 26.098 -7.063 1.00 0.00 H new ATOM 0 HH11 ARG A 62 0.551 29.289 -7.423 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -0.738 29.889 -8.471 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -2.633 26.928 -8.301 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -2.526 28.562 -8.965 1.00 0.00 H new ATOM 1053 N VAL A 63 3.232 22.715 -3.671 1.00 0.00 N ATOM 1054 CA VAL A 63 3.883 22.764 -2.359 1.00 0.00 C ATOM 1055 C VAL A 63 4.998 23.843 -2.385 1.00 0.00 C ATOM 1056 O VAL A 63 6.036 23.693 -3.048 1.00 0.00 O ATOM 1057 CB VAL A 63 4.400 21.336 -1.893 1.00 0.00 C ATOM 1058 CG1 VAL A 63 3.209 20.352 -1.733 1.00 0.00 C ATOM 1059 CG2 VAL A 63 5.473 20.736 -2.847 1.00 0.00 C ATOM 0 H VAL A 63 3.721 22.135 -4.353 1.00 0.00 H new ATOM 0 HA VAL A 63 3.152 23.053 -1.604 1.00 0.00 H new ATOM 0 HB VAL A 63 4.884 21.481 -0.927 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.582 19.379 -1.413 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.516 20.738 -0.986 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.693 20.247 -2.687 1.00 0.00 H new ATOM 0 HG21 VAL A 63 5.786 19.761 -2.475 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.051 20.625 -3.846 1.00 0.00 H new ATOM 0 HG23 VAL A 63 6.335 21.402 -2.890 1.00 0.00 H new ATOM 1069 N VAL A 64 4.723 24.978 -1.718 1.00 0.00 N ATOM 1070 CA VAL A 64 5.639 26.126 -1.666 1.00 0.00 C ATOM 1071 C VAL A 64 6.568 25.959 -0.456 1.00 0.00 C ATOM 1072 O VAL A 64 6.140 26.082 0.691 1.00 0.00 O ATOM 1073 CB VAL A 64 4.842 27.483 -1.564 1.00 0.00 C ATOM 1074 CG1 VAL A 64 5.793 28.708 -1.481 1.00 0.00 C ATOM 1075 CG2 VAL A 64 3.837 27.629 -2.737 1.00 0.00 C ATOM 0 H VAL A 64 3.857 25.123 -1.199 1.00 0.00 H new ATOM 0 HA VAL A 64 6.226 26.159 -2.584 1.00 0.00 H new ATOM 0 HB VAL A 64 4.273 27.456 -0.635 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.204 29.622 -1.412 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.427 28.617 -0.599 1.00 0.00 H new ATOM 0 HG13 VAL A 64 6.417 28.745 -2.374 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.301 28.573 -2.642 1.00 0.00 H new ATOM 0 HG22 VAL A 64 4.377 27.612 -3.683 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.125 26.804 -2.711 1.00 0.00 H new ATOM 1085 N LEU A 65 7.836 25.649 -0.733 1.00 0.00 N ATOM 1086 CA LEU A 65 8.857 25.422 0.295 1.00 0.00 C ATOM 1087 C LEU A 65 9.541 26.756 0.639 1.00 0.00 C ATOM 1088 O LEU A 65 10.125 27.395 -0.245 1.00 0.00 O ATOM 1089 CB LEU A 65 9.910 24.396 -0.225 1.00 0.00 C ATOM 1090 CG LEU A 65 9.343 23.063 -0.827 1.00 0.00 C ATOM 1091 CD1 LEU A 65 10.475 22.163 -1.379 1.00 0.00 C ATOM 1092 CD2 LEU A 65 8.473 22.304 0.201 1.00 0.00 C ATOM 0 H LEU A 65 8.187 25.547 -1.685 1.00 0.00 H new ATOM 0 HA LEU A 65 8.388 25.019 1.193 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.517 24.885 -0.987 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.577 24.143 0.599 1.00 0.00 H new ATOM 0 HG LEU A 65 8.701 23.333 -1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.046 21.248 -1.788 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.012 22.695 -2.164 1.00 0.00 H new ATOM 0 HD13 LEU A 65 11.165 21.911 -0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.096 21.385 -0.249 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.075 22.059 1.076 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.634 22.932 0.501 1.00 0.00 H new ATOM 1104 N SER A 66 9.457 27.166 1.910 1.00 0.00 N ATOM 1105 CA SER A 66 10.085 28.399 2.410 1.00 0.00 C ATOM 1106 C SER A 66 10.425 28.251 3.899 1.00 0.00 C ATOM 1107 O SER A 66 9.605 27.780 4.681 1.00 0.00 O ATOM 1108 CB SER A 66 9.147 29.611 2.198 1.00 0.00 C ATOM 1109 OG SER A 66 9.745 30.812 2.659 1.00 0.00 O ATOM 0 H SER A 66 8.948 26.649 2.627 1.00 0.00 H new ATOM 0 HA SER A 66 11.005 28.570 1.851 1.00 0.00 H new ATOM 0 HB2 SER A 66 8.905 29.706 1.139 1.00 0.00 H new ATOM 0 HB3 SER A 66 8.208 29.444 2.726 1.00 0.00 H new ATOM 0 HG SER A 66 9.234 31.161 3.419 1.00 0.00 H new ATOM 1115 N GLU A 67 11.636 28.691 4.275 1.00 0.00 N ATOM 1116 CA GLU A 67 12.106 28.717 5.677 1.00 0.00 C ATOM 1117 C GLU A 67 11.379 29.802 6.508 1.00 0.00 C ATOM 1118 O GLU A 67 11.537 29.861 7.735 1.00 0.00 O ATOM 1119 CB GLU A 67 13.638 28.946 5.688 1.00 0.00 C ATOM 1120 CG GLU A 67 14.486 27.702 5.344 1.00 0.00 C ATOM 1121 CD GLU A 67 15.879 28.056 4.785 1.00 0.00 C ATOM 1122 OE1 GLU A 67 16.013 28.216 3.554 1.00 0.00 O ATOM 1123 OE2 GLU A 67 16.837 28.199 5.567 1.00 0.00 O ATOM 0 H GLU A 67 12.326 29.043 3.611 1.00 0.00 H new ATOM 0 HA GLU A 67 11.874 27.759 6.143 1.00 0.00 H new ATOM 0 HB2 GLU A 67 13.877 29.738 4.978 1.00 0.00 H new ATOM 0 HB3 GLU A 67 13.930 29.304 6.675 1.00 0.00 H new ATOM 0 HG2 GLU A 67 14.605 27.091 6.239 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.951 27.096 4.613 1.00 0.00 H new ATOM 1130 N ASN A 68 10.616 30.680 5.828 1.00 0.00 N ATOM 1131 CA ASN A 68 9.755 31.679 6.483 1.00 0.00 C ATOM 1132 C ASN A 68 8.286 31.282 6.256 1.00 0.00 C ATOM 1133 O ASN A 68 7.860 31.145 5.099 1.00 0.00 O ATOM 1134 CB ASN A 68 10.011 33.106 5.927 1.00 0.00 C ATOM 1135 CG ASN A 68 11.451 33.591 6.125 1.00 0.00 C ATOM 1136 OD1 ASN A 68 12.117 33.228 7.097 1.00 0.00 O ATOM 1137 ND2 ASN A 68 11.935 34.422 5.214 1.00 0.00 N ATOM 0 H ASN A 68 10.581 30.715 4.809 1.00 0.00 H new ATOM 0 HA ASN A 68 9.985 31.699 7.548 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.774 33.120 4.863 1.00 0.00 H new ATOM 0 HB3 ASN A 68 9.331 33.804 6.414 1.00 0.00 H new ATOM 0 HD21 ASN A 68 12.885 34.781 5.305 1.00 0.00 H new ATOM 0 HD22 ASN A 68 11.357 34.703 4.422 1.00 0.00 H new ATOM 1144 N PRO A 69 7.481 31.085 7.349 1.00 0.00 N ATOM 1145 CA PRO A 69 6.035 30.792 7.222 1.00 0.00 C ATOM 1146 C PRO A 69 5.246 31.980 6.619 1.00 0.00 C ATOM 1147 O PRO A 69 4.201 31.782 6.005 1.00 0.00 O ATOM 1148 CB PRO A 69 5.597 30.497 8.682 1.00 0.00 C ATOM 1149 CG PRO A 69 6.610 31.205 9.533 1.00 0.00 C ATOM 1150 CD PRO A 69 7.912 31.100 8.777 1.00 0.00 C ATOM 0 HA PRO A 69 5.838 29.964 6.542 1.00 0.00 H new ATOM 0 HB2 PRO A 69 4.590 30.866 8.876 1.00 0.00 H new ATOM 0 HB3 PRO A 69 5.589 29.426 8.884 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.331 32.247 9.692 1.00 0.00 H new ATOM 0 HG3 PRO A 69 6.689 30.743 10.517 1.00 0.00 H new ATOM 0 HD2 PRO A 69 8.569 31.943 8.990 1.00 0.00 H new ATOM 0 HD3 PRO A 69 8.459 30.195 9.042 1.00 0.00 H new ATOM 1158 N MET A 70 5.813 33.200 6.731 1.00 0.00 N ATOM 1159 CA MET A 70 5.103 34.462 6.423 1.00 0.00 C ATOM 1160 C MET A 70 4.857 34.613 4.916 1.00 0.00 C ATOM 1161 O MET A 70 3.896 35.279 4.500 1.00 0.00 O ATOM 1162 CB MET A 70 5.913 35.653 6.977 1.00 0.00 C ATOM 1163 CG MET A 70 6.065 35.659 8.507 1.00 0.00 C ATOM 1164 SD MET A 70 7.298 36.851 9.078 1.00 0.00 S ATOM 1165 CE MET A 70 8.799 36.183 8.350 1.00 0.00 C ATOM 0 H MET A 70 6.776 33.339 7.037 1.00 0.00 H new ATOM 0 HA MET A 70 4.125 34.441 6.904 1.00 0.00 H new ATOM 0 HB2 MET A 70 6.905 35.644 6.525 1.00 0.00 H new ATOM 0 HB3 MET A 70 5.431 36.580 6.668 1.00 0.00 H new ATOM 0 HG2 MET A 70 5.103 35.891 8.963 1.00 0.00 H new ATOM 0 HG3 MET A 70 6.346 34.661 8.844 1.00 0.00 H new ATOM 0 HE1 MET A 70 9.664 36.533 8.914 1.00 0.00 H new ATOM 0 HE2 MET A 70 8.764 35.094 8.379 1.00 0.00 H new ATOM 0 HE3 MET A 70 8.881 36.516 7.315 1.00 0.00 H new ATOM 1175 N GLN A 71 5.725 33.953 4.119 1.00 0.00 N ATOM 1176 CA GLN A 71 5.610 33.878 2.649 1.00 0.00 C ATOM 1177 C GLN A 71 4.230 33.369 2.204 1.00 0.00 C ATOM 1178 O GLN A 71 3.682 33.827 1.202 1.00 0.00 O ATOM 1179 CB GLN A 71 6.724 32.956 2.076 1.00 0.00 C ATOM 1180 CG GLN A 71 8.150 33.548 2.120 1.00 0.00 C ATOM 1181 CD GLN A 71 8.408 34.640 1.073 1.00 0.00 C ATOM 1182 OE1 GLN A 71 7.511 35.371 0.661 1.00 0.00 O ATOM 1183 NE2 GLN A 71 9.646 34.760 0.632 1.00 0.00 N ATOM 0 H GLN A 71 6.535 33.452 4.484 1.00 0.00 H new ATOM 0 HA GLN A 71 5.730 34.888 2.258 1.00 0.00 H new ATOM 0 HB2 GLN A 71 6.719 32.018 2.631 1.00 0.00 H new ATOM 0 HB3 GLN A 71 6.479 32.715 1.042 1.00 0.00 H new ATOM 0 HG2 GLN A 71 8.330 33.962 3.112 1.00 0.00 H new ATOM 0 HG3 GLN A 71 8.871 32.743 1.975 1.00 0.00 H new ATOM 0 HE21 GLN A 71 10.376 34.143 0.987 1.00 0.00 H new ATOM 0 HE22 GLN A 71 9.873 35.470 -0.064 1.00 0.00 H new ATOM 1192 N PHE A 72 3.669 32.444 2.980 1.00 0.00 N ATOM 1193 CA PHE A 72 2.394 31.790 2.650 1.00 0.00 C ATOM 1194 C PHE A 72 1.212 32.725 2.960 1.00 0.00 C ATOM 1195 O PHE A 72 0.215 32.729 2.244 1.00 0.00 O ATOM 1196 CB PHE A 72 2.267 30.469 3.452 1.00 0.00 C ATOM 1197 CG PHE A 72 3.537 29.609 3.460 1.00 0.00 C ATOM 1198 CD1 PHE A 72 4.327 29.463 2.315 1.00 0.00 C ATOM 1199 CD2 PHE A 72 3.939 28.953 4.618 1.00 0.00 C ATOM 1200 CE1 PHE A 72 5.469 28.689 2.339 1.00 0.00 C ATOM 1201 CE2 PHE A 72 5.074 28.182 4.633 1.00 0.00 C ATOM 1202 CZ PHE A 72 5.842 28.049 3.498 1.00 0.00 C ATOM 0 H PHE A 72 4.081 32.123 3.856 1.00 0.00 H new ATOM 0 HA PHE A 72 2.375 31.563 1.584 1.00 0.00 H new ATOM 0 HB2 PHE A 72 1.997 30.707 4.481 1.00 0.00 H new ATOM 0 HB3 PHE A 72 1.448 29.882 3.036 1.00 0.00 H new ATOM 0 HD1 PHE A 72 4.040 29.962 1.401 1.00 0.00 H new ATOM 0 HD2 PHE A 72 3.350 29.052 5.518 1.00 0.00 H new ATOM 0 HE1 PHE A 72 6.070 28.586 1.448 1.00 0.00 H new ATOM 0 HE2 PHE A 72 5.367 27.676 5.541 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.736 27.443 3.518 1.00 0.00 H new ATOM 1212 N PHE A 73 1.362 33.540 4.017 1.00 0.00 N ATOM 1213 CA PHE A 73 0.298 34.437 4.513 1.00 0.00 C ATOM 1214 C PHE A 73 0.225 35.739 3.694 1.00 0.00 C ATOM 1215 O PHE A 73 -0.760 36.475 3.785 1.00 0.00 O ATOM 1216 CB PHE A 73 0.532 34.742 6.010 1.00 0.00 C ATOM 1217 CG PHE A 73 0.552 33.490 6.882 1.00 0.00 C ATOM 1218 CD1 PHE A 73 -0.625 32.849 7.240 1.00 0.00 C ATOM 1219 CD2 PHE A 73 1.747 32.939 7.316 1.00 0.00 C ATOM 1220 CE1 PHE A 73 -0.595 31.705 8.010 1.00 0.00 C ATOM 1221 CE2 PHE A 73 1.768 31.789 8.075 1.00 0.00 C ATOM 1222 CZ PHE A 73 0.598 31.175 8.424 1.00 0.00 C ATOM 0 H PHE A 73 2.226 33.598 4.555 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.660 33.931 4.396 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.478 35.271 6.123 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.252 35.412 6.365 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -1.573 33.249 6.913 1.00 0.00 H new ATOM 0 HD2 PHE A 73 2.678 33.419 7.055 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.520 31.223 8.289 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.711 31.372 8.395 1.00 0.00 H new ATOM 0 HZ PHE A 73 0.614 30.277 9.023 1.00 0.00 H new ATOM 1232 N GLU A 74 1.285 36.041 2.926 1.00 0.00 N ATOM 1233 CA GLU A 74 1.281 37.176 1.979 1.00 0.00 C ATOM 1234 C GLU A 74 0.874 36.718 0.558 1.00 0.00 C ATOM 1235 O GLU A 74 0.230 37.473 -0.178 1.00 0.00 O ATOM 1236 CB GLU A 74 2.660 37.883 1.978 1.00 0.00 C ATOM 1237 CG GLU A 74 3.838 37.026 1.493 1.00 0.00 C ATOM 1238 CD GLU A 74 5.193 37.738 1.615 1.00 0.00 C ATOM 1239 OE1 GLU A 74 5.504 38.584 0.751 1.00 0.00 O ATOM 1240 OE2 GLU A 74 5.940 37.478 2.585 1.00 0.00 O ATOM 0 H GLU A 74 2.159 35.515 2.940 1.00 0.00 H new ATOM 0 HA GLU A 74 0.534 37.897 2.309 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.594 38.770 1.348 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.874 38.226 2.990 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.868 36.101 2.069 1.00 0.00 H new ATOM 0 HG3 GLU A 74 3.673 36.748 0.452 1.00 0.00 H new ATOM 1247 N THR A 75 1.252 35.475 0.180 1.00 0.00 N ATOM 1248 CA THR A 75 0.958 34.928 -1.163 1.00 0.00 C ATOM 1249 C THR A 75 -0.510 34.463 -1.254 1.00 0.00 C ATOM 1250 O THR A 75 -1.244 34.849 -2.170 1.00 0.00 O ATOM 1251 CB THR A 75 1.928 33.747 -1.517 1.00 0.00 C ATOM 1252 OG1 THR A 75 3.280 34.228 -1.498 1.00 0.00 O ATOM 1253 CG2 THR A 75 1.630 33.110 -2.893 1.00 0.00 C ATOM 0 H THR A 75 1.761 34.833 0.787 1.00 0.00 H new ATOM 0 HA THR A 75 1.115 35.726 -1.889 1.00 0.00 H new ATOM 0 HB THR A 75 1.777 32.970 -0.768 1.00 0.00 H new ATOM 0 HG1 THR A 75 3.634 34.173 -0.586 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.335 32.300 -3.079 1.00 0.00 H new ATOM 0 HG22 THR A 75 0.614 32.716 -2.899 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.731 33.865 -3.673 1.00 0.00 H new ATOM 1261 N PHE A 76 -0.918 33.628 -0.287 1.00 0.00 N ATOM 1262 CA PHE A 76 -2.270 33.043 -0.233 1.00 0.00 C ATOM 1263 C PHE A 76 -3.142 33.824 0.773 1.00 0.00 C ATOM 1264 O PHE A 76 -4.241 34.278 0.431 1.00 0.00 O ATOM 1265 CB PHE A 76 -2.186 31.547 0.167 1.00 0.00 C ATOM 1266 CG PHE A 76 -1.296 30.692 -0.730 1.00 0.00 C ATOM 1267 CD1 PHE A 76 -1.695 30.369 -2.025 1.00 0.00 C ATOM 1268 CD2 PHE A 76 -0.069 30.205 -0.275 1.00 0.00 C ATOM 1269 CE1 PHE A 76 -0.898 29.584 -2.838 1.00 0.00 C ATOM 1270 CE2 PHE A 76 0.728 29.423 -1.087 1.00 0.00 C ATOM 1271 CZ PHE A 76 0.313 29.112 -2.370 1.00 0.00 C ATOM 0 H PHE A 76 -0.318 33.337 0.485 1.00 0.00 H new ATOM 0 HA PHE A 76 -2.729 33.113 -1.219 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.817 31.480 1.191 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -3.192 31.127 0.162 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.639 30.736 -2.399 1.00 0.00 H new ATOM 0 HD2 PHE A 76 0.261 30.443 0.725 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -1.222 29.340 -3.839 1.00 0.00 H new ATOM 0 HE2 PHE A 76 1.675 29.054 -0.721 1.00 0.00 H new ATOM 0 HZ PHE A 76 0.936 28.500 -3.006 1.00 0.00 H new ATOM 1281 N GLY A 77 -2.626 33.949 2.022 1.00 0.00 N ATOM 1282 CA GLY A 77 -3.294 34.687 3.106 1.00 0.00 C ATOM 1283 C GLY A 77 -4.586 34.036 3.562 1.00 0.00 C ATOM 1284 O GLY A 77 -4.582 33.231 4.504 1.00 0.00 O ATOM 0 H GLY A 77 -1.734 33.538 2.298 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -2.615 34.767 3.955 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -3.505 35.702 2.770 1.00 0.00 H new ATOM 1288 N ASP A 78 -5.687 34.378 2.867 1.00 0.00 N ATOM 1289 CA ASP A 78 -7.008 33.766 3.088 1.00 0.00 C ATOM 1290 C ASP A 78 -6.947 32.250 2.865 1.00 0.00 C ATOM 1291 O ASP A 78 -7.517 31.488 3.636 1.00 0.00 O ATOM 1292 CB ASP A 78 -8.066 34.387 2.136 1.00 0.00 C ATOM 1293 CG ASP A 78 -9.414 33.624 2.150 1.00 0.00 C ATOM 1294 OD1 ASP A 78 -10.236 33.852 3.064 1.00 0.00 O ATOM 1295 OD2 ASP A 78 -9.633 32.755 1.270 1.00 0.00 O ATOM 0 H ASP A 78 -5.684 35.088 2.135 1.00 0.00 H new ATOM 0 HA ASP A 78 -7.298 33.963 4.120 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.239 35.425 2.421 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -7.671 34.397 1.120 1.00 0.00 H new ATOM 1300 N ARG A 79 -6.258 31.833 1.791 1.00 0.00 N ATOM 1301 CA ARG A 79 -6.204 30.418 1.393 1.00 0.00 C ATOM 1302 C ARG A 79 -5.413 29.566 2.386 1.00 0.00 C ATOM 1303 O ARG A 79 -5.557 28.378 2.356 1.00 0.00 O ATOM 1304 CB ARG A 79 -5.620 30.241 -0.029 1.00 0.00 C ATOM 1305 CG ARG A 79 -6.412 30.934 -1.149 1.00 0.00 C ATOM 1306 CD ARG A 79 -7.884 30.480 -1.200 1.00 0.00 C ATOM 1307 NE ARG A 79 -8.557 30.935 -2.425 1.00 0.00 N ATOM 1308 CZ ARG A 79 -9.711 31.614 -2.496 1.00 0.00 C ATOM 1309 NH1 ARG A 79 -10.327 32.057 -1.404 1.00 0.00 N ATOM 1310 NH2 ARG A 79 -10.220 31.889 -3.681 1.00 0.00 N ATOM 0 H ARG A 79 -5.730 32.457 1.182 1.00 0.00 H new ATOM 0 HA ARG A 79 -7.236 30.069 1.392 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -4.599 30.624 -0.036 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -5.562 29.175 -0.251 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -6.373 32.013 -1.003 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -5.937 30.725 -2.108 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -7.930 29.392 -1.143 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -8.414 30.868 -0.330 1.00 0.00 H new ATOM 0 HE ARG A 79 -8.101 30.712 -3.309 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -9.922 31.883 -0.484 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -11.204 32.571 -1.486 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -9.737 31.586 -4.526 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -11.097 32.405 -3.752 1.00 0.00 H new ATOM 1324 N VAL A 80 -4.566 30.160 3.244 1.00 0.00 N ATOM 1325 CA VAL A 80 -3.880 29.392 4.306 1.00 0.00 C ATOM 1326 C VAL A 80 -4.855 29.195 5.475 1.00 0.00 C ATOM 1327 O VAL A 80 -5.468 30.177 5.907 1.00 0.00 O ATOM 1328 CB VAL A 80 -2.577 30.106 4.800 1.00 0.00 C ATOM 1329 CG1 VAL A 80 -1.841 29.254 5.854 1.00 0.00 C ATOM 1330 CG2 VAL A 80 -1.647 30.450 3.618 1.00 0.00 C ATOM 0 H VAL A 80 -4.340 31.154 3.227 1.00 0.00 H new ATOM 0 HA VAL A 80 -3.576 28.428 3.897 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.872 31.042 5.274 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -0.940 29.775 6.179 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.495 29.091 6.711 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.567 28.293 5.418 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -0.751 30.945 3.992 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.366 29.534 3.098 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.167 31.114 2.928 1.00 0.00 H new ATOM 1340 N PHE A 81 -4.971 27.938 5.985 1.00 0.00 N ATOM 1341 CA PHE A 81 -6.012 27.543 6.970 1.00 0.00 C ATOM 1342 C PHE A 81 -6.071 28.462 8.190 1.00 0.00 C ATOM 1343 O PHE A 81 -7.149 28.773 8.692 1.00 0.00 O ATOM 1344 CB PHE A 81 -5.877 26.046 7.383 1.00 0.00 C ATOM 1345 CG PHE A 81 -4.631 25.615 8.179 1.00 0.00 C ATOM 1346 CD1 PHE A 81 -4.607 25.658 9.576 1.00 0.00 C ATOM 1347 CD2 PHE A 81 -3.510 25.107 7.535 1.00 0.00 C ATOM 1348 CE1 PHE A 81 -3.514 25.216 10.293 1.00 0.00 C ATOM 1349 CE2 PHE A 81 -2.412 24.670 8.255 1.00 0.00 C ATOM 1350 CZ PHE A 81 -2.413 24.723 9.630 1.00 0.00 C ATOM 0 H PHE A 81 -4.347 27.174 5.725 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.967 27.662 6.459 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.755 25.784 7.973 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -5.914 25.446 6.474 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -5.464 26.046 10.107 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -3.495 25.052 6.456 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -3.522 25.257 11.372 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -1.548 24.285 7.734 1.00 0.00 H new ATOM 0 HZ PHE A 81 -1.554 24.379 10.187 1.00 0.00 H new ATOM 1360 N LEU A 82 -4.905 28.907 8.638 1.00 0.00 N ATOM 1361 CA LEU A 82 -4.783 29.921 9.692 1.00 0.00 C ATOM 1362 C LEU A 82 -4.217 31.205 9.068 1.00 0.00 C ATOM 1363 O LEU A 82 -3.646 31.159 7.976 1.00 0.00 O ATOM 1364 CB LEU A 82 -3.899 29.391 10.869 1.00 0.00 C ATOM 1365 CG LEU A 82 -2.339 29.363 10.697 1.00 0.00 C ATOM 1366 CD1 LEU A 82 -1.655 28.911 12.005 1.00 0.00 C ATOM 1367 CD2 LEU A 82 -1.888 28.477 9.523 1.00 0.00 C ATOM 0 H LEU A 82 -4.008 28.576 8.282 1.00 0.00 H new ATOM 0 HA LEU A 82 -5.761 30.143 10.120 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.122 29.997 11.747 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.224 28.375 11.092 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.030 30.382 10.465 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -0.574 28.898 11.865 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -1.909 29.604 12.807 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -1.998 27.911 12.268 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.801 28.495 9.451 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -2.224 27.454 9.690 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.319 28.854 8.596 1.00 0.00 H new ATOM 1379 N THR A 83 -4.403 32.356 9.730 1.00 0.00 N ATOM 1380 CA THR A 83 -3.779 33.625 9.286 1.00 0.00 C ATOM 1381 C THR A 83 -2.490 33.865 10.089 1.00 0.00 C ATOM 1382 O THR A 83 -2.179 33.099 11.008 1.00 0.00 O ATOM 1383 CB THR A 83 -4.761 34.848 9.385 1.00 0.00 C ATOM 1384 OG1 THR A 83 -4.130 36.036 8.874 1.00 0.00 O ATOM 1385 CG2 THR A 83 -5.242 35.109 10.814 1.00 0.00 C ATOM 0 H THR A 83 -4.975 32.441 10.570 1.00 0.00 H new ATOM 0 HA THR A 83 -3.531 33.532 8.229 1.00 0.00 H new ATOM 0 HB THR A 83 -5.634 34.594 8.784 1.00 0.00 H new ATOM 0 HG1 THR A 83 -4.752 36.791 8.939 1.00 0.00 H new ATOM 0 HG21 THR A 83 -5.917 35.965 10.820 1.00 0.00 H new ATOM 0 HG22 THR A 83 -5.767 34.230 11.187 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.385 35.318 11.454 1.00 0.00 H new ATOM 1393 N LYS A 84 -1.734 34.911 9.715 1.00 0.00 N ATOM 1394 CA LYS A 84 -0.426 35.227 10.320 1.00 0.00 C ATOM 1395 C LYS A 84 -0.559 35.522 11.829 1.00 0.00 C ATOM 1396 O LYS A 84 0.385 35.306 12.599 1.00 0.00 O ATOM 1397 CB LYS A 84 0.212 36.421 9.581 1.00 0.00 C ATOM 1398 CG LYS A 84 1.699 36.675 9.919 1.00 0.00 C ATOM 1399 CD LYS A 84 2.267 37.929 9.212 1.00 0.00 C ATOM 1400 CE LYS A 84 2.143 37.869 7.675 1.00 0.00 C ATOM 1401 NZ LYS A 84 2.536 39.152 7.037 1.00 0.00 N ATOM 0 H LYS A 84 -2.012 35.564 8.983 1.00 0.00 H new ATOM 0 HA LYS A 84 0.222 34.357 10.217 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.121 36.256 8.507 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -0.358 37.321 9.814 1.00 0.00 H new ATOM 0 HG2 LYS A 84 1.807 36.791 10.997 1.00 0.00 H new ATOM 0 HG3 LYS A 84 2.287 35.803 9.631 1.00 0.00 H new ATOM 0 HD2 LYS A 84 1.744 38.813 9.578 1.00 0.00 H new ATOM 0 HD3 LYS A 84 3.317 38.046 9.481 1.00 0.00 H new ATOM 0 HE2 LYS A 84 2.771 37.065 7.291 1.00 0.00 H new ATOM 0 HE3 LYS A 84 1.115 37.628 7.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 2.439 39.071 6.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 1.920 39.915 7.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 3.525 39.370 7.275 1.00 0.00 H new ATOM 1415 N ASP A 85 -1.750 36.006 12.231 1.00 0.00 N ATOM 1416 CA ASP A 85 -2.100 36.210 13.651 1.00 0.00 C ATOM 1417 C ASP A 85 -2.146 34.858 14.367 1.00 0.00 C ATOM 1418 O ASP A 85 -1.476 34.652 15.373 1.00 0.00 O ATOM 1419 CB ASP A 85 -3.469 36.896 13.836 1.00 0.00 C ATOM 1420 CG ASP A 85 -3.653 38.176 13.012 1.00 0.00 C ATOM 1421 OD1 ASP A 85 -3.718 38.088 11.766 1.00 0.00 O ATOM 1422 OD2 ASP A 85 -3.775 39.271 13.604 1.00 0.00 O ATOM 0 H ASP A 85 -2.494 36.266 11.584 1.00 0.00 H new ATOM 0 HA ASP A 85 -1.333 36.860 14.072 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -4.255 36.190 13.568 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -3.602 37.135 14.891 1.00 0.00 H new ATOM 1427 N GLU A 86 -2.929 33.929 13.796 1.00 0.00 N ATOM 1428 CA GLU A 86 -3.101 32.579 14.355 1.00 0.00 C ATOM 1429 C GLU A 86 -1.753 31.831 14.389 1.00 0.00 C ATOM 1430 O GLU A 86 -1.534 31.013 15.268 1.00 0.00 O ATOM 1431 CB GLU A 86 -4.149 31.777 13.549 1.00 0.00 C ATOM 1432 CG GLU A 86 -5.494 32.496 13.301 1.00 0.00 C ATOM 1433 CD GLU A 86 -6.247 32.916 14.574 1.00 0.00 C ATOM 1434 OE1 GLU A 86 -7.008 32.090 15.124 1.00 0.00 O ATOM 1435 OE2 GLU A 86 -6.105 34.080 15.011 1.00 0.00 O ATOM 0 H GLU A 86 -3.458 34.091 12.939 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.465 32.679 15.377 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.715 31.514 12.584 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -4.348 30.843 14.075 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.309 33.384 12.696 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -6.138 31.840 12.715 1.00 0.00 H new ATOM 1442 N LEU A 87 -0.855 32.164 13.432 1.00 0.00 N ATOM 1443 CA LEU A 87 0.517 31.621 13.358 1.00 0.00 C ATOM 1444 C LEU A 87 1.342 32.034 14.586 1.00 0.00 C ATOM 1445 O LEU A 87 1.851 31.173 15.304 1.00 0.00 O ATOM 1446 CB LEU A 87 1.235 32.120 12.072 1.00 0.00 C ATOM 1447 CG LEU A 87 2.773 31.820 11.987 1.00 0.00 C ATOM 1448 CD1 LEU A 87 3.052 30.321 11.745 1.00 0.00 C ATOM 1449 CD2 LEU A 87 3.480 32.716 10.945 1.00 0.00 C ATOM 0 H LEU A 87 -1.067 32.824 12.684 1.00 0.00 H new ATOM 0 HA LEU A 87 0.437 30.534 13.332 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.748 31.668 11.208 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.089 33.197 11.992 1.00 0.00 H new ATOM 0 HG LEU A 87 3.200 32.070 12.958 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.128 30.155 11.692 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.634 29.736 12.565 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.591 30.012 10.807 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.543 32.475 10.919 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.045 32.543 9.961 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.352 33.763 11.219 1.00 0.00 H new ATOM 1461 N LYS A 88 1.478 33.366 14.801 1.00 0.00 N ATOM 1462 CA LYS A 88 2.378 33.913 15.841 1.00 0.00 C ATOM 1463 C LYS A 88 1.987 33.417 17.249 1.00 0.00 C ATOM 1464 O LYS A 88 2.851 33.006 18.016 1.00 0.00 O ATOM 1465 CB LYS A 88 2.534 35.475 15.741 1.00 0.00 C ATOM 1466 CG LYS A 88 1.251 36.314 15.570 1.00 0.00 C ATOM 1467 CD LYS A 88 0.417 36.467 16.862 1.00 0.00 C ATOM 1468 CE LYS A 88 -0.542 37.643 16.788 1.00 0.00 C ATOM 1469 NZ LYS A 88 -1.500 37.658 17.924 1.00 0.00 N ATOM 0 H LYS A 88 0.977 34.077 14.269 1.00 0.00 H new ATOM 0 HA LYS A 88 3.376 33.518 15.650 1.00 0.00 H new ATOM 0 HB2 LYS A 88 3.043 35.820 16.641 1.00 0.00 H new ATOM 0 HB3 LYS A 88 3.192 35.693 14.900 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.524 37.305 15.208 1.00 0.00 H new ATOM 0 HG3 LYS A 88 0.629 35.854 14.802 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -0.147 35.551 17.040 1.00 0.00 H new ATOM 0 HD3 LYS A 88 1.087 36.599 17.712 1.00 0.00 H new ATOM 0 HE2 LYS A 88 0.026 38.573 16.782 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -1.095 37.601 15.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -2.055 38.537 17.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -2.140 36.842 17.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -0.976 37.605 18.821 1.00 0.00 H new ATOM 1483 N GLU A 89 0.673 33.372 17.530 1.00 0.00 N ATOM 1484 CA GLU A 89 0.143 32.940 18.843 1.00 0.00 C ATOM 1485 C GLU A 89 0.145 31.402 18.975 1.00 0.00 C ATOM 1486 O GLU A 89 0.169 30.882 20.090 1.00 0.00 O ATOM 1487 CB GLU A 89 -1.270 33.533 19.061 1.00 0.00 C ATOM 1488 CG GLU A 89 -2.316 33.129 18.008 1.00 0.00 C ATOM 1489 CD GLU A 89 -3.591 33.981 18.077 1.00 0.00 C ATOM 1490 OE1 GLU A 89 -3.522 35.190 17.735 1.00 0.00 O ATOM 1491 OE2 GLU A 89 -4.650 33.466 18.493 1.00 0.00 O ATOM 0 H GLU A 89 -0.051 33.632 16.860 1.00 0.00 H new ATOM 0 HA GLU A 89 0.799 33.321 19.626 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -1.629 33.226 20.043 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -1.193 34.620 19.076 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -1.878 33.219 17.014 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -2.578 32.080 18.147 1.00 0.00 H new ATOM 1498 N TYR A 90 0.123 30.688 17.828 1.00 0.00 N ATOM 1499 CA TYR A 90 0.299 29.219 17.784 1.00 0.00 C ATOM 1500 C TYR A 90 1.737 28.855 18.186 1.00 0.00 C ATOM 1501 O TYR A 90 1.945 27.962 19.005 1.00 0.00 O ATOM 1502 CB TYR A 90 -0.035 28.671 16.368 1.00 0.00 C ATOM 1503 CG TYR A 90 0.300 27.190 16.132 1.00 0.00 C ATOM 1504 CD1 TYR A 90 -0.422 26.171 16.762 1.00 0.00 C ATOM 1505 CD2 TYR A 90 1.349 26.816 15.281 1.00 0.00 C ATOM 1506 CE1 TYR A 90 -0.114 24.839 16.550 1.00 0.00 C ATOM 1507 CE2 TYR A 90 1.661 25.485 15.069 1.00 0.00 C ATOM 1508 CZ TYR A 90 0.927 24.499 15.702 1.00 0.00 C ATOM 1509 OH TYR A 90 1.238 23.168 15.491 1.00 0.00 O ATOM 0 H TYR A 90 -0.017 31.111 16.910 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.389 28.758 18.492 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -1.099 28.818 16.183 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.502 29.268 15.631 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.234 26.429 17.426 1.00 0.00 H new ATOM 0 HD2 TYR A 90 1.925 27.581 14.781 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.684 24.066 17.044 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.475 25.217 14.412 1.00 0.00 H new ATOM 0 HH TYR A 90 1.992 23.103 14.869 1.00 0.00 H new ATOM 1519 N MET A 91 2.716 29.583 17.615 1.00 0.00 N ATOM 1520 CA MET A 91 4.150 29.352 17.876 1.00 0.00 C ATOM 1521 C MET A 91 4.494 29.710 19.332 1.00 0.00 C ATOM 1522 O MET A 91 5.254 28.985 19.981 1.00 0.00 O ATOM 1523 CB MET A 91 5.032 30.157 16.883 1.00 0.00 C ATOM 1524 CG MET A 91 4.887 29.742 15.404 1.00 0.00 C ATOM 1525 SD MET A 91 6.057 30.584 14.308 1.00 0.00 S ATOM 1526 CE MET A 91 5.648 32.312 14.570 1.00 0.00 C ATOM 0 H MET A 91 2.536 30.345 16.962 1.00 0.00 H new ATOM 0 HA MET A 91 4.360 28.293 17.724 1.00 0.00 H new ATOM 0 HB2 MET A 91 4.785 31.215 16.975 1.00 0.00 H new ATOM 0 HB3 MET A 91 6.076 30.047 17.176 1.00 0.00 H new ATOM 0 HG2 MET A 91 5.031 28.665 15.320 1.00 0.00 H new ATOM 0 HG3 MET A 91 3.871 29.954 15.072 1.00 0.00 H new ATOM 0 HE1 MET A 91 6.137 32.921 13.810 1.00 0.00 H new ATOM 0 HE2 MET A 91 4.568 32.445 14.502 1.00 0.00 H new ATOM 0 HE3 MET A 91 5.990 32.621 15.558 1.00 0.00 H new ATOM 1536 N LYS A 92 3.895 30.819 19.841 1.00 0.00 N ATOM 1537 CA LYS A 92 4.048 31.233 21.257 1.00 0.00 C ATOM 1538 C LYS A 92 3.438 30.176 22.190 1.00 0.00 C ATOM 1539 O LYS A 92 3.999 29.888 23.247 1.00 0.00 O ATOM 1540 CB LYS A 92 3.408 32.622 21.555 1.00 0.00 C ATOM 1541 CG LYS A 92 3.992 33.848 20.797 1.00 0.00 C ATOM 1542 CD LYS A 92 5.551 33.974 20.838 1.00 0.00 C ATOM 1543 CE LYS A 92 6.240 33.428 19.568 1.00 0.00 C ATOM 1544 NZ LYS A 92 7.718 33.557 19.638 1.00 0.00 N ATOM 0 H LYS A 92 3.303 31.440 19.290 1.00 0.00 H new ATOM 0 HA LYS A 92 5.119 31.322 21.440 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.344 32.560 21.328 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.496 32.812 22.625 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.675 33.796 19.756 1.00 0.00 H new ATOM 0 HG3 LYS A 92 3.559 34.755 21.218 1.00 0.00 H new ATOM 0 HD2 LYS A 92 5.821 35.022 20.968 1.00 0.00 H new ATOM 0 HD3 LYS A 92 5.930 33.437 21.708 1.00 0.00 H new ATOM 0 HE2 LYS A 92 5.974 32.380 19.433 1.00 0.00 H new ATOM 0 HE3 LYS A 92 5.870 33.966 18.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.141 33.179 18.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 7.974 34.560 19.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 8.075 33.023 20.456 1.00 0.00 H new ATOM 1558 N SER A 93 2.296 29.598 21.766 1.00 0.00 N ATOM 1559 CA SER A 93 1.598 28.535 22.512 1.00 0.00 C ATOM 1560 C SER A 93 2.491 27.286 22.647 1.00 0.00 C ATOM 1561 O SER A 93 2.599 26.707 23.730 1.00 0.00 O ATOM 1562 CB SER A 93 0.263 28.177 21.818 1.00 0.00 C ATOM 1563 OG SER A 93 -0.498 27.254 22.580 1.00 0.00 O ATOM 0 H SER A 93 1.832 29.857 20.895 1.00 0.00 H new ATOM 0 HA SER A 93 1.379 28.906 23.513 1.00 0.00 H new ATOM 0 HB2 SER A 93 -0.319 29.085 21.660 1.00 0.00 H new ATOM 0 HB3 SER A 93 0.467 27.754 20.834 1.00 0.00 H new ATOM 0 HG SER A 93 -1.334 27.053 22.110 1.00 0.00 H new ATOM 1798 N LYS A 106 16.506 28.482 12.132 1.00 0.00 N ATOM 1799 CA LYS A 106 15.125 28.522 11.572 1.00 0.00 C ATOM 1800 C LYS A 106 14.551 27.097 11.398 1.00 0.00 C ATOM 1801 O LYS A 106 15.133 26.113 11.858 1.00 0.00 O ATOM 1802 CB LYS A 106 15.078 29.296 10.207 1.00 0.00 C ATOM 1803 CG LYS A 106 15.647 28.542 8.969 1.00 0.00 C ATOM 1804 CD LYS A 106 17.182 28.573 8.867 1.00 0.00 C ATOM 1805 CE LYS A 106 17.722 29.976 8.540 1.00 0.00 C ATOM 1806 NZ LYS A 106 17.188 30.498 7.253 1.00 0.00 N ATOM 0 HA LYS A 106 14.504 29.060 12.289 1.00 0.00 H new ATOM 0 HB2 LYS A 106 14.042 29.562 10.000 1.00 0.00 H new ATOM 0 HB3 LYS A 106 15.629 30.229 10.323 1.00 0.00 H new ATOM 0 HG2 LYS A 106 15.317 27.504 9.006 1.00 0.00 H new ATOM 0 HG3 LYS A 106 15.224 28.979 8.064 1.00 0.00 H new ATOM 0 HD2 LYS A 106 17.613 28.232 9.808 1.00 0.00 H new ATOM 0 HD3 LYS A 106 17.506 27.874 8.096 1.00 0.00 H new ATOM 0 HE2 LYS A 106 17.459 30.662 9.345 1.00 0.00 H new ATOM 0 HE3 LYS A 106 18.810 29.943 8.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 17.866 31.172 6.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 17.043 29.709 6.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 16.281 30.978 7.423 1.00 0.00 H new ATOM 1820 N LYS A 107 13.383 27.022 10.736 1.00 0.00 N ATOM 1821 CA LYS A 107 12.740 25.767 10.334 1.00 0.00 C ATOM 1822 C LYS A 107 12.258 25.903 8.888 1.00 0.00 C ATOM 1823 O LYS A 107 11.853 26.988 8.472 1.00 0.00 O ATOM 1824 CB LYS A 107 11.542 25.448 11.276 1.00 0.00 C ATOM 1825 CG LYS A 107 10.859 24.089 10.998 1.00 0.00 C ATOM 1826 CD LYS A 107 11.786 22.880 11.305 1.00 0.00 C ATOM 1827 CE LYS A 107 11.394 21.621 10.520 1.00 0.00 C ATOM 1828 NZ LYS A 107 12.167 20.426 10.935 1.00 0.00 N ATOM 0 H LYS A 107 12.853 27.849 10.462 1.00 0.00 H new ATOM 0 HA LYS A 107 13.455 24.948 10.407 1.00 0.00 H new ATOM 0 HB2 LYS A 107 11.893 25.461 12.308 1.00 0.00 H new ATOM 0 HB3 LYS A 107 10.800 26.241 11.182 1.00 0.00 H new ATOM 0 HG2 LYS A 107 9.955 24.011 11.601 1.00 0.00 H new ATOM 0 HG3 LYS A 107 10.550 24.049 9.954 1.00 0.00 H new ATOM 0 HD2 LYS A 107 12.816 23.147 11.066 1.00 0.00 H new ATOM 0 HD3 LYS A 107 11.752 22.663 12.373 1.00 0.00 H new ATOM 0 HE2 LYS A 107 10.330 21.427 10.659 1.00 0.00 H new ATOM 0 HE3 LYS A 107 11.549 21.798 9.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 11.863 19.604 10.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 13.181 20.597 10.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 12.000 20.237 11.944 1.00 0.00 H new ATOM 1842 N LEU A 108 12.321 24.800 8.136 1.00 0.00 N ATOM 1843 CA LEU A 108 11.762 24.719 6.775 1.00 0.00 C ATOM 1844 C LEU A 108 10.246 24.488 6.911 1.00 0.00 C ATOM 1845 O LEU A 108 9.816 23.532 7.559 1.00 0.00 O ATOM 1846 CB LEU A 108 12.459 23.572 5.956 1.00 0.00 C ATOM 1847 CG LEU A 108 12.289 23.551 4.383 1.00 0.00 C ATOM 1848 CD1 LEU A 108 10.871 23.158 3.928 1.00 0.00 C ATOM 1849 CD2 LEU A 108 12.715 24.891 3.749 1.00 0.00 C ATOM 0 H LEU A 108 12.761 23.935 8.450 1.00 0.00 H new ATOM 0 HA LEU A 108 11.944 25.642 6.225 1.00 0.00 H new ATOM 0 HB2 LEU A 108 13.526 23.613 6.173 1.00 0.00 H new ATOM 0 HB3 LEU A 108 12.092 22.621 6.341 1.00 0.00 H new ATOM 0 HG LEU A 108 12.959 22.769 4.024 1.00 0.00 H new ATOM 0 HD11 LEU A 108 10.824 23.163 2.839 1.00 0.00 H new ATOM 0 HD12 LEU A 108 10.634 22.160 4.297 1.00 0.00 H new ATOM 0 HD13 LEU A 108 10.150 23.872 4.326 1.00 0.00 H new ATOM 0 HD21 LEU A 108 12.585 24.840 2.668 1.00 0.00 H new ATOM 0 HD22 LEU A 108 12.099 25.696 4.151 1.00 0.00 H new ATOM 0 HD23 LEU A 108 13.762 25.086 3.979 1.00 0.00 H new ATOM 1861 N TRP A 109 9.458 25.399 6.342 1.00 0.00 N ATOM 1862 CA TRP A 109 7.992 25.284 6.257 1.00 0.00 C ATOM 1863 C TRP A 109 7.588 24.981 4.804 1.00 0.00 C ATOM 1864 O TRP A 109 8.344 25.256 3.868 1.00 0.00 O ATOM 1865 CB TRP A 109 7.318 26.592 6.741 1.00 0.00 C ATOM 1866 CG TRP A 109 7.493 26.901 8.209 1.00 0.00 C ATOM 1867 CD1 TRP A 109 8.650 27.240 8.850 1.00 0.00 C ATOM 1868 CD2 TRP A 109 6.463 26.925 9.210 1.00 0.00 C ATOM 1869 NE1 TRP A 109 8.410 27.459 10.180 1.00 0.00 N ATOM 1870 CE2 TRP A 109 7.075 27.275 10.427 1.00 0.00 C ATOM 1871 CE3 TRP A 109 5.084 26.678 9.190 1.00 0.00 C ATOM 1872 CZ2 TRP A 109 6.358 27.389 11.616 1.00 0.00 C ATOM 1873 CZ3 TRP A 109 4.372 26.793 10.370 1.00 0.00 C ATOM 1874 CH2 TRP A 109 5.010 27.146 11.571 1.00 0.00 C ATOM 0 H TRP A 109 9.820 26.253 5.919 1.00 0.00 H new ATOM 0 HA TRP A 109 7.658 24.470 6.901 1.00 0.00 H new ATOM 0 HB2 TRP A 109 7.718 27.424 6.161 1.00 0.00 H new ATOM 0 HB3 TRP A 109 6.252 26.535 6.523 1.00 0.00 H new ATOM 0 HD1 TRP A 109 9.617 27.323 8.376 1.00 0.00 H new ATOM 0 HE1 TRP A 109 9.111 27.717 10.874 1.00 0.00 H new ATOM 0 HE3 TRP A 109 4.587 26.403 8.271 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 6.847 27.659 12.540 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 3.308 26.608 10.368 1.00 0.00 H new ATOM 0 HH2 TRP A 109 4.427 27.227 12.476 1.00 0.00 H new ATOM 1885 N MET A 110 6.391 24.421 4.626 1.00 0.00 N ATOM 1886 CA MET A 110 5.872 24.026 3.306 1.00 0.00 C ATOM 1887 C MET A 110 4.360 24.259 3.239 1.00 0.00 C ATOM 1888 O MET A 110 3.620 23.842 4.119 1.00 0.00 O ATOM 1889 CB MET A 110 6.235 22.539 3.018 1.00 0.00 C ATOM 1890 CG MET A 110 5.984 21.572 4.187 1.00 0.00 C ATOM 1891 SD MET A 110 6.309 19.847 3.779 1.00 0.00 S ATOM 1892 CE MET A 110 4.968 19.507 2.642 1.00 0.00 C ATOM 0 H MET A 110 5.748 24.226 5.393 1.00 0.00 H new ATOM 0 HA MET A 110 6.335 24.642 2.536 1.00 0.00 H new ATOM 0 HB2 MET A 110 5.660 22.200 2.156 1.00 0.00 H new ATOM 0 HB3 MET A 110 7.288 22.485 2.740 1.00 0.00 H new ATOM 0 HG2 MET A 110 6.613 21.862 5.029 1.00 0.00 H new ATOM 0 HG3 MET A 110 4.949 21.671 4.513 1.00 0.00 H new ATOM 0 HE1 MET A 110 4.353 18.699 3.037 1.00 0.00 H new ATOM 0 HE2 MET A 110 4.358 20.402 2.521 1.00 0.00 H new ATOM 0 HE3 MET A 110 5.376 19.213 1.675 1.00 0.00 H new ATOM 1902 N ALA A 111 3.915 24.920 2.167 1.00 0.00 N ATOM 1903 CA ALA A 111 2.505 25.245 1.942 1.00 0.00 C ATOM 1904 C ALA A 111 1.927 24.302 0.895 1.00 0.00 C ATOM 1905 O ALA A 111 2.162 24.478 -0.298 1.00 0.00 O ATOM 1906 CB ALA A 111 2.377 26.700 1.484 1.00 0.00 C ATOM 0 H ALA A 111 4.531 25.248 1.423 1.00 0.00 H new ATOM 0 HA ALA A 111 1.948 25.123 2.871 1.00 0.00 H new ATOM 0 HB1 ALA A 111 1.326 26.938 1.318 1.00 0.00 H new ATOM 0 HB2 ALA A 111 2.781 27.360 2.251 1.00 0.00 H new ATOM 0 HB3 ALA A 111 2.932 26.840 0.556 1.00 0.00 H new ATOM 1912 N ILE A 112 1.171 23.309 1.357 1.00 0.00 N ATOM 1913 CA ILE A 112 0.508 22.334 0.485 1.00 0.00 C ATOM 1914 C ILE A 112 -0.814 22.937 0.002 1.00 0.00 C ATOM 1915 O ILE A 112 -1.684 23.224 0.825 1.00 0.00 O ATOM 1916 CB ILE A 112 0.210 20.992 1.251 1.00 0.00 C ATOM 1917 CG1 ILE A 112 1.471 20.460 2.003 1.00 0.00 C ATOM 1918 CG2 ILE A 112 -0.357 19.925 0.292 1.00 0.00 C ATOM 1919 CD1 ILE A 112 1.203 19.258 2.908 1.00 0.00 C ATOM 0 H ILE A 112 0.998 23.155 2.350 1.00 0.00 H new ATOM 0 HA ILE A 112 1.166 22.108 -0.354 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.547 21.208 2.005 1.00 0.00 H new ATOM 0 HG12 ILE A 112 2.229 20.186 1.269 1.00 0.00 H new ATOM 0 HG13 ILE A 112 1.888 21.267 2.605 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.555 19.007 0.845 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.284 20.289 -0.150 1.00 0.00 H new ATOM 0 HG23 ILE A 112 0.367 19.724 -0.498 1.00 0.00 H new ATOM 0 HD11 ILE A 112 2.131 18.953 3.392 1.00 0.00 H new ATOM 0 HD12 ILE A 112 0.471 19.531 3.668 1.00 0.00 H new ATOM 0 HD13 ILE A 112 0.816 18.432 2.311 1.00 0.00 H new ATOM 1931 N GLU A 113 -0.970 23.140 -1.315 1.00 0.00 N ATOM 1932 CA GLU A 113 -2.205 23.723 -1.861 1.00 0.00 C ATOM 1933 C GLU A 113 -3.267 22.628 -1.999 1.00 0.00 C ATOM 1934 O GLU A 113 -3.106 21.699 -2.762 1.00 0.00 O ATOM 1935 CB GLU A 113 -1.942 24.409 -3.224 1.00 0.00 C ATOM 1936 CG GLU A 113 -3.210 24.928 -3.934 1.00 0.00 C ATOM 1937 CD GLU A 113 -2.918 25.613 -5.273 1.00 0.00 C ATOM 1938 OE1 GLU A 113 -2.551 24.913 -6.242 1.00 0.00 O ATOM 1939 OE2 GLU A 113 -3.033 26.852 -5.367 1.00 0.00 O ATOM 0 H GLU A 113 -0.264 22.912 -2.015 1.00 0.00 H new ATOM 0 HA GLU A 113 -2.567 24.488 -1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -1.259 25.245 -3.070 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -1.437 23.701 -3.881 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -3.891 24.094 -4.102 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -3.723 25.632 -3.278 1.00 0.00 H new ATOM 1946 N LEU A 114 -4.325 22.718 -1.214 1.00 0.00 N ATOM 1947 CA LEU A 114 -5.470 21.802 -1.304 1.00 0.00 C ATOM 1948 C LEU A 114 -6.547 22.370 -2.234 1.00 0.00 C ATOM 1949 O LEU A 114 -6.863 23.560 -2.189 1.00 0.00 O ATOM 1950 CB LEU A 114 -6.042 21.499 0.118 1.00 0.00 C ATOM 1951 CG LEU A 114 -5.285 20.390 0.910 1.00 0.00 C ATOM 1952 CD1 LEU A 114 -5.269 19.098 0.096 1.00 0.00 C ATOM 1953 CD2 LEU A 114 -3.853 20.795 1.298 1.00 0.00 C ATOM 0 H LEU A 114 -4.424 23.429 -0.489 1.00 0.00 H new ATOM 0 HA LEU A 114 -5.129 20.860 -1.733 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -6.025 22.418 0.703 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -7.087 21.204 0.018 1.00 0.00 H new ATOM 0 HG LEU A 114 -5.825 20.238 1.844 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -4.739 18.324 0.652 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -6.293 18.774 -0.092 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -4.764 19.273 -0.854 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -3.381 19.980 1.847 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -3.278 21.007 0.397 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -3.884 21.685 1.926 1.00 0.00 H new ATOM 1965 N GLU A 115 -7.078 21.506 -3.103 1.00 0.00 N ATOM 1966 CA GLU A 115 -8.232 21.815 -3.954 1.00 0.00 C ATOM 1967 C GLU A 115 -9.165 20.606 -4.001 1.00 0.00 C ATOM 1968 O GLU A 115 -8.783 19.515 -3.557 1.00 0.00 O ATOM 1969 CB GLU A 115 -7.786 22.209 -5.384 1.00 0.00 C ATOM 1970 CG GLU A 115 -7.207 21.052 -6.223 1.00 0.00 C ATOM 1971 CD GLU A 115 -7.053 21.408 -7.710 1.00 0.00 C ATOM 1972 OE1 GLU A 115 -6.258 22.319 -8.039 1.00 0.00 O ATOM 1973 OE2 GLU A 115 -7.737 20.794 -8.558 1.00 0.00 O ATOM 0 H GLU A 115 -6.716 20.562 -3.238 1.00 0.00 H new ATOM 0 HA GLU A 115 -8.761 22.667 -3.528 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.641 22.630 -5.913 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -7.036 22.997 -5.311 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -6.234 20.769 -5.820 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.856 20.182 -6.129 1.00 0.00 H new ATOM 1980 N ASP A 116 -10.386 20.824 -4.535 1.00 0.00 N ATOM 1981 CA ASP A 116 -11.395 19.762 -4.766 1.00 0.00 C ATOM 1982 C ASP A 116 -11.656 18.971 -3.469 1.00 0.00 C ATOM 1983 O ASP A 116 -11.631 17.732 -3.432 1.00 0.00 O ATOM 1984 CB ASP A 116 -10.955 18.853 -5.960 1.00 0.00 C ATOM 1985 CG ASP A 116 -12.036 17.845 -6.411 1.00 0.00 C ATOM 1986 OD1 ASP A 116 -13.089 18.279 -6.936 1.00 0.00 O ATOM 1987 OD2 ASP A 116 -11.847 16.623 -6.240 1.00 0.00 O ATOM 0 H ASP A 116 -10.704 21.750 -4.821 1.00 0.00 H new ATOM 0 HA ASP A 116 -12.346 20.216 -5.046 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -10.687 19.486 -6.806 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -10.057 18.305 -5.675 1.00 0.00 H new ATOM 1992 N VAL A 117 -11.858 19.732 -2.386 1.00 0.00 N ATOM 1993 CA VAL A 117 -12.077 19.168 -1.062 1.00 0.00 C ATOM 1994 C VAL A 117 -13.454 18.483 -1.016 1.00 0.00 C ATOM 1995 O VAL A 117 -14.497 19.147 -1.058 1.00 0.00 O ATOM 1996 CB VAL A 117 -11.939 20.250 0.066 1.00 0.00 C ATOM 1997 CG1 VAL A 117 -12.116 19.618 1.463 1.00 0.00 C ATOM 1998 CG2 VAL A 117 -10.578 20.998 -0.037 1.00 0.00 C ATOM 0 H VAL A 117 -11.873 20.752 -2.410 1.00 0.00 H new ATOM 0 HA VAL A 117 -11.304 18.424 -0.873 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.734 20.982 -0.076 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -12.016 20.389 2.227 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -13.104 19.163 1.534 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -11.353 18.854 1.616 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.510 21.742 0.757 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.761 20.283 0.065 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.508 21.494 -1.005 1.00 0.00 H new ATOM 2008 N LYS A 118 -13.425 17.143 -0.993 1.00 0.00 N ATOM 2009 CA LYS A 118 -14.617 16.304 -1.061 1.00 0.00 C ATOM 2010 C LYS A 118 -15.089 15.952 0.352 1.00 0.00 C ATOM 2011 O LYS A 118 -14.454 15.149 1.038 1.00 0.00 O ATOM 2012 CB LYS A 118 -14.308 15.005 -1.870 1.00 0.00 C ATOM 2013 CG LYS A 118 -15.521 14.426 -2.633 1.00 0.00 C ATOM 2014 CD LYS A 118 -15.986 15.368 -3.772 1.00 0.00 C ATOM 2015 CE LYS A 118 -14.859 15.661 -4.785 1.00 0.00 C ATOM 2016 NZ LYS A 118 -15.268 16.619 -5.835 1.00 0.00 N ATOM 0 H LYS A 118 -12.558 16.610 -0.926 1.00 0.00 H new ATOM 0 HA LYS A 118 -15.411 16.852 -1.569 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -13.512 15.217 -2.584 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -13.929 14.246 -1.185 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.258 13.454 -3.050 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -16.344 14.263 -1.937 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -16.831 14.917 -4.292 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -16.340 16.306 -3.344 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -13.994 16.058 -4.254 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -14.545 14.728 -5.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -14.467 17.240 -6.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -15.562 16.097 -6.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -16.063 17.194 -5.490 1.00 0.00 H new ATOM 2030 N LYS A 119 -16.193 16.561 0.777 1.00 0.00 N ATOM 2031 CA LYS A 119 -16.813 16.261 2.077 1.00 0.00 C ATOM 2032 C LYS A 119 -17.400 14.839 2.052 1.00 0.00 C ATOM 2033 O LYS A 119 -18.209 14.518 1.175 1.00 0.00 O ATOM 2034 CB LYS A 119 -17.927 17.311 2.432 1.00 0.00 C ATOM 2035 CG LYS A 119 -17.567 18.309 3.560 1.00 0.00 C ATOM 2036 CD LYS A 119 -17.312 17.633 4.937 1.00 0.00 C ATOM 2037 CE LYS A 119 -18.492 16.763 5.428 1.00 0.00 C ATOM 2038 NZ LYS A 119 -18.352 16.364 6.847 1.00 0.00 N ATOM 0 H LYS A 119 -16.685 17.273 0.238 1.00 0.00 H new ATOM 0 HA LYS A 119 -16.046 16.321 2.849 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -18.168 17.878 1.532 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -18.830 16.773 2.721 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -16.677 18.867 3.269 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -18.376 19.032 3.665 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -16.418 17.013 4.868 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -17.107 18.405 5.679 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -19.423 17.314 5.299 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -18.562 15.869 4.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -19.268 16.025 7.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -17.646 15.604 6.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -18.043 17.183 7.409 1.00 0.00 H new ATOM 2052 N TYR A 120 -16.969 13.987 2.991 1.00 0.00 N ATOM 2053 CA TYR A 120 -17.598 12.681 3.198 1.00 0.00 C ATOM 2054 C TYR A 120 -18.969 12.899 3.847 1.00 0.00 C ATOM 2055 O TYR A 120 -19.060 13.120 5.059 1.00 0.00 O ATOM 2056 CB TYR A 120 -16.722 11.751 4.078 1.00 0.00 C ATOM 2057 CG TYR A 120 -15.375 11.332 3.470 1.00 0.00 C ATOM 2058 CD1 TYR A 120 -15.184 11.231 2.085 1.00 0.00 C ATOM 2059 CD2 TYR A 120 -14.302 11.003 4.294 1.00 0.00 C ATOM 2060 CE1 TYR A 120 -13.971 10.824 1.561 1.00 0.00 C ATOM 2061 CE2 TYR A 120 -13.094 10.602 3.770 1.00 0.00 C ATOM 2062 CZ TYR A 120 -12.932 10.513 2.413 1.00 0.00 C ATOM 2063 OH TYR A 120 -11.721 10.108 1.909 1.00 0.00 O ATOM 0 H TYR A 120 -16.188 14.181 3.618 1.00 0.00 H new ATOM 0 HA TYR A 120 -17.711 12.187 2.233 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -16.531 12.253 5.026 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -17.294 10.851 4.303 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -15.997 11.475 1.417 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -14.420 11.064 5.366 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -13.838 10.750 0.492 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -12.274 10.358 4.429 1.00 0.00 H new ATOM 0 HH TYR A 120 -11.669 10.339 0.958 1.00 0.00 H new ATOM 2073 N ASP A 121 -20.017 12.909 3.007 1.00 0.00 N ATOM 2074 CA ASP A 121 -21.418 13.008 3.456 1.00 0.00 C ATOM 2075 C ASP A 121 -21.790 11.771 4.293 1.00 0.00 C ATOM 2076 O ASP A 121 -22.594 11.852 5.224 1.00 0.00 O ATOM 2077 CB ASP A 121 -22.365 13.165 2.237 1.00 0.00 C ATOM 2078 CG ASP A 121 -22.114 14.461 1.443 1.00 0.00 C ATOM 2079 OD1 ASP A 121 -22.674 15.516 1.819 1.00 0.00 O ATOM 2080 OD2 ASP A 121 -21.352 14.436 0.450 1.00 0.00 O ATOM 0 H ASP A 121 -19.917 12.848 1.994 1.00 0.00 H new ATOM 0 HA ASP A 121 -21.531 13.892 4.084 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -22.240 12.309 1.574 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -23.399 13.152 2.583 1.00 0.00 H new ATOM 2085 N LYS A 122 -21.193 10.628 3.923 1.00 0.00 N ATOM 2086 CA LYS A 122 -21.232 9.396 4.719 1.00 0.00 C ATOM 2087 C LYS A 122 -20.071 9.413 5.748 1.00 0.00 C ATOM 2088 O LYS A 122 -18.956 9.835 5.409 1.00 0.00 O ATOM 2089 CB LYS A 122 -21.123 8.157 3.788 1.00 0.00 C ATOM 2090 CG LYS A 122 -19.839 8.090 2.922 1.00 0.00 C ATOM 2091 CD LYS A 122 -19.775 6.835 2.024 1.00 0.00 C ATOM 2092 CE LYS A 122 -20.908 6.785 0.977 1.00 0.00 C ATOM 2093 NZ LYS A 122 -20.822 5.575 0.124 1.00 0.00 N ATOM 0 H LYS A 122 -20.666 10.534 3.055 1.00 0.00 H new ATOM 0 HA LYS A 122 -22.179 9.336 5.255 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -21.176 7.257 4.401 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -21.989 8.143 3.126 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -19.784 8.980 2.295 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -18.967 8.106 3.575 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -18.813 6.810 1.512 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.826 5.944 2.650 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -21.872 6.803 1.485 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -20.862 7.675 0.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -21.601 5.580 -0.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -19.913 5.570 -0.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -20.892 4.725 0.719 1.00 0.00 H new ATOM 2107 N PRO A 123 -20.305 8.989 7.028 1.00 0.00 N ATOM 2108 CA PRO A 123 -19.225 8.884 8.032 1.00 0.00 C ATOM 2109 C PRO A 123 -18.310 7.672 7.732 1.00 0.00 C ATOM 2110 O PRO A 123 -18.716 6.515 7.900 1.00 0.00 O ATOM 2111 CB PRO A 123 -20.000 8.748 9.366 1.00 0.00 C ATOM 2112 CG PRO A 123 -21.295 8.090 8.985 1.00 0.00 C ATOM 2113 CD PRO A 123 -21.628 8.602 7.596 1.00 0.00 C ATOM 0 HA PRO A 123 -18.544 9.735 8.044 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -19.446 8.146 10.087 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -20.170 9.721 9.827 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -21.197 7.004 8.988 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -22.084 8.341 9.694 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -22.112 7.834 6.993 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -22.309 9.452 7.636 1.00 0.00 H new ATOM 2121 N ILE A 124 -17.097 7.949 7.215 1.00 0.00 N ATOM 2122 CA ILE A 124 -16.130 6.900 6.845 1.00 0.00 C ATOM 2123 C ILE A 124 -15.204 6.578 8.028 1.00 0.00 C ATOM 2124 O ILE A 124 -14.330 7.371 8.400 1.00 0.00 O ATOM 2125 CB ILE A 124 -15.306 7.274 5.555 1.00 0.00 C ATOM 2126 CG1 ILE A 124 -16.277 7.397 4.332 1.00 0.00 C ATOM 2127 CG2 ILE A 124 -14.165 6.247 5.280 1.00 0.00 C ATOM 2128 CD1 ILE A 124 -15.603 7.550 2.981 1.00 0.00 C ATOM 0 H ILE A 124 -16.763 8.897 7.044 1.00 0.00 H new ATOM 0 HA ILE A 124 -16.699 6.003 6.600 1.00 0.00 H new ATOM 0 HB ILE A 124 -14.822 8.237 5.718 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -16.913 6.512 4.304 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -16.930 8.255 4.493 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -13.620 6.540 4.382 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -13.481 6.227 6.129 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -14.595 5.256 5.136 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -16.362 7.627 2.202 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -14.990 8.451 2.980 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -14.972 6.682 2.789 1.00 0.00 H new ATOM 2140 N LYS A 125 -15.437 5.392 8.599 1.00 0.00 N ATOM 2141 CA LYS A 125 -14.684 4.855 9.739 1.00 0.00 C ATOM 2142 C LYS A 125 -13.291 4.377 9.273 1.00 0.00 C ATOM 2143 O LYS A 125 -13.173 3.783 8.189 1.00 0.00 O ATOM 2144 CB LYS A 125 -15.478 3.687 10.429 1.00 0.00 C ATOM 2145 CG LYS A 125 -16.687 4.126 11.306 1.00 0.00 C ATOM 2146 CD LYS A 125 -17.857 4.759 10.506 1.00 0.00 C ATOM 2147 CE LYS A 125 -18.637 5.815 11.310 1.00 0.00 C ATOM 2148 NZ LYS A 125 -19.228 5.283 12.565 1.00 0.00 N ATOM 0 H LYS A 125 -16.172 4.763 8.274 1.00 0.00 H new ATOM 0 HA LYS A 125 -14.550 5.647 10.476 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -15.840 3.010 9.655 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -14.787 3.119 11.052 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -17.061 3.258 11.850 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -16.340 4.843 12.050 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -17.463 5.219 9.600 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -18.542 3.972 10.191 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -17.970 6.642 11.553 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -19.433 6.221 10.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -19.739 6.043 13.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -19.889 4.513 12.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -18.471 4.920 13.179 1.00 0.00 H new ATOM 2162 N PRO A 126 -12.215 4.625 10.076 1.00 0.00 N ATOM 2163 CA PRO A 126 -10.843 4.247 9.706 1.00 0.00 C ATOM 2164 C PRO A 126 -10.502 2.802 10.117 1.00 0.00 C ATOM 2165 O PRO A 126 -11.270 2.146 10.834 1.00 0.00 O ATOM 2166 CB PRO A 126 -10.007 5.281 10.487 1.00 0.00 C ATOM 2167 CG PRO A 126 -10.778 5.514 11.754 1.00 0.00 C ATOM 2168 CD PRO A 126 -12.246 5.288 11.413 1.00 0.00 C ATOM 0 HA PRO A 126 -10.665 4.258 8.631 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -9.006 4.904 10.696 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -9.888 6.204 9.920 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -10.452 4.831 12.538 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -10.617 6.526 12.126 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -12.735 4.660 12.157 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -12.796 6.228 11.378 1.00 0.00 H new ATOM 2176 N LYS A 127 -9.346 2.315 9.638 1.00 0.00 N ATOM 2177 CA LYS A 127 -8.795 1.004 10.048 1.00 0.00 C ATOM 2178 C LYS A 127 -7.930 1.176 11.309 1.00 0.00 C ATOM 2179 O LYS A 127 -7.800 0.250 12.114 1.00 0.00 O ATOM 2180 CB LYS A 127 -7.965 0.332 8.903 1.00 0.00 C ATOM 2181 CG LYS A 127 -8.788 -0.216 7.705 1.00 0.00 C ATOM 2182 CD LYS A 127 -9.404 0.892 6.814 1.00 0.00 C ATOM 2183 CE LYS A 127 -10.212 0.322 5.632 1.00 0.00 C ATOM 2184 NZ LYS A 127 -10.771 1.395 4.769 1.00 0.00 N ATOM 0 H LYS A 127 -8.767 2.811 8.960 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.633 0.342 10.268 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -7.248 1.060 8.524 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -7.390 -0.489 9.331 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -8.145 -0.847 7.092 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -9.588 -0.851 8.085 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.053 1.523 7.422 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -8.607 1.529 6.431 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.571 -0.327 5.034 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -11.025 -0.296 6.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.307 0.968 3.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.403 1.999 5.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -9.995 1.970 4.383 1.00 0.00 H new ATOM 2198 N ARG A 128 -7.346 2.379 11.466 1.00 0.00 N ATOM 2199 CA ARG A 128 -6.490 2.723 12.614 1.00 0.00 C ATOM 2200 C ARG A 128 -6.692 4.187 13.013 1.00 0.00 C ATOM 2201 O ARG A 128 -7.250 4.988 12.252 1.00 0.00 O ATOM 2202 CB ARG A 128 -4.992 2.470 12.276 1.00 0.00 C ATOM 2203 CG ARG A 128 -4.414 3.393 11.170 1.00 0.00 C ATOM 2204 CD ARG A 128 -2.928 3.128 10.890 1.00 0.00 C ATOM 2205 NE ARG A 128 -2.072 3.528 12.025 1.00 0.00 N ATOM 2206 CZ ARG A 128 -1.135 2.766 12.608 1.00 0.00 C ATOM 2207 NH1 ARG A 128 -1.003 1.483 12.298 1.00 0.00 N ATOM 2208 NH2 ARG A 128 -0.351 3.294 13.526 1.00 0.00 N ATOM 0 H ARG A 128 -7.456 3.141 10.797 1.00 0.00 H new ATOM 0 HA ARG A 128 -6.774 2.086 13.451 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -4.402 2.599 13.183 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -4.874 1.433 11.963 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -4.983 3.251 10.251 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -4.543 4.434 11.468 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -2.782 2.068 10.681 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -2.624 3.674 9.997 1.00 0.00 H new ATOM 0 HE ARG A 128 -2.205 4.468 12.399 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -1.620 1.060 11.605 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -0.284 0.920 12.752 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -0.460 4.274 13.787 1.00 0.00 H new ATOM 0 HH22 ARG A 128 0.365 2.723 13.975 1.00 0.00 H new ATOM 2222 N LEU A 129 -6.194 4.514 14.207 1.00 0.00 N ATOM 2223 CA LEU A 129 -6.190 5.873 14.748 1.00 0.00 C ATOM 2224 C LEU A 129 -5.127 6.684 13.981 1.00 0.00 C ATOM 2225 O LEU A 129 -4.017 6.183 13.739 1.00 0.00 O ATOM 2226 CB LEU A 129 -5.882 5.819 16.288 1.00 0.00 C ATOM 2227 CG LEU A 129 -6.459 6.964 17.193 1.00 0.00 C ATOM 2228 CD1 LEU A 129 -5.861 8.348 16.881 1.00 0.00 C ATOM 2229 CD2 LEU A 129 -8.002 6.987 17.123 1.00 0.00 C ATOM 0 H LEU A 129 -5.775 3.829 14.836 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.160 6.354 14.624 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -6.256 4.870 16.671 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.799 5.808 16.412 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.158 6.736 18.215 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.303 9.093 17.542 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -4.782 8.321 17.035 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.074 8.611 15.845 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.383 7.788 17.757 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.317 7.158 16.094 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.396 6.031 17.469 1.00 0.00 H new ATOM 2241 N VAL A 130 -5.491 7.904 13.565 1.00 0.00 N ATOM 2242 CA VAL A 130 -4.548 8.861 12.960 1.00 0.00 C ATOM 2243 C VAL A 130 -4.158 9.908 14.033 1.00 0.00 C ATOM 2244 O VAL A 130 -4.957 10.806 14.329 1.00 0.00 O ATOM 2245 CB VAL A 130 -5.157 9.553 11.679 1.00 0.00 C ATOM 2246 CG1 VAL A 130 -4.165 10.562 11.038 1.00 0.00 C ATOM 2247 CG2 VAL A 130 -5.608 8.489 10.644 1.00 0.00 C ATOM 0 H VAL A 130 -6.445 8.257 13.637 1.00 0.00 H new ATOM 0 HA VAL A 130 -3.659 8.327 12.625 1.00 0.00 H new ATOM 0 HB VAL A 130 -6.032 10.119 11.999 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -4.624 11.015 10.159 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -3.919 11.340 11.761 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -3.255 10.040 10.743 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.025 8.987 9.769 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -4.751 7.886 10.345 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.366 7.845 11.091 1.00 0.00 H new ATOM 2257 N PRO A 131 -2.952 9.764 14.690 1.00 0.00 N ATOM 2258 CA PRO A 131 -2.459 10.731 15.721 1.00 0.00 C ATOM 2259 C PRO A 131 -2.101 12.101 15.114 1.00 0.00 C ATOM 2260 O PRO A 131 -2.145 12.263 13.895 1.00 0.00 O ATOM 2261 CB PRO A 131 -1.204 10.021 16.298 1.00 0.00 C ATOM 2262 CG PRO A 131 -0.728 9.152 15.174 1.00 0.00 C ATOM 2263 CD PRO A 131 -1.989 8.641 14.510 1.00 0.00 C ATOM 0 HA PRO A 131 -3.213 10.958 16.475 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -0.441 10.740 16.597 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -1.450 9.432 17.181 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -0.114 9.716 14.472 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -0.116 8.329 15.544 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -1.826 8.416 13.456 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -2.348 7.725 14.979 1.00 0.00 H new ATOM 2271 N VAL A 132 -1.714 13.068 15.979 1.00 0.00 N ATOM 2272 CA VAL A 132 -1.419 14.461 15.573 1.00 0.00 C ATOM 2273 C VAL A 132 -0.312 14.557 14.495 1.00 0.00 C ATOM 2274 O VAL A 132 -0.349 15.461 13.654 1.00 0.00 O ATOM 2275 CB VAL A 132 -1.051 15.352 16.819 1.00 0.00 C ATOM 2276 CG1 VAL A 132 -2.269 15.512 17.768 1.00 0.00 C ATOM 2277 CG2 VAL A 132 0.182 14.783 17.578 1.00 0.00 C ATOM 0 H VAL A 132 -1.598 12.903 16.979 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.335 14.844 15.122 1.00 0.00 H new ATOM 0 HB VAL A 132 -0.781 16.342 16.451 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -1.988 16.131 18.620 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -3.090 15.986 17.230 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.586 14.531 18.122 1.00 0.00 H new ATOM 0 HG21 VAL A 132 0.410 15.421 18.432 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -0.039 13.774 17.927 1.00 0.00 H new ATOM 0 HG23 VAL A 132 1.041 14.755 16.907 1.00 0.00 H new ATOM 2287 N GLY A 133 0.640 13.600 14.520 1.00 0.00 N ATOM 2288 CA GLY A 133 1.719 13.524 13.521 1.00 0.00 C ATOM 2289 C GLY A 133 1.229 13.126 12.126 1.00 0.00 C ATOM 2290 O GLY A 133 1.910 13.385 11.125 1.00 0.00 O ATOM 0 H GLY A 133 0.680 12.866 15.228 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.217 14.492 13.461 1.00 0.00 H new ATOM 0 HA3 GLY A 133 2.464 12.802 13.856 1.00 0.00 H new ATOM 2294 N GLY A 134 0.046 12.488 12.083 1.00 0.00 N ATOM 2295 CA GLY A 134 -0.609 12.088 10.839 1.00 0.00 C ATOM 2296 C GLY A 134 -0.128 10.729 10.336 1.00 0.00 C ATOM 2297 O GLY A 134 0.941 10.253 10.740 1.00 0.00 O ATOM 0 H GLY A 134 -0.481 12.237 12.920 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -1.687 12.053 10.995 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -0.421 12.842 10.075 1.00 0.00 H new ATOM 2301 N GLN A 135 -0.942 10.085 9.483 1.00 0.00 N ATOM 2302 CA GLN A 135 -0.612 8.790 8.841 1.00 0.00 C ATOM 2303 C GLN A 135 -0.488 8.980 7.324 1.00 0.00 C ATOM 2304 O GLN A 135 -1.081 9.900 6.761 1.00 0.00 O ATOM 2305 CB GLN A 135 -1.708 7.716 9.141 1.00 0.00 C ATOM 2306 CG GLN A 135 -1.862 7.320 10.621 1.00 0.00 C ATOM 2307 CD GLN A 135 -0.577 6.766 11.237 1.00 0.00 C ATOM 2308 OE1 GLN A 135 -0.300 5.575 11.154 1.00 0.00 O ATOM 2309 NE2 GLN A 135 0.208 7.628 11.864 1.00 0.00 N ATOM 0 H GLN A 135 -1.857 10.447 9.214 1.00 0.00 H new ATOM 0 HA GLN A 135 0.336 8.441 9.251 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -2.667 8.090 8.782 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -1.480 6.819 8.565 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -2.183 8.192 11.191 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -2.650 6.573 10.710 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -0.053 8.613 11.914 1.00 0.00 H new ATOM 0 HE22 GLN A 135 1.074 7.307 12.297 1.00 0.00 H new ATOM 2318 N TYR A 136 0.287 8.105 6.672 1.00 0.00 N ATOM 2319 CA TYR A 136 0.354 8.038 5.205 1.00 0.00 C ATOM 2320 C TYR A 136 -0.726 7.092 4.683 1.00 0.00 C ATOM 2321 O TYR A 136 -0.789 5.926 5.091 1.00 0.00 O ATOM 2322 CB TYR A 136 1.758 7.576 4.708 1.00 0.00 C ATOM 2323 CG TYR A 136 2.783 8.714 4.607 1.00 0.00 C ATOM 2324 CD1 TYR A 136 2.527 9.818 3.784 1.00 0.00 C ATOM 2325 CD2 TYR A 136 3.992 8.692 5.309 1.00 0.00 C ATOM 2326 CE1 TYR A 136 3.433 10.847 3.670 1.00 0.00 C ATOM 2327 CE2 TYR A 136 4.903 9.721 5.186 1.00 0.00 C ATOM 2328 CZ TYR A 136 4.616 10.793 4.367 1.00 0.00 C ATOM 2329 OH TYR A 136 5.531 11.796 4.219 1.00 0.00 O ATOM 0 H TYR A 136 0.884 7.425 7.143 1.00 0.00 H new ATOM 0 HA TYR A 136 0.183 9.042 4.816 1.00 0.00 H new ATOM 0 HB2 TYR A 136 2.141 6.814 5.386 1.00 0.00 H new ATOM 0 HB3 TYR A 136 1.651 7.108 3.730 1.00 0.00 H new ATOM 0 HD1 TYR A 136 1.602 9.862 3.229 1.00 0.00 H new ATOM 0 HD2 TYR A 136 4.216 7.857 5.957 1.00 0.00 H new ATOM 0 HE1 TYR A 136 3.215 11.693 3.036 1.00 0.00 H new ATOM 0 HE2 TYR A 136 5.836 9.687 5.728 1.00 0.00 H new ATOM 0 HH TYR A 136 5.187 12.462 3.588 1.00 0.00 H new ATOM 2339 N LEU A 137 -1.577 7.606 3.784 1.00 0.00 N ATOM 2340 CA LEU A 137 -2.557 6.789 3.075 1.00 0.00 C ATOM 2341 C LEU A 137 -1.867 6.300 1.798 1.00 0.00 C ATOM 2342 O LEU A 137 -1.476 7.102 0.950 1.00 0.00 O ATOM 2343 CB LEU A 137 -3.862 7.595 2.753 1.00 0.00 C ATOM 2344 CG LEU A 137 -5.216 6.789 2.786 1.00 0.00 C ATOM 2345 CD1 LEU A 137 -6.401 7.688 2.396 1.00 0.00 C ATOM 2346 CD2 LEU A 137 -5.182 5.513 1.906 1.00 0.00 C ATOM 0 H LEU A 137 -1.601 8.594 3.533 1.00 0.00 H new ATOM 0 HA LEU A 137 -2.879 5.949 3.691 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -3.938 8.418 3.464 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -3.753 8.038 1.763 1.00 0.00 H new ATOM 0 HG LEU A 137 -5.351 6.455 3.815 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -7.323 7.108 2.427 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -6.472 8.520 3.096 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -6.249 8.074 1.388 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -6.142 5.001 1.970 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -4.987 5.791 0.870 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -4.393 4.849 2.258 1.00 0.00 H new ATOM 2358 N ARG A 138 -1.689 4.992 1.686 1.00 0.00 N ATOM 2359 CA ARG A 138 -1.072 4.370 0.510 1.00 0.00 C ATOM 2360 C ARG A 138 -1.990 3.267 -0.007 1.00 0.00 C ATOM 2361 O ARG A 138 -2.597 2.540 0.796 1.00 0.00 O ATOM 2362 CB ARG A 138 0.365 3.841 0.812 1.00 0.00 C ATOM 2363 CG ARG A 138 0.507 2.590 1.708 1.00 0.00 C ATOM 2364 CD ARG A 138 0.076 2.815 3.166 1.00 0.00 C ATOM 2365 NE ARG A 138 0.379 1.648 4.015 1.00 0.00 N ATOM 2366 CZ ARG A 138 -0.390 1.186 5.018 1.00 0.00 C ATOM 2367 NH1 ARG A 138 -1.577 1.728 5.278 1.00 0.00 N ATOM 2368 NH2 ARG A 138 0.035 0.165 5.749 1.00 0.00 N ATOM 0 H ARG A 138 -1.967 4.325 2.406 1.00 0.00 H new ATOM 0 HA ARG A 138 -0.951 5.125 -0.267 1.00 0.00 H new ATOM 0 HB2 ARG A 138 0.848 3.625 -0.141 1.00 0.00 H new ATOM 0 HB3 ARG A 138 0.927 4.650 1.278 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -0.089 1.782 1.284 1.00 0.00 H new ATOM 0 HG3 ARG A 138 1.546 2.261 1.693 1.00 0.00 H new ATOM 0 HD2 ARG A 138 0.583 3.694 3.563 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -0.994 3.021 3.201 1.00 0.00 H new ATOM 0 HE ARG A 138 1.247 1.147 3.825 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -1.917 2.506 4.713 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -2.147 1.365 6.042 1.00 0.00 H new ATOM 0 HH21 ARG A 138 0.939 -0.264 5.549 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -0.542 -0.191 6.511 1.00 0.00 H new ATOM 2382 N GLU A 139 -2.120 3.162 -1.339 1.00 0.00 N ATOM 2383 CA GLU A 139 -2.986 2.142 -1.954 1.00 0.00 C ATOM 2384 C GLU A 139 -2.316 0.758 -1.771 1.00 0.00 C ATOM 2385 O GLU A 139 -1.181 0.590 -2.242 1.00 0.00 O ATOM 2386 CB GLU A 139 -3.238 2.486 -3.450 1.00 0.00 C ATOM 2387 CG GLU A 139 -4.499 1.865 -4.093 1.00 0.00 C ATOM 2388 CD GLU A 139 -4.421 0.351 -4.347 1.00 0.00 C ATOM 2389 OE1 GLU A 139 -3.506 -0.082 -5.079 1.00 0.00 O ATOM 2390 OE2 GLU A 139 -5.272 -0.407 -3.835 1.00 0.00 O ATOM 2391 OXT GLU A 139 -2.909 -0.137 -1.133 1.00 0.00 O ATOM 0 H GLU A 139 -1.641 3.766 -2.007 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.962 2.119 -1.470 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -3.304 3.570 -3.545 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -2.369 2.168 -4.025 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -5.354 2.066 -3.448 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -4.690 2.368 -5.041 1.00 0.00 H new