USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 758 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -111:sc= 0.117 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0.188 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl -164:sc= -1.2 (180deg=-2.04) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -168:sc= 0.623 (180deg=0.526) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0887 USER MOD Single : A 26 ASN : amide:sc= -1.66! C(o=-1.7!,f=-6.3!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0.177 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 35 ASN : amide:sc= -1.47 K(o=-1.5,f=-3.5!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -105:sc= -0.403 USER MOD Single : A 56 ASN : amide:sc= -0.0321 K(o=-0.032,f=-1.5) USER MOD Single : A 58 MET CE :methyl -133:sc= -2.11 (180deg=-8.17!) USER MOD Single : A 60 THR OG1 : rot -41:sc= 0.59 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot -81:sc= 0.0926 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HD1:sc= -1.05 K(o=-1.1,f=-1.7) USER MOD Single : A 82 LYS NZ :NH3+ 145:sc= -0.0361 (180deg=-0.55) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 100:sc= -2.03! USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 74:sc= 0.0402 USER MOD Single : A 92 LYS NZ :NH3+ 151:sc= -0.317 (180deg=-1.6!) USER MOD Single : A 95 ASN : amide:sc= -0.257 K(o=-0.26,f=-2.2!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 162:sc=-0.00132 (180deg=-0.391) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.396 1.202 -19.864 1.00 0.00 N ATOM 2 CA MET A 1 19.061 2.468 -19.223 1.00 0.00 C ATOM 3 C MET A 1 18.143 2.245 -18.025 1.00 0.00 C ATOM 4 O MET A 1 17.684 1.130 -17.783 1.00 0.00 O ATOM 5 CB MET A 1 18.392 3.410 -20.224 1.00 0.00 C ATOM 6 CG MET A 1 19.378 4.232 -21.039 1.00 0.00 C ATOM 7 SD MET A 1 18.592 5.099 -22.411 1.00 0.00 S ATOM 8 CE MET A 1 19.740 4.743 -23.739 1.00 0.00 C ATOM 0 H1 MET A 1 20.402 0.990 -19.708 1.00 0.00 H new ATOM 0 H2 MET A 1 18.814 0.442 -19.457 1.00 0.00 H new ATOM 0 H3 MET A 1 19.211 1.270 -20.885 1.00 0.00 H new ATOM 0 HA MET A 1 19.986 2.923 -18.870 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.772 2.824 -20.903 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.726 4.085 -19.686 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.866 4.957 -20.388 1.00 0.00 H new ATOM 0 HG3 MET A 1 20.158 3.577 -21.427 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.390 5.213 -24.658 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.725 5.134 -23.483 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.805 3.665 -23.885 1.00 0.00 H new ATOM 18 N ALA A 2 17.881 3.313 -17.278 1.00 0.00 N ATOM 19 CA ALA A 2 17.017 3.232 -16.107 1.00 0.00 C ATOM 20 C ALA A 2 15.873 4.237 -16.200 1.00 0.00 C ATOM 21 O ALA A 2 15.706 5.083 -15.321 1.00 0.00 O ATOM 22 CB ALA A 2 17.825 3.464 -14.839 1.00 0.00 C ATOM 0 H ALA A 2 18.255 4.244 -17.463 1.00 0.00 H new ATOM 0 HA ALA A 2 16.585 2.232 -16.071 1.00 0.00 H new ATOM 0 HB1 ALA A 2 17.168 3.401 -13.972 1.00 0.00 H new ATOM 0 HB2 ALA A 2 18.604 2.705 -14.760 1.00 0.00 H new ATOM 0 HB3 ALA A 2 18.283 4.452 -14.875 1.00 0.00 H new ATOM 28 N ARG A 3 15.090 4.137 -17.268 1.00 0.00 N ATOM 29 CA ARG A 3 13.962 5.039 -17.475 1.00 0.00 C ATOM 30 C ARG A 3 12.824 4.717 -16.511 1.00 0.00 C ATOM 31 O ARG A 3 12.949 3.840 -15.657 1.00 0.00 O ATOM 32 CB ARG A 3 13.465 4.944 -18.918 1.00 0.00 C ATOM 33 CG ARG A 3 14.494 5.384 -19.948 1.00 0.00 C ATOM 34 CD ARG A 3 14.898 6.836 -19.746 1.00 0.00 C ATOM 35 NE ARG A 3 16.043 6.966 -18.850 1.00 0.00 N ATOM 36 CZ ARG A 3 16.364 8.096 -18.228 1.00 0.00 C ATOM 37 NH1 ARG A 3 15.630 9.185 -18.404 1.00 0.00 N ATOM 38 NH2 ARG A 3 17.421 8.135 -17.427 1.00 0.00 N ATOM 0 H ARG A 3 15.215 3.441 -18.003 1.00 0.00 H new ATOM 0 HA ARG A 3 14.302 6.056 -17.281 1.00 0.00 H new ATOM 0 HB2 ARG A 3 13.173 3.915 -19.126 1.00 0.00 H new ATOM 0 HB3 ARG A 3 12.570 5.557 -19.026 1.00 0.00 H new ATOM 0 HG2 ARG A 3 15.376 4.747 -19.878 1.00 0.00 H new ATOM 0 HG3 ARG A 3 14.086 5.255 -20.950 1.00 0.00 H new ATOM 0 HD2 ARG A 3 15.140 7.282 -20.710 1.00 0.00 H new ATOM 0 HD3 ARG A 3 14.054 7.394 -19.339 1.00 0.00 H new ATOM 0 HE ARG A 3 16.628 6.146 -18.693 1.00 0.00 H new ATOM 0 HH11 ARG A 3 14.816 9.158 -19.018 1.00 0.00 H new ATOM 0 HH12 ARG A 3 15.879 10.051 -17.925 1.00 0.00 H new ATOM 0 HH21 ARG A 3 17.987 7.298 -17.289 1.00 0.00 H new ATOM 0 HH22 ARG A 3 17.667 9.002 -16.950 1.00 0.00 H new ATOM 52 N GLY A 4 11.714 5.434 -16.654 1.00 0.00 N ATOM 53 CA GLY A 4 10.570 5.210 -15.789 1.00 0.00 C ATOM 54 C GLY A 4 9.279 5.044 -16.567 1.00 0.00 C ATOM 55 O GLY A 4 8.202 5.377 -16.073 1.00 0.00 O ATOM 0 H GLY A 4 11.586 6.166 -17.353 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.744 4.319 -15.185 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.470 6.048 -15.099 1.00 0.00 H new ATOM 59 N SER A 5 9.388 4.527 -17.786 1.00 0.00 N ATOM 60 CA SER A 5 8.221 4.322 -18.636 1.00 0.00 C ATOM 61 C SER A 5 7.244 3.343 -17.991 1.00 0.00 C ATOM 62 O SER A 5 7.395 2.976 -16.825 1.00 0.00 O ATOM 63 CB SER A 5 8.648 3.802 -20.009 1.00 0.00 C ATOM 64 OG SER A 5 7.640 4.032 -20.979 1.00 0.00 O ATOM 0 H SER A 5 10.272 4.242 -18.207 1.00 0.00 H new ATOM 0 HA SER A 5 7.719 5.282 -18.759 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.571 4.293 -20.316 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.860 2.735 -19.947 1.00 0.00 H new ATOM 0 HG SER A 5 7.939 3.692 -21.848 1.00 0.00 H new ATOM 70 N VAL A 6 6.243 2.923 -18.757 1.00 0.00 N ATOM 71 CA VAL A 6 5.242 1.986 -18.263 1.00 0.00 C ATOM 72 C VAL A 6 4.459 1.359 -19.412 1.00 0.00 C ATOM 73 O VAL A 6 3.873 2.064 -20.233 1.00 0.00 O ATOM 74 CB VAL A 6 4.256 2.674 -17.300 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.583 3.857 -17.980 1.00 0.00 C ATOM 76 CG2 VAL A 6 3.222 1.679 -16.795 1.00 0.00 C ATOM 0 H VAL A 6 6.104 3.217 -19.724 1.00 0.00 H new ATOM 0 HA VAL A 6 5.779 1.205 -17.725 1.00 0.00 H new ATOM 0 HB VAL A 6 4.815 3.049 -16.442 1.00 0.00 H new ATOM 0 HG11 VAL A 6 2.890 4.330 -17.285 1.00 0.00 H new ATOM 0 HG12 VAL A 6 4.340 4.579 -18.287 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.036 3.510 -18.857 1.00 0.00 H new ATOM 0 HG21 VAL A 6 2.534 2.182 -16.116 1.00 0.00 H new ATOM 0 HG22 VAL A 6 2.666 1.272 -17.640 1.00 0.00 H new ATOM 0 HG23 VAL A 6 3.724 0.868 -16.267 1.00 0.00 H new ATOM 86 N SER A 7 4.454 0.032 -19.462 1.00 0.00 N ATOM 87 CA SER A 7 3.746 -0.691 -20.513 1.00 0.00 C ATOM 88 C SER A 7 2.244 -0.444 -20.423 1.00 0.00 C ATOM 89 O SER A 7 1.746 0.075 -19.424 1.00 0.00 O ATOM 90 CB SER A 7 4.036 -2.189 -20.415 1.00 0.00 C ATOM 91 OG SER A 7 5.398 -2.465 -20.693 1.00 0.00 O ATOM 0 H SER A 7 4.932 -0.565 -18.787 1.00 0.00 H new ATOM 0 HA SER A 7 4.100 -0.323 -21.476 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.786 -2.546 -19.416 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.402 -2.732 -21.116 1.00 0.00 H new ATOM 0 HG SER A 7 5.557 -3.429 -20.622 1.00 0.00 H new ATOM 97 N ASP A 8 1.525 -0.820 -21.475 1.00 0.00 N ATOM 98 CA ASP A 8 0.079 -0.642 -21.518 1.00 0.00 C ATOM 99 C ASP A 8 -0.595 -1.393 -20.373 1.00 0.00 C ATOM 100 O ASP A 8 -1.329 -0.804 -19.579 1.00 0.00 O ATOM 101 CB ASP A 8 -0.478 -1.125 -22.857 1.00 0.00 C ATOM 102 CG ASP A 8 0.243 -0.509 -24.040 1.00 0.00 C ATOM 103 OD1 ASP A 8 0.958 -1.247 -24.750 1.00 0.00 O ATOM 104 OD2 ASP A 8 0.093 0.712 -24.256 1.00 0.00 O ATOM 0 H ASP A 8 1.921 -1.251 -22.310 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.134 0.421 -21.408 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -0.397 -2.211 -22.911 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.539 -0.882 -22.915 1.00 0.00 H new ATOM 109 N GLU A 9 -0.340 -2.695 -20.295 1.00 0.00 N ATOM 110 CA GLU A 9 -0.923 -3.525 -19.248 1.00 0.00 C ATOM 111 C GLU A 9 -0.568 -2.987 -17.865 1.00 0.00 C ATOM 112 O GLU A 9 -1.449 -2.682 -17.062 1.00 0.00 O ATOM 113 CB GLU A 9 -0.441 -4.970 -19.384 1.00 0.00 C ATOM 114 CG GLU A 9 -0.844 -5.626 -20.695 1.00 0.00 C ATOM 115 CD GLU A 9 -2.256 -6.177 -20.661 1.00 0.00 C ATOM 116 OE1 GLU A 9 -2.509 -7.113 -19.873 1.00 0.00 O ATOM 117 OE2 GLU A 9 -3.109 -5.674 -21.422 1.00 0.00 O ATOM 0 H GLU A 9 0.266 -3.197 -20.944 1.00 0.00 H new ATOM 0 HA GLU A 9 -2.007 -3.499 -19.361 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.645 -4.992 -19.296 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.840 -5.557 -18.556 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.761 -4.898 -21.502 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.148 -6.434 -20.922 1.00 0.00 H new ATOM 124 N GLU A 10 0.729 -2.874 -17.596 1.00 0.00 N ATOM 125 CA GLU A 10 1.200 -2.374 -16.310 1.00 0.00 C ATOM 126 C GLU A 10 0.566 -1.025 -15.985 1.00 0.00 C ATOM 127 O GLU A 10 0.117 -0.793 -14.862 1.00 0.00 O ATOM 128 CB GLU A 10 2.725 -2.245 -16.315 1.00 0.00 C ATOM 129 CG GLU A 10 3.304 -1.803 -14.982 1.00 0.00 C ATOM 130 CD GLU A 10 4.111 -2.894 -14.305 1.00 0.00 C ATOM 131 OE1 GLU A 10 5.182 -2.578 -13.747 1.00 0.00 O ATOM 132 OE2 GLU A 10 3.671 -4.062 -14.334 1.00 0.00 O ATOM 0 H GLU A 10 1.471 -3.122 -18.251 1.00 0.00 H new ATOM 0 HA GLU A 10 0.905 -3.089 -15.542 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.161 -3.205 -16.590 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.018 -1.530 -17.084 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.939 -0.930 -15.137 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.493 -1.494 -14.323 1.00 0.00 H new ATOM 139 N MET A 11 0.535 -0.139 -16.975 1.00 0.00 N ATOM 140 CA MET A 11 -0.045 1.187 -16.794 1.00 0.00 C ATOM 141 C MET A 11 -1.493 1.088 -16.324 1.00 0.00 C ATOM 142 O MET A 11 -1.901 1.785 -15.395 1.00 0.00 O ATOM 143 CB MET A 11 0.026 1.980 -18.101 1.00 0.00 C ATOM 144 CG MET A 11 -0.611 3.357 -18.012 1.00 0.00 C ATOM 145 SD MET A 11 0.366 4.513 -17.032 1.00 0.00 S ATOM 146 CE MET A 11 -0.645 4.647 -15.559 1.00 0.00 C ATOM 0 H MET A 11 0.904 -0.315 -17.910 1.00 0.00 H new ATOM 0 HA MET A 11 0.532 1.707 -16.029 1.00 0.00 H new ATOM 0 HB2 MET A 11 1.070 2.090 -18.393 1.00 0.00 H new ATOM 0 HB3 MET A 11 -0.467 1.411 -18.889 1.00 0.00 H new ATOM 0 HG2 MET A 11 -0.741 3.758 -19.017 1.00 0.00 H new ATOM 0 HG3 MET A 11 -1.605 3.265 -17.574 1.00 0.00 H new ATOM 0 HE1 MET A 11 -0.338 5.522 -14.986 1.00 0.00 H new ATOM 0 HE2 MET A 11 -1.692 4.749 -15.844 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.520 3.752 -14.950 1.00 0.00 H new ATOM 156 N MET A 12 -2.262 0.220 -16.972 1.00 0.00 N ATOM 157 CA MET A 12 -3.665 0.032 -16.619 1.00 0.00 C ATOM 158 C MET A 12 -3.796 -0.623 -15.247 1.00 0.00 C ATOM 159 O MET A 12 -4.468 -0.096 -14.360 1.00 0.00 O ATOM 160 CB MET A 12 -4.368 -0.824 -17.674 1.00 0.00 C ATOM 161 CG MET A 12 -4.973 -0.014 -18.808 1.00 0.00 C ATOM 162 SD MET A 12 -5.831 -1.043 -20.016 1.00 0.00 S ATOM 163 CE MET A 12 -7.524 -0.514 -19.767 1.00 0.00 C ATOM 0 H MET A 12 -1.939 -0.364 -17.743 1.00 0.00 H new ATOM 0 HA MET A 12 -4.140 1.013 -16.582 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.654 -1.536 -18.088 1.00 0.00 H new ATOM 0 HB3 MET A 12 -5.155 -1.405 -17.193 1.00 0.00 H new ATOM 0 HG2 MET A 12 -5.671 0.715 -18.396 1.00 0.00 H new ATOM 0 HG3 MET A 12 -4.185 0.547 -19.309 1.00 0.00 H new ATOM 0 HE1 MET A 12 -8.180 -1.061 -20.444 1.00 0.00 H new ATOM 0 HE2 MET A 12 -7.819 -0.712 -18.737 1.00 0.00 H new ATOM 0 HE3 MET A 12 -7.605 0.554 -19.968 1.00 0.00 H new ATOM 173 N GLU A 13 -3.150 -1.772 -15.080 1.00 0.00 N ATOM 174 CA GLU A 13 -3.196 -2.498 -13.816 1.00 0.00 C ATOM 175 C GLU A 13 -2.768 -1.600 -12.658 1.00 0.00 C ATOM 176 O GLU A 13 -3.289 -1.710 -11.546 1.00 0.00 O ATOM 177 CB GLU A 13 -2.297 -3.734 -13.877 1.00 0.00 C ATOM 178 CG GLU A 13 -2.979 -4.953 -14.474 1.00 0.00 C ATOM 179 CD GLU A 13 -3.799 -5.720 -13.455 1.00 0.00 C ATOM 180 OE1 GLU A 13 -3.436 -6.874 -13.149 1.00 0.00 O ATOM 181 OE2 GLU A 13 -4.805 -5.165 -12.964 1.00 0.00 O ATOM 0 H GLU A 13 -2.588 -2.221 -15.804 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.225 -2.816 -13.647 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.410 -3.499 -14.466 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.956 -3.975 -12.870 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.626 -4.638 -15.293 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.225 -5.615 -14.900 1.00 0.00 H new ATOM 188 N LEU A 14 -1.815 -0.715 -12.925 1.00 0.00 N ATOM 189 CA LEU A 14 -1.314 0.201 -11.906 1.00 0.00 C ATOM 190 C LEU A 14 -2.309 1.329 -11.652 1.00 0.00 C ATOM 191 O LEU A 14 -2.787 1.508 -10.531 1.00 0.00 O ATOM 192 CB LEU A 14 0.035 0.783 -12.333 1.00 0.00 C ATOM 193 CG LEU A 14 1.260 -0.090 -12.054 1.00 0.00 C ATOM 194 CD1 LEU A 14 2.491 0.485 -12.737 1.00 0.00 C ATOM 195 CD2 LEU A 14 1.491 -0.221 -10.556 1.00 0.00 C ATOM 0 H LEU A 14 -1.373 -0.612 -13.839 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.184 -0.360 -10.981 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.003 0.990 -13.402 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.172 1.739 -11.828 1.00 0.00 H new ATOM 0 HG LEU A 14 1.075 -1.084 -12.461 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.353 -0.149 -12.528 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.324 0.526 -13.813 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.680 1.490 -12.360 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.366 -0.845 -10.376 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.655 0.767 -10.125 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.617 -0.679 -10.092 1.00 0.00 H new ATOM 207 N ARG A 15 -2.618 2.086 -12.700 1.00 0.00 N ATOM 208 CA ARG A 15 -3.557 3.196 -12.591 1.00 0.00 C ATOM 209 C ARG A 15 -4.876 2.734 -11.978 1.00 0.00 C ATOM 210 O ARG A 15 -5.506 3.465 -11.215 1.00 0.00 O ATOM 211 CB ARG A 15 -3.811 3.814 -13.966 1.00 0.00 C ATOM 212 CG ARG A 15 -4.926 3.134 -14.744 1.00 0.00 C ATOM 213 CD ARG A 15 -6.280 3.755 -14.434 1.00 0.00 C ATOM 214 NE ARG A 15 -7.231 3.564 -15.525 1.00 0.00 N ATOM 215 CZ ARG A 15 -8.498 3.961 -15.473 1.00 0.00 C ATOM 216 NH1 ARG A 15 -8.962 4.568 -14.389 1.00 0.00 N ATOM 217 NH2 ARG A 15 -9.303 3.752 -16.506 1.00 0.00 N ATOM 0 H ARG A 15 -2.232 1.951 -13.634 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.116 3.949 -11.938 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -4.058 4.868 -13.841 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -2.892 3.769 -14.550 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.725 3.211 -15.813 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -4.947 2.072 -14.499 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.681 3.314 -13.522 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -6.155 4.821 -14.244 1.00 0.00 H new ATOM 0 HE ARG A 15 -6.905 3.101 -16.373 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -8.346 4.731 -13.593 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -9.935 4.872 -14.352 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -8.950 3.286 -17.342 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -10.275 4.057 -16.465 1.00 0.00 H new ATOM 231 N GLU A 16 -5.287 1.516 -12.317 1.00 0.00 N ATOM 232 CA GLU A 16 -6.530 0.958 -11.801 1.00 0.00 C ATOM 233 C GLU A 16 -6.366 0.510 -10.351 1.00 0.00 C ATOM 234 O GLU A 16 -7.311 0.561 -9.564 1.00 0.00 O ATOM 235 CB GLU A 16 -6.982 -0.224 -12.663 1.00 0.00 C ATOM 236 CG GLU A 16 -6.436 -1.562 -12.195 1.00 0.00 C ATOM 237 CD GLU A 16 -7.290 -2.194 -11.112 1.00 0.00 C ATOM 238 OE1 GLU A 16 -6.776 -2.392 -9.992 1.00 0.00 O ATOM 239 OE2 GLU A 16 -8.472 -2.490 -11.386 1.00 0.00 O ATOM 0 H GLU A 16 -4.777 0.897 -12.947 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.290 1.738 -11.838 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.071 -0.266 -12.665 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.668 -0.053 -13.693 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -6.372 -2.241 -13.045 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -5.422 -1.425 -11.819 1.00 0.00 H new ATOM 246 N ALA A 17 -5.160 0.071 -10.007 1.00 0.00 N ATOM 247 CA ALA A 17 -4.869 -0.384 -8.653 1.00 0.00 C ATOM 248 C ALA A 17 -4.955 0.768 -7.657 1.00 0.00 C ATOM 249 O ALA A 17 -5.404 0.590 -6.524 1.00 0.00 O ATOM 250 CB ALA A 17 -3.495 -1.033 -8.597 1.00 0.00 C ATOM 0 H ALA A 17 -4.368 0.021 -10.648 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.619 -1.125 -8.376 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.292 -1.368 -7.580 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.469 -1.888 -9.272 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.738 -0.309 -8.899 1.00 0.00 H new ATOM 256 N PHE A 18 -4.519 1.948 -8.085 1.00 0.00 N ATOM 257 CA PHE A 18 -4.545 3.129 -7.230 1.00 0.00 C ATOM 258 C PHE A 18 -5.960 3.689 -7.119 1.00 0.00 C ATOM 259 O PHE A 18 -6.455 3.940 -6.021 1.00 0.00 O ATOM 260 CB PHE A 18 -3.600 4.201 -7.777 1.00 0.00 C ATOM 261 CG PHE A 18 -2.326 3.645 -8.344 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.597 2.697 -7.645 1.00 0.00 C ATOM 263 CD2 PHE A 18 -1.857 4.070 -9.577 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.424 2.183 -8.164 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.685 3.560 -10.101 1.00 0.00 C ATOM 266 CZ PHE A 18 0.033 2.615 -9.393 1.00 0.00 C ATOM 0 H PHE A 18 -4.143 2.112 -9.019 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.211 2.835 -6.235 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.116 4.768 -8.552 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.357 4.902 -6.978 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -1.950 2.356 -6.683 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.414 4.808 -10.135 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.135 1.444 -7.609 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.330 3.899 -11.063 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.950 2.215 -9.800 1.00 0.00 H new ATOM 276 N ALA A 19 -6.604 3.885 -8.265 1.00 0.00 N ATOM 277 CA ALA A 19 -7.962 4.415 -8.296 1.00 0.00 C ATOM 278 C ALA A 19 -8.925 3.503 -7.544 1.00 0.00 C ATOM 279 O ALA A 19 -9.996 3.931 -7.115 1.00 0.00 O ATOM 280 CB ALA A 19 -8.422 4.599 -9.735 1.00 0.00 C ATOM 0 H ALA A 19 -6.208 3.685 -9.183 1.00 0.00 H new ATOM 0 HA ALA A 19 -7.959 5.385 -7.799 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.437 4.995 -9.745 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.756 5.296 -10.244 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.403 3.638 -10.249 1.00 0.00 H new ATOM 286 N LYS A 20 -8.537 2.241 -7.387 1.00 0.00 N ATOM 287 CA LYS A 20 -9.365 1.268 -6.687 1.00 0.00 C ATOM 288 C LYS A 20 -9.553 1.665 -5.226 1.00 0.00 C ATOM 289 O LYS A 20 -10.677 1.878 -4.770 1.00 0.00 O ATOM 290 CB LYS A 20 -8.734 -0.123 -6.770 1.00 0.00 C ATOM 291 CG LYS A 20 -9.605 -1.145 -7.481 1.00 0.00 C ATOM 292 CD LYS A 20 -9.799 -0.788 -8.946 1.00 0.00 C ATOM 293 CE LYS A 20 -11.112 -1.338 -9.484 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.998 -2.772 -9.868 1.00 0.00 N ATOM 0 H LYS A 20 -7.654 1.869 -7.736 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.342 1.247 -7.169 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.778 -0.049 -7.289 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.522 -0.478 -5.761 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.148 -2.131 -7.403 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.575 -1.204 -6.988 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -9.782 0.296 -9.063 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.970 -1.185 -9.531 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.889 -1.225 -8.728 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -11.422 -0.754 -10.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.838 -3.054 -10.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.147 -2.909 -10.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.929 -3.357 -9.011 1.00 0.00 H new ATOM 308 N VAL A 21 -8.446 1.763 -4.496 1.00 0.00 N ATOM 309 CA VAL A 21 -8.489 2.138 -3.088 1.00 0.00 C ATOM 310 C VAL A 21 -8.947 3.581 -2.917 1.00 0.00 C ATOM 311 O VAL A 21 -9.329 3.997 -1.822 1.00 0.00 O ATOM 312 CB VAL A 21 -7.112 1.965 -2.419 1.00 0.00 C ATOM 313 CG1 VAL A 21 -6.808 0.492 -2.196 1.00 0.00 C ATOM 314 CG2 VAL A 21 -6.027 2.622 -3.259 1.00 0.00 C ATOM 0 H VAL A 21 -7.508 1.588 -4.857 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.206 1.473 -2.605 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.134 2.457 -1.446 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.831 0.390 -1.723 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.571 0.057 -1.551 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.803 -0.028 -3.154 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.061 2.491 -2.772 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -6.002 2.161 -4.246 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.240 3.686 -3.361 1.00 0.00 H new ATOM 324 N ASP A 22 -8.909 4.342 -4.005 1.00 0.00 N ATOM 325 CA ASP A 22 -9.323 5.740 -3.977 1.00 0.00 C ATOM 326 C ASP A 22 -10.830 5.856 -3.776 1.00 0.00 C ATOM 327 O ASP A 22 -11.591 5.957 -4.739 1.00 0.00 O ATOM 328 CB ASP A 22 -8.911 6.442 -5.272 1.00 0.00 C ATOM 329 CG ASP A 22 -7.467 6.899 -5.250 1.00 0.00 C ATOM 330 OD1 ASP A 22 -6.907 7.149 -6.338 1.00 0.00 O ATOM 331 OD2 ASP A 22 -6.896 7.007 -4.145 1.00 0.00 O ATOM 0 H ASP A 22 -8.595 4.014 -4.918 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.825 6.225 -3.137 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -9.062 5.764 -6.112 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.559 7.303 -5.437 1.00 0.00 H new ATOM 336 N THR A 23 -11.257 5.843 -2.517 1.00 0.00 N ATOM 337 CA THR A 23 -12.673 5.946 -2.189 1.00 0.00 C ATOM 338 C THR A 23 -13.198 7.353 -2.453 1.00 0.00 C ATOM 339 O THR A 23 -14.400 7.552 -2.640 1.00 0.00 O ATOM 340 CB THR A 23 -12.937 5.579 -0.716 1.00 0.00 C ATOM 341 OG1 THR A 23 -11.796 5.913 0.084 1.00 0.00 O ATOM 342 CG2 THR A 23 -13.247 4.097 -0.574 1.00 0.00 C ATOM 0 H THR A 23 -10.642 5.762 -1.708 1.00 0.00 H new ATOM 0 HA THR A 23 -13.198 5.239 -2.831 1.00 0.00 H new ATOM 0 HB THR A 23 -13.801 6.148 -0.372 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.972 5.678 1.019 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.430 3.862 0.475 1.00 0.00 H new ATOM 0 HG22 THR A 23 -14.133 3.853 -1.160 1.00 0.00 H new ATOM 0 HG23 THR A 23 -12.401 3.512 -0.935 1.00 0.00 H new ATOM 350 N ASP A 24 -12.293 8.324 -2.468 1.00 0.00 N ATOM 351 CA ASP A 24 -12.665 9.712 -2.711 1.00 0.00 C ATOM 352 C ASP A 24 -12.214 10.162 -4.098 1.00 0.00 C ATOM 353 O ASP A 24 -12.605 11.226 -4.575 1.00 0.00 O ATOM 354 CB ASP A 24 -12.054 10.622 -1.644 1.00 0.00 C ATOM 355 CG ASP A 24 -10.653 10.195 -1.253 1.00 0.00 C ATOM 356 OD1 ASP A 24 -10.282 10.380 -0.075 1.00 0.00 O ATOM 357 OD2 ASP A 24 -9.927 9.673 -2.125 1.00 0.00 O ATOM 0 H ASP A 24 -11.296 8.176 -2.315 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.751 9.784 -2.660 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -12.028 11.646 -2.016 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.692 10.620 -0.760 1.00 0.00 H new ATOM 362 N GLY A 25 -11.387 9.341 -4.740 1.00 0.00 N ATOM 363 CA GLY A 25 -10.896 9.672 -6.065 1.00 0.00 C ATOM 364 C GLY A 25 -10.021 10.910 -6.067 1.00 0.00 C ATOM 365 O GLY A 25 -10.330 11.895 -6.735 1.00 0.00 O ATOM 0 H GLY A 25 -11.049 8.454 -4.366 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.329 8.829 -6.460 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.742 9.828 -6.734 1.00 0.00 H new ATOM 369 N ASN A 26 -8.925 10.860 -5.315 1.00 0.00 N ATOM 370 CA ASN A 26 -8.005 11.987 -5.232 1.00 0.00 C ATOM 371 C ASN A 26 -6.666 11.646 -5.879 1.00 0.00 C ATOM 372 O ASN A 26 -5.736 12.451 -5.870 1.00 0.00 O ATOM 373 CB ASN A 26 -7.789 12.388 -3.771 1.00 0.00 C ATOM 374 CG ASN A 26 -7.529 11.193 -2.875 1.00 0.00 C ATOM 375 OD1 ASN A 26 -7.158 10.118 -3.347 1.00 0.00 O ATOM 376 ND2 ASN A 26 -7.724 11.376 -1.574 1.00 0.00 N ATOM 0 H ASN A 26 -8.654 10.051 -4.755 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.447 12.825 -5.772 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -6.946 13.077 -3.707 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.667 12.924 -3.411 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -7.566 10.608 -0.922 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -8.032 12.285 -1.227 1.00 0.00 H new ATOM 383 N GLY A 27 -6.577 10.445 -6.444 1.00 0.00 N ATOM 384 CA GLY A 27 -5.349 10.018 -7.089 1.00 0.00 C ATOM 385 C GLY A 27 -4.196 9.893 -6.115 1.00 0.00 C ATOM 386 O GLY A 27 -3.033 9.863 -6.519 1.00 0.00 O ATOM 0 H GLY A 27 -7.333 9.761 -6.466 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.514 9.058 -7.577 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.085 10.731 -7.870 1.00 0.00 H new ATOM 390 N TYR A 28 -4.515 9.821 -4.827 1.00 0.00 N ATOM 391 CA TYR A 28 -3.495 9.703 -3.793 1.00 0.00 C ATOM 392 C TYR A 28 -3.781 8.513 -2.881 1.00 0.00 C ATOM 393 O TYR A 28 -4.914 8.041 -2.795 1.00 0.00 O ATOM 394 CB TYR A 28 -3.427 10.988 -2.965 1.00 0.00 C ATOM 395 CG TYR A 28 -2.517 12.041 -3.557 1.00 0.00 C ATOM 396 CD1 TYR A 28 -3.037 13.202 -4.114 1.00 0.00 C ATOM 397 CD2 TYR A 28 -1.138 11.874 -3.561 1.00 0.00 C ATOM 398 CE1 TYR A 28 -2.210 14.167 -4.656 1.00 0.00 C ATOM 399 CE2 TYR A 28 -0.304 12.833 -4.099 1.00 0.00 C ATOM 400 CZ TYR A 28 -0.845 13.978 -4.646 1.00 0.00 C ATOM 401 OH TYR A 28 -0.016 14.935 -5.185 1.00 0.00 O ATOM 0 H TYR A 28 -5.472 9.842 -4.475 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.534 9.542 -4.282 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.431 11.401 -2.867 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -3.082 10.745 -1.960 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.106 13.353 -4.124 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -0.711 10.978 -3.136 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -2.631 15.064 -5.085 1.00 0.00 H new ATOM 0 HE2 TYR A 28 0.766 12.688 -4.092 1.00 0.00 H new ATOM 0 HH TYR A 28 0.917 14.647 -5.096 1.00 0.00 H new ATOM 411 N ILE A 29 -2.743 8.033 -2.203 1.00 0.00 N ATOM 412 CA ILE A 29 -2.881 6.901 -1.297 1.00 0.00 C ATOM 413 C ILE A 29 -2.116 7.138 0.001 1.00 0.00 C ATOM 414 O ILE A 29 -0.921 7.434 -0.015 1.00 0.00 O ATOM 415 CB ILE A 29 -2.378 5.597 -1.944 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.210 5.263 -3.183 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.426 4.454 -0.942 1.00 0.00 C ATOM 418 CD1 ILE A 29 -2.720 4.042 -3.929 1.00 0.00 C ATOM 0 H ILE A 29 -1.798 8.411 -2.265 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.944 6.802 -1.077 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.342 5.739 -2.253 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.246 5.104 -2.883 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.201 6.119 -3.858 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.067 3.540 -1.415 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.793 4.693 -0.087 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.452 4.309 -0.604 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.357 3.865 -4.796 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.694 4.205 -4.260 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.755 3.175 -3.270 1.00 0.00 H new ATOM 430 N SER A 30 -2.813 7.005 1.125 1.00 0.00 N ATOM 431 CA SER A 30 -2.200 7.207 2.433 1.00 0.00 C ATOM 432 C SER A 30 -1.875 5.871 3.093 1.00 0.00 C ATOM 433 O SER A 30 -1.980 4.815 2.469 1.00 0.00 O ATOM 434 CB SER A 30 -3.130 8.022 3.335 1.00 0.00 C ATOM 435 OG SER A 30 -4.034 7.180 4.029 1.00 0.00 O ATOM 0 H SER A 30 -3.802 6.758 1.156 1.00 0.00 H new ATOM 0 HA SER A 30 -1.270 7.757 2.290 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.539 8.594 4.050 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.686 8.741 2.734 1.00 0.00 H new ATOM 0 HG SER A 30 -4.616 7.724 4.600 1.00 0.00 H new ATOM 441 N PHE A 31 -1.480 5.925 4.361 1.00 0.00 N ATOM 442 CA PHE A 31 -1.139 4.719 5.107 1.00 0.00 C ATOM 443 C PHE A 31 -2.398 4.006 5.594 1.00 0.00 C ATOM 444 O PHE A 31 -2.385 2.800 5.835 1.00 0.00 O ATOM 445 CB PHE A 31 -0.244 5.068 6.299 1.00 0.00 C ATOM 446 CG PHE A 31 -0.273 4.039 7.392 1.00 0.00 C ATOM 447 CD1 PHE A 31 0.632 2.990 7.398 1.00 0.00 C ATOM 448 CD2 PHE A 31 -1.206 4.120 8.413 1.00 0.00 C ATOM 449 CE1 PHE A 31 0.609 2.041 8.403 1.00 0.00 C ATOM 450 CE2 PHE A 31 -1.234 3.173 9.420 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.327 2.133 9.415 1.00 0.00 C ATOM 0 H PHE A 31 -1.388 6.790 4.893 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.599 4.049 4.439 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.782 5.187 5.950 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.555 6.029 6.708 1.00 0.00 H new ATOM 0 HD1 PHE A 31 1.364 2.913 6.608 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.919 4.931 8.422 1.00 0.00 H new ATOM 0 HE1 PHE A 31 1.321 1.229 8.397 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.966 3.247 10.211 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.349 1.392 10.201 1.00 0.00 H new ATOM 461 N ASN A 32 -3.482 4.762 5.734 1.00 0.00 N ATOM 462 CA ASN A 32 -4.748 4.202 6.194 1.00 0.00 C ATOM 463 C ASN A 32 -5.284 3.181 5.195 1.00 0.00 C ATOM 464 O ASN A 32 -5.452 2.007 5.525 1.00 0.00 O ATOM 465 CB ASN A 32 -5.776 5.317 6.400 1.00 0.00 C ATOM 466 CG ASN A 32 -5.645 5.978 7.759 1.00 0.00 C ATOM 467 OD1 ASN A 32 -4.564 6.423 8.144 1.00 0.00 O ATOM 468 ND2 ASN A 32 -6.750 6.046 8.493 1.00 0.00 N ATOM 0 H ASN A 32 -3.510 5.762 5.536 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.572 3.698 7.144 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -5.655 6.069 5.620 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -6.780 4.906 6.294 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -6.724 6.480 9.416 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -7.625 5.664 8.134 1.00 0.00 H new ATOM 475 N GLU A 33 -5.551 3.635 3.976 1.00 0.00 N ATOM 476 CA GLU A 33 -6.068 2.760 2.930 1.00 0.00 C ATOM 477 C GLU A 33 -5.070 1.652 2.606 1.00 0.00 C ATOM 478 O GLU A 33 -5.455 0.551 2.207 1.00 0.00 O ATOM 479 CB GLU A 33 -6.381 3.566 1.668 1.00 0.00 C ATOM 480 CG GLU A 33 -5.213 4.403 1.176 1.00 0.00 C ATOM 481 CD GLU A 33 -5.646 5.513 0.237 1.00 0.00 C ATOM 482 OE1 GLU A 33 -6.134 5.198 -0.869 1.00 0.00 O ATOM 483 OE2 GLU A 33 -5.496 6.696 0.607 1.00 0.00 O ATOM 0 H GLU A 33 -5.418 4.604 3.687 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.987 2.302 3.296 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.686 2.882 0.876 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -7.229 4.222 1.867 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.696 4.837 2.032 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.498 3.758 0.665 1.00 0.00 H new ATOM 490 N LEU A 34 -3.788 1.950 2.779 1.00 0.00 N ATOM 491 CA LEU A 34 -2.733 0.980 2.504 1.00 0.00 C ATOM 492 C LEU A 34 -2.847 -0.226 3.431 1.00 0.00 C ATOM 493 O LEU A 34 -3.055 -1.351 2.979 1.00 0.00 O ATOM 494 CB LEU A 34 -1.358 1.632 2.664 1.00 0.00 C ATOM 495 CG LEU A 34 -0.669 2.073 1.372 1.00 0.00 C ATOM 496 CD1 LEU A 34 0.609 2.835 1.681 1.00 0.00 C ATOM 497 CD2 LEU A 34 -0.375 0.869 0.488 1.00 0.00 C ATOM 0 H LEU A 34 -3.453 2.855 3.108 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.848 0.637 1.476 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.464 2.503 3.311 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.703 0.930 3.180 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.342 2.740 0.833 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.085 3.140 0.749 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.372 3.718 2.274 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.288 2.193 2.242 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.115 1.201 -0.427 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.279 0.178 1.020 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.308 0.365 0.237 1.00 0.00 H new ATOM 509 N ASN A 35 -2.712 0.018 4.731 1.00 0.00 N ATOM 510 CA ASN A 35 -2.801 -1.047 5.722 1.00 0.00 C ATOM 511 C ASN A 35 -4.145 -1.765 5.629 1.00 0.00 C ATOM 512 O ASN A 35 -4.207 -2.995 5.666 1.00 0.00 O ATOM 513 CB ASN A 35 -2.610 -0.480 7.130 1.00 0.00 C ATOM 514 CG ASN A 35 -2.292 -1.557 8.149 1.00 0.00 C ATOM 515 OD1 ASN A 35 -1.171 -1.639 8.653 1.00 0.00 O ATOM 516 ND2 ASN A 35 -3.279 -2.391 8.457 1.00 0.00 N ATOM 0 H ASN A 35 -2.541 0.944 5.122 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.009 -1.767 5.517 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.804 0.253 7.117 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.515 0.047 7.432 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.124 -3.136 9.136 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -4.192 -2.286 8.015 1.00 0.00 H new ATOM 523 N ASP A 36 -5.216 -0.990 5.507 1.00 0.00 N ATOM 524 CA ASP A 36 -6.559 -1.551 5.407 1.00 0.00 C ATOM 525 C ASP A 36 -6.686 -2.437 4.172 1.00 0.00 C ATOM 526 O ASP A 36 -7.281 -3.514 4.226 1.00 0.00 O ATOM 527 CB ASP A 36 -7.600 -0.433 5.358 1.00 0.00 C ATOM 528 CG ASP A 36 -9.003 -0.935 5.633 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.877 -0.766 4.756 1.00 0.00 O ATOM 530 OD2 ASP A 36 -9.228 -1.497 6.725 1.00 0.00 O ATOM 0 H ASP A 36 -5.181 0.029 5.475 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.738 -2.163 6.291 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.341 0.332 6.090 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.573 0.042 4.377 1.00 0.00 H new ATOM 535 N LEU A 37 -6.126 -1.975 3.059 1.00 0.00 N ATOM 536 CA LEU A 37 -6.178 -2.726 1.809 1.00 0.00 C ATOM 537 C LEU A 37 -5.430 -4.049 1.936 1.00 0.00 C ATOM 538 O LEU A 37 -5.845 -5.064 1.376 1.00 0.00 O ATOM 539 CB LEU A 37 -5.580 -1.897 0.669 1.00 0.00 C ATOM 540 CG LEU A 37 -5.598 -2.548 -0.714 1.00 0.00 C ATOM 541 CD1 LEU A 37 -4.391 -3.455 -0.893 1.00 0.00 C ATOM 542 CD2 LEU A 37 -6.889 -3.329 -0.920 1.00 0.00 C ATOM 0 H LEU A 37 -5.631 -1.085 2.997 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.223 -2.941 1.586 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.121 -0.952 0.611 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.547 -1.658 0.923 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.549 -1.760 -1.465 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.421 -3.909 -1.883 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.477 -2.869 -0.790 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.408 -4.237 -0.134 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.884 -3.785 -1.910 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.968 -4.108 -0.162 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.740 -2.653 -0.836 1.00 0.00 H new ATOM 554 N PHE A 38 -4.329 -4.032 2.678 1.00 0.00 N ATOM 555 CA PHE A 38 -3.525 -5.232 2.882 1.00 0.00 C ATOM 556 C PHE A 38 -4.149 -6.132 3.943 1.00 0.00 C ATOM 557 O PHE A 38 -3.965 -7.349 3.928 1.00 0.00 O ATOM 558 CB PHE A 38 -2.100 -4.853 3.291 1.00 0.00 C ATOM 559 CG PHE A 38 -1.409 -3.959 2.302 1.00 0.00 C ATOM 560 CD1 PHE A 38 -0.511 -2.994 2.727 1.00 0.00 C ATOM 561 CD2 PHE A 38 -1.658 -4.085 0.944 1.00 0.00 C ATOM 562 CE1 PHE A 38 0.128 -2.171 1.820 1.00 0.00 C ATOM 563 CE2 PHE A 38 -1.022 -3.265 0.030 1.00 0.00 C ATOM 564 CZ PHE A 38 -0.130 -2.306 0.469 1.00 0.00 C ATOM 0 H PHE A 38 -3.972 -3.200 3.149 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.492 -5.781 1.941 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.129 -4.355 4.260 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.513 -5.763 3.418 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.308 -2.883 3.782 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.356 -4.832 0.596 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.827 -1.424 2.166 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -1.222 -3.374 -1.026 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.365 -1.662 -0.243 1.00 0.00 H new ATOM 574 N LYS A 39 -4.889 -5.524 4.865 1.00 0.00 N ATOM 575 CA LYS A 39 -5.542 -6.269 5.935 1.00 0.00 C ATOM 576 C LYS A 39 -6.826 -6.925 5.436 1.00 0.00 C ATOM 577 O LYS A 39 -7.147 -8.050 5.818 1.00 0.00 O ATOM 578 CB LYS A 39 -5.855 -5.342 7.112 1.00 0.00 C ATOM 579 CG LYS A 39 -5.061 -5.663 8.367 1.00 0.00 C ATOM 580 CD LYS A 39 -5.733 -6.749 9.190 1.00 0.00 C ATOM 581 CE LYS A 39 -6.411 -6.173 10.424 1.00 0.00 C ATOM 582 NZ LYS A 39 -7.889 -6.101 10.260 1.00 0.00 N ATOM 0 H LYS A 39 -5.051 -4.517 4.892 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.860 -7.052 6.268 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.652 -4.313 6.817 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.919 -5.404 7.340 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.056 -5.984 8.091 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -4.953 -4.762 8.971 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -6.470 -7.268 8.577 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -4.992 -7.489 9.492 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.171 -6.788 11.291 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -6.018 -5.176 10.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -8.315 -5.703 11.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -8.119 -5.493 9.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.267 -7.056 10.096 1.00 0.00 H new ATOM 596 N ALA A 40 -7.553 -6.215 4.581 1.00 0.00 N ATOM 597 CA ALA A 40 -8.800 -6.731 4.028 1.00 0.00 C ATOM 598 C ALA A 40 -8.584 -8.081 3.352 1.00 0.00 C ATOM 599 O ALA A 40 -9.506 -8.889 3.250 1.00 0.00 O ATOM 600 CB ALA A 40 -9.392 -5.734 3.041 1.00 0.00 C ATOM 0 H ALA A 40 -7.301 -5.282 4.256 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.502 -6.873 4.850 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.322 -6.132 2.636 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.592 -4.792 3.551 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.686 -5.564 2.228 1.00 0.00 H new ATOM 606 N ALA A 41 -7.360 -8.318 2.891 1.00 0.00 N ATOM 607 CA ALA A 41 -7.023 -9.570 2.227 1.00 0.00 C ATOM 608 C ALA A 41 -7.344 -10.767 3.115 1.00 0.00 C ATOM 609 O ALA A 41 -7.641 -11.855 2.623 1.00 0.00 O ATOM 610 CB ALA A 41 -5.553 -9.581 1.836 1.00 0.00 C ATOM 0 H ALA A 41 -6.585 -7.658 2.966 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.629 -9.648 1.324 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.315 -10.522 1.341 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.351 -8.753 1.157 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.938 -9.476 2.730 1.00 0.00 H new ATOM 616 N CYS A 42 -7.283 -10.558 4.426 1.00 0.00 N ATOM 617 CA CYS A 42 -7.567 -11.621 5.383 1.00 0.00 C ATOM 618 C CYS A 42 -6.761 -12.875 5.059 1.00 0.00 C ATOM 619 O CYS A 42 -7.309 -13.876 4.595 1.00 0.00 O ATOM 620 CB CYS A 42 -9.061 -11.948 5.387 1.00 0.00 C ATOM 621 SG CYS A 42 -10.086 -10.710 6.215 1.00 0.00 S ATOM 0 H CYS A 42 -7.040 -9.663 4.850 1.00 0.00 H new ATOM 0 HA CYS A 42 -7.277 -11.270 6.373 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -9.401 -12.056 4.357 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -9.210 -12.912 5.874 1.00 0.00 H new ATOM 0 HG CYS A 42 -11.333 -11.074 6.164 1.00 0.00 H new ATOM 627 N LEU A 43 -5.457 -12.813 5.304 1.00 0.00 N ATOM 628 CA LEU A 43 -4.573 -13.943 5.037 1.00 0.00 C ATOM 629 C LEU A 43 -3.976 -14.485 6.331 1.00 0.00 C ATOM 630 O LEU A 43 -3.930 -13.803 7.356 1.00 0.00 O ATOM 631 CB LEU A 43 -3.455 -13.525 4.080 1.00 0.00 C ATOM 632 CG LEU A 43 -3.609 -13.981 2.628 1.00 0.00 C ATOM 633 CD1 LEU A 43 -4.923 -13.483 2.049 1.00 0.00 C ATOM 634 CD2 LEU A 43 -2.436 -13.494 1.790 1.00 0.00 C ATOM 0 H LEU A 43 -4.988 -11.992 5.687 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.163 -14.733 4.573 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.381 -12.438 4.092 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.511 -13.913 4.464 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.617 -15.071 2.608 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.015 -13.817 1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.752 -13.881 2.634 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.945 -12.394 2.082 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.562 -13.827 0.760 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.397 -12.405 1.817 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.508 -13.900 2.192 1.00 0.00 H new ATOM 646 N PRO A 44 -3.503 -15.739 6.284 1.00 0.00 N ATOM 647 CA PRO A 44 -2.895 -16.399 7.444 1.00 0.00 C ATOM 648 C PRO A 44 -1.543 -15.798 7.812 1.00 0.00 C ATOM 649 O PRO A 44 -0.495 -16.365 7.501 1.00 0.00 O ATOM 650 CB PRO A 44 -2.729 -17.848 6.980 1.00 0.00 C ATOM 651 CG PRO A 44 -2.644 -17.763 5.495 1.00 0.00 C ATOM 652 CD PRO A 44 -3.522 -16.608 5.097 1.00 0.00 C ATOM 0 HA PRO A 44 -3.505 -16.291 8.341 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.831 -18.299 7.403 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.572 -18.463 7.294 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -1.616 -17.602 5.171 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -2.983 -18.689 5.031 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -3.135 -16.094 4.217 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -4.533 -16.936 4.856 1.00 0.00 H new ATOM 660 N LEU A 45 -1.573 -14.647 8.475 1.00 0.00 N ATOM 661 CA LEU A 45 -0.349 -13.969 8.885 1.00 0.00 C ATOM 662 C LEU A 45 -0.606 -13.055 10.079 1.00 0.00 C ATOM 663 O LEU A 45 -1.735 -12.638 10.341 1.00 0.00 O ATOM 664 CB LEU A 45 0.223 -13.157 7.722 1.00 0.00 C ATOM 665 CG LEU A 45 -0.130 -11.669 7.704 1.00 0.00 C ATOM 666 CD1 LEU A 45 0.512 -10.983 6.508 1.00 0.00 C ATOM 667 CD2 LEU A 45 -1.639 -11.480 7.684 1.00 0.00 C ATOM 0 H LEU A 45 -2.432 -14.164 8.740 1.00 0.00 H new ATOM 0 HA LEU A 45 0.375 -14.728 9.181 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.309 -13.252 7.738 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -0.122 -13.603 6.789 1.00 0.00 H new ATOM 0 HG LEU A 45 0.261 -11.211 8.612 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.250 -9.925 6.511 1.00 0.00 H new ATOM 0 HD12 LEU A 45 1.595 -11.089 6.566 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.151 -11.443 5.588 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -1.872 -10.415 7.671 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -2.053 -11.953 6.793 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.075 -11.936 8.573 1.00 0.00 H new ATOM 679 N PRO A 46 0.464 -12.734 10.821 1.00 0.00 N ATOM 680 CA PRO A 46 0.380 -11.864 11.998 1.00 0.00 C ATOM 681 C PRO A 46 0.080 -10.415 11.627 1.00 0.00 C ATOM 682 O PRO A 46 -0.252 -10.113 10.482 1.00 0.00 O ATOM 683 CB PRO A 46 1.772 -11.978 12.624 1.00 0.00 C ATOM 684 CG PRO A 46 2.668 -12.346 11.492 1.00 0.00 C ATOM 685 CD PRO A 46 1.839 -13.195 10.568 1.00 0.00 C ATOM 0 HA PRO A 46 -0.428 -12.160 12.667 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.078 -11.037 13.082 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.793 -12.735 13.408 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.036 -11.457 10.980 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.541 -12.893 11.847 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.125 -13.052 9.526 1.00 0.00 H new ATOM 0 HD3 PRO A 46 1.953 -14.257 10.787 1.00 0.00 H new ATOM 693 N GLY A 47 0.199 -9.522 12.605 1.00 0.00 N ATOM 694 CA GLY A 47 -0.063 -8.116 12.361 1.00 0.00 C ATOM 695 C GLY A 47 1.170 -7.370 11.891 1.00 0.00 C ATOM 696 O GLY A 47 1.108 -6.597 10.934 1.00 0.00 O ATOM 0 H GLY A 47 0.472 -9.747 13.562 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.849 -8.021 11.612 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.436 -7.655 13.275 1.00 0.00 H new ATOM 700 N TYR A 48 2.291 -7.600 12.564 1.00 0.00 N ATOM 701 CA TYR A 48 3.543 -6.940 12.212 1.00 0.00 C ATOM 702 C TYR A 48 3.851 -7.113 10.728 1.00 0.00 C ATOM 703 O TYR A 48 4.513 -6.273 10.118 1.00 0.00 O ATOM 704 CB TYR A 48 4.692 -7.500 13.051 1.00 0.00 C ATOM 705 CG TYR A 48 5.426 -8.644 12.388 1.00 0.00 C ATOM 706 CD1 TYR A 48 4.944 -9.945 12.470 1.00 0.00 C ATOM 707 CD2 TYR A 48 6.601 -8.425 11.680 1.00 0.00 C ATOM 708 CE1 TYR A 48 5.611 -10.993 11.865 1.00 0.00 C ATOM 709 CE2 TYR A 48 7.274 -9.466 11.072 1.00 0.00 C ATOM 710 CZ TYR A 48 6.775 -10.748 11.167 1.00 0.00 C ATOM 711 OH TYR A 48 7.443 -11.789 10.564 1.00 0.00 O ATOM 0 H TYR A 48 2.359 -8.238 13.357 1.00 0.00 H new ATOM 0 HA TYR A 48 3.435 -5.876 12.421 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.400 -6.699 13.262 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.299 -7.839 14.010 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.033 -10.140 13.016 1.00 0.00 H new ATOM 0 HD2 TYR A 48 6.995 -7.422 11.604 1.00 0.00 H new ATOM 0 HE1 TYR A 48 5.223 -11.998 11.938 1.00 0.00 H new ATOM 0 HE2 TYR A 48 8.186 -9.277 10.525 1.00 0.00 H new ATOM 0 HH TYR A 48 8.243 -11.447 10.113 1.00 0.00 H new ATOM 721 N ARG A 49 3.365 -8.209 10.153 1.00 0.00 N ATOM 722 CA ARG A 49 3.588 -8.494 8.741 1.00 0.00 C ATOM 723 C ARG A 49 2.976 -7.407 7.863 1.00 0.00 C ATOM 724 O ARG A 49 3.683 -6.704 7.141 1.00 0.00 O ATOM 725 CB ARG A 49 2.995 -9.855 8.373 1.00 0.00 C ATOM 726 CG ARG A 49 3.973 -11.008 8.527 1.00 0.00 C ATOM 727 CD ARG A 49 5.163 -10.857 7.592 1.00 0.00 C ATOM 728 NE ARG A 49 5.665 -12.149 7.133 1.00 0.00 N ATOM 729 CZ ARG A 49 6.848 -12.313 6.550 1.00 0.00 C ATOM 730 NH1 ARG A 49 7.646 -11.271 6.358 1.00 0.00 N ATOM 731 NH2 ARG A 49 7.236 -13.520 6.159 1.00 0.00 N ATOM 0 H ARG A 49 2.814 -8.914 10.644 1.00 0.00 H new ATOM 0 HA ARG A 49 4.664 -8.515 8.567 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.123 -10.043 9.000 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.645 -9.822 7.341 1.00 0.00 H new ATOM 0 HG2 ARG A 49 4.323 -11.055 9.558 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.463 -11.949 8.320 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.874 -10.254 6.731 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.961 -10.319 8.104 1.00 0.00 H new ATOM 0 HE ARG A 49 5.076 -12.971 7.267 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.352 -10.341 6.658 1.00 0.00 H new ATOM 0 HH12 ARG A 49 8.554 -11.399 5.910 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.626 -14.324 6.306 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.144 -13.644 5.712 1.00 0.00 H new ATOM 745 N VAL A 50 1.655 -7.272 7.931 1.00 0.00 N ATOM 746 CA VAL A 50 0.947 -6.271 7.143 1.00 0.00 C ATOM 747 C VAL A 50 1.434 -4.865 7.477 1.00 0.00 C ATOM 748 O VAL A 50 1.517 -4.002 6.603 1.00 0.00 O ATOM 749 CB VAL A 50 -0.574 -6.344 7.379 1.00 0.00 C ATOM 750 CG1 VAL A 50 -0.887 -6.308 8.866 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.280 -5.211 6.648 1.00 0.00 C ATOM 0 H VAL A 50 1.054 -7.844 8.524 1.00 0.00 H new ATOM 0 HA VAL A 50 1.156 -6.487 6.095 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.942 -7.289 6.979 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.966 -6.361 9.012 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.412 -7.157 9.358 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.507 -5.381 9.295 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.354 -5.277 6.825 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.910 -4.254 7.016 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -1.083 -5.289 5.579 1.00 0.00 H new ATOM 761 N ARG A 51 1.755 -4.641 8.747 1.00 0.00 N ATOM 762 CA ARG A 51 2.234 -3.340 9.197 1.00 0.00 C ATOM 763 C ARG A 51 3.636 -3.063 8.664 1.00 0.00 C ATOM 764 O ARG A 51 4.019 -1.909 8.469 1.00 0.00 O ATOM 765 CB ARG A 51 2.236 -3.273 10.725 1.00 0.00 C ATOM 766 CG ARG A 51 1.937 -1.887 11.275 1.00 0.00 C ATOM 767 CD ARG A 51 2.649 -1.647 12.595 1.00 0.00 C ATOM 768 NE ARG A 51 1.931 -0.698 13.441 1.00 0.00 N ATOM 769 CZ ARG A 51 2.422 -0.200 14.570 1.00 0.00 C ATOM 770 NH1 ARG A 51 3.629 -0.558 14.987 1.00 0.00 N ATOM 771 NH2 ARG A 51 1.707 0.659 15.285 1.00 0.00 N ATOM 0 H ARG A 51 1.692 -5.344 9.483 1.00 0.00 H new ATOM 0 HA ARG A 51 1.558 -2.578 8.808 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.498 -3.975 11.112 1.00 0.00 H new ATOM 0 HB3 ARG A 51 3.209 -3.599 11.093 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.246 -1.133 10.551 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.862 -1.774 11.414 1.00 0.00 H new ATOM 0 HD2 ARG A 51 2.759 -2.593 13.125 1.00 0.00 H new ATOM 0 HD3 ARG A 51 3.654 -1.272 12.402 1.00 0.00 H new ATOM 0 HE ARG A 51 1.000 -0.401 13.148 1.00 0.00 H new ATOM 0 HH11 ARG A 51 4.183 -1.217 14.440 1.00 0.00 H new ATOM 0 HH12 ARG A 51 4.004 -0.174 15.854 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.779 0.938 14.968 1.00 0.00 H new ATOM 0 HH22 ARG A 51 2.086 1.040 16.152 1.00 0.00 H new ATOM 785 N GLU A 52 4.397 -4.127 8.429 1.00 0.00 N ATOM 786 CA GLU A 52 5.757 -3.997 7.920 1.00 0.00 C ATOM 787 C GLU A 52 5.751 -3.679 6.428 1.00 0.00 C ATOM 788 O GLU A 52 6.495 -2.813 5.965 1.00 0.00 O ATOM 789 CB GLU A 52 6.546 -5.284 8.174 1.00 0.00 C ATOM 790 CG GLU A 52 8.008 -5.189 7.775 1.00 0.00 C ATOM 791 CD GLU A 52 8.670 -6.549 7.663 1.00 0.00 C ATOM 792 OE1 GLU A 52 8.677 -7.291 8.667 1.00 0.00 O ATOM 793 OE2 GLU A 52 9.182 -6.872 6.570 1.00 0.00 O ATOM 0 H GLU A 52 4.095 -5.089 8.583 1.00 0.00 H new ATOM 0 HA GLU A 52 6.238 -3.174 8.448 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.482 -5.536 9.232 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.080 -6.101 7.623 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.087 -4.670 6.820 1.00 0.00 H new ATOM 0 HG3 GLU A 52 8.543 -4.588 8.510 1.00 0.00 H new ATOM 800 N ILE A 53 4.907 -4.383 5.681 1.00 0.00 N ATOM 801 CA ILE A 53 4.804 -4.175 4.243 1.00 0.00 C ATOM 802 C ILE A 53 4.218 -2.803 3.927 1.00 0.00 C ATOM 803 O ILE A 53 4.633 -2.143 2.973 1.00 0.00 O ATOM 804 CB ILE A 53 3.933 -5.258 3.578 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.536 -5.272 4.203 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.592 -6.622 3.709 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.620 -6.319 3.607 1.00 0.00 C ATOM 0 H ILE A 53 4.285 -5.103 6.049 1.00 0.00 H new ATOM 0 HA ILE A 53 5.816 -4.237 3.842 1.00 0.00 H new ATOM 0 HB ILE A 53 3.835 -5.025 2.518 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.628 -5.448 5.275 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.081 -4.289 4.079 1.00 0.00 H new ATOM 0 HG21 ILE A 53 3.964 -7.376 3.234 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.567 -6.603 3.223 1.00 0.00 H new ATOM 0 HG23 ILE A 53 4.717 -6.866 4.764 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.647 -6.273 4.097 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.499 -6.131 2.540 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.054 -7.308 3.754 1.00 0.00 H new ATOM 819 N THR A 54 3.253 -2.377 4.735 1.00 0.00 N ATOM 820 CA THR A 54 2.611 -1.082 4.543 1.00 0.00 C ATOM 821 C THR A 54 3.536 0.058 4.953 1.00 0.00 C ATOM 822 O THR A 54 3.598 1.089 4.285 1.00 0.00 O ATOM 823 CB THR A 54 1.301 -0.980 5.347 1.00 0.00 C ATOM 824 OG1 THR A 54 0.608 0.226 5.004 1.00 0.00 O ATOM 825 CG2 THR A 54 1.581 -1.002 6.843 1.00 0.00 C ATOM 0 H THR A 54 2.898 -2.910 5.529 1.00 0.00 H new ATOM 0 HA THR A 54 2.384 -0.997 3.480 1.00 0.00 H new ATOM 0 HB THR A 54 0.679 -1.840 5.097 1.00 0.00 H new ATOM 0 HG1 THR A 54 0.711 0.879 5.727 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.641 -0.929 7.390 1.00 0.00 H new ATOM 0 HG22 THR A 54 2.082 -1.934 7.106 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.220 -0.159 7.106 1.00 0.00 H new ATOM 833 N GLU A 55 4.255 -0.138 6.055 1.00 0.00 N ATOM 834 CA GLU A 55 5.177 0.876 6.553 1.00 0.00 C ATOM 835 C GLU A 55 6.354 1.057 5.598 1.00 0.00 C ATOM 836 O GLU A 55 6.749 2.180 5.289 1.00 0.00 O ATOM 837 CB GLU A 55 5.688 0.492 7.943 1.00 0.00 C ATOM 838 CG GLU A 55 4.758 0.908 9.070 1.00 0.00 C ATOM 839 CD GLU A 55 5.382 0.723 10.440 1.00 0.00 C ATOM 840 OE1 GLU A 55 6.626 0.653 10.520 1.00 0.00 O ATOM 841 OE2 GLU A 55 4.626 0.647 11.431 1.00 0.00 O ATOM 0 H GLU A 55 4.217 -0.988 6.618 1.00 0.00 H new ATOM 0 HA GLU A 55 4.637 1.821 6.620 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.832 -0.588 7.982 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.664 0.950 8.101 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.480 1.954 8.940 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.839 0.325 9.012 1.00 0.00 H new ATOM 848 N ASN A 56 6.910 -0.059 5.135 1.00 0.00 N ATOM 849 CA ASN A 56 8.042 -0.024 4.217 1.00 0.00 C ATOM 850 C ASN A 56 7.621 0.519 2.855 1.00 0.00 C ATOM 851 O ASN A 56 8.332 1.320 2.246 1.00 0.00 O ATOM 852 CB ASN A 56 8.639 -1.423 4.059 1.00 0.00 C ATOM 853 CG ASN A 56 9.331 -1.903 5.320 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.241 -1.267 6.370 1.00 0.00 O ATOM 855 ND2 ASN A 56 10.023 -3.032 5.223 1.00 0.00 N ATOM 0 H ASN A 56 6.595 -0.997 5.381 1.00 0.00 H new ATOM 0 HA ASN A 56 8.798 0.641 4.635 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.848 -2.124 3.793 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.353 -1.419 3.235 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.507 -3.405 6.040 1.00 0.00 H new ATOM 0 HD22 ASN A 56 10.070 -3.526 4.332 1.00 0.00 H new ATOM 862 N LEU A 57 6.460 0.079 2.382 1.00 0.00 N ATOM 863 CA LEU A 57 5.943 0.520 1.091 1.00 0.00 C ATOM 864 C LEU A 57 5.727 2.031 1.079 1.00 0.00 C ATOM 865 O LEU A 57 6.086 2.711 0.118 1.00 0.00 O ATOM 866 CB LEU A 57 4.629 -0.196 0.774 1.00 0.00 C ATOM 867 CG LEU A 57 4.035 0.072 -0.609 1.00 0.00 C ATOM 868 CD1 LEU A 57 4.953 -0.461 -1.698 1.00 0.00 C ATOM 869 CD2 LEU A 57 2.650 -0.549 -0.725 1.00 0.00 C ATOM 0 H LEU A 57 5.859 -0.583 2.873 1.00 0.00 H new ATOM 0 HA LEU A 57 6.680 0.270 0.327 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.789 -1.269 0.877 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.893 0.089 1.525 1.00 0.00 H new ATOM 0 HG LEU A 57 3.940 1.150 -0.739 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.513 -0.261 -2.675 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.923 0.031 -1.629 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.082 -1.536 -1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.243 -0.348 -1.716 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.720 -1.626 -0.573 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.994 -0.118 0.031 1.00 0.00 H new ATOM 881 N MET A 58 5.141 2.548 2.154 1.00 0.00 N ATOM 882 CA MET A 58 4.881 3.979 2.267 1.00 0.00 C ATOM 883 C MET A 58 6.185 4.761 2.377 1.00 0.00 C ATOM 884 O MET A 58 6.351 5.801 1.742 1.00 0.00 O ATOM 885 CB MET A 58 3.998 4.263 3.484 1.00 0.00 C ATOM 886 CG MET A 58 2.682 4.941 3.134 1.00 0.00 C ATOM 887 SD MET A 58 2.782 6.739 3.223 1.00 0.00 S ATOM 888 CE MET A 58 1.228 7.202 2.462 1.00 0.00 C ATOM 0 H MET A 58 4.838 1.999 2.958 1.00 0.00 H new ATOM 0 HA MET A 58 4.360 4.301 1.365 1.00 0.00 H new ATOM 0 HB2 MET A 58 3.789 3.325 3.998 1.00 0.00 H new ATOM 0 HB3 MET A 58 4.548 4.894 4.183 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.383 4.647 2.128 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.905 4.590 3.813 1.00 0.00 H new ATOM 0 HE1 MET A 58 1.403 7.988 1.727 1.00 0.00 H new ATOM 0 HE2 MET A 58 0.792 6.334 1.969 1.00 0.00 H new ATOM 0 HE3 MET A 58 0.543 7.567 3.227 1.00 0.00 H new ATOM 898 N ALA A 59 7.108 4.254 3.188 1.00 0.00 N ATOM 899 CA ALA A 59 8.398 4.904 3.380 1.00 0.00 C ATOM 900 C ALA A 59 9.189 4.949 2.077 1.00 0.00 C ATOM 901 O ALA A 59 9.869 5.933 1.785 1.00 0.00 O ATOM 902 CB ALA A 59 9.195 4.188 4.460 1.00 0.00 C ATOM 0 H ALA A 59 6.986 3.394 3.723 1.00 0.00 H new ATOM 0 HA ALA A 59 8.216 5.930 3.700 1.00 0.00 H new ATOM 0 HB1 ALA A 59 10.156 4.685 4.592 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.641 4.214 5.398 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.360 3.152 4.164 1.00 0.00 H new ATOM 908 N THR A 60 9.099 3.876 1.297 1.00 0.00 N ATOM 909 CA THR A 60 9.807 3.791 0.028 1.00 0.00 C ATOM 910 C THR A 60 8.914 4.224 -1.130 1.00 0.00 C ATOM 911 O THR A 60 9.297 4.119 -2.294 1.00 0.00 O ATOM 912 CB THR A 60 10.316 2.362 -0.239 1.00 0.00 C ATOM 913 OG1 THR A 60 11.219 2.363 -1.350 1.00 0.00 O ATOM 914 CG2 THR A 60 9.158 1.418 -0.519 1.00 0.00 C ATOM 0 H THR A 60 8.541 3.053 1.524 1.00 0.00 H new ATOM 0 HA THR A 60 10.661 4.465 0.098 1.00 0.00 H new ATOM 0 HB THR A 60 10.839 2.014 0.652 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.876 2.957 -2.050 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.543 0.415 -0.704 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.490 1.397 0.342 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.610 1.764 -1.395 1.00 0.00 H new ATOM 922 N GLY A 61 7.722 4.712 -0.802 1.00 0.00 N ATOM 923 CA GLY A 61 6.794 5.153 -1.826 1.00 0.00 C ATOM 924 C GLY A 61 6.415 6.614 -1.675 1.00 0.00 C ATOM 925 O GLY A 61 5.422 7.067 -2.244 1.00 0.00 O ATOM 0 H GLY A 61 7.382 4.810 0.155 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.240 4.996 -2.808 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.893 4.541 -1.784 1.00 0.00 H new ATOM 929 N ASP A 62 7.207 7.351 -0.905 1.00 0.00 N ATOM 930 CA ASP A 62 6.950 8.769 -0.679 1.00 0.00 C ATOM 931 C ASP A 62 8.228 9.586 -0.840 1.00 0.00 C ATOM 932 O ASP A 62 9.044 9.667 0.078 1.00 0.00 O ATOM 933 CB ASP A 62 6.363 8.987 0.716 1.00 0.00 C ATOM 934 CG ASP A 62 5.514 10.241 0.798 1.00 0.00 C ATOM 935 OD1 ASP A 62 5.527 11.031 -0.171 1.00 0.00 O ATOM 936 OD2 ASP A 62 4.838 10.434 1.829 1.00 0.00 O ATOM 0 H ASP A 62 8.033 6.991 -0.426 1.00 0.00 H new ATOM 0 HA ASP A 62 6.229 9.105 -1.424 1.00 0.00 H new ATOM 0 HB2 ASP A 62 5.758 8.123 0.991 1.00 0.00 H new ATOM 0 HB3 ASP A 62 7.174 9.052 1.442 1.00 0.00 H new ATOM 941 N LEU A 63 8.395 10.189 -2.012 1.00 0.00 N ATOM 942 CA LEU A 63 9.575 10.999 -2.294 1.00 0.00 C ATOM 943 C LEU A 63 9.424 12.402 -1.715 1.00 0.00 C ATOM 944 O LEU A 63 10.289 12.877 -0.979 1.00 0.00 O ATOM 945 CB LEU A 63 9.812 11.080 -3.803 1.00 0.00 C ATOM 946 CG LEU A 63 10.286 9.794 -4.480 1.00 0.00 C ATOM 947 CD1 LEU A 63 9.134 8.811 -4.623 1.00 0.00 C ATOM 948 CD2 LEU A 63 10.902 10.100 -5.837 1.00 0.00 C ATOM 0 H LEU A 63 7.728 10.132 -2.782 1.00 0.00 H new ATOM 0 HA LEU A 63 10.434 10.523 -1.822 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.884 11.396 -4.279 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.550 11.860 -3.993 1.00 0.00 H new ATOM 0 HG LEU A 63 11.051 9.336 -3.853 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.490 7.901 -5.107 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.740 8.567 -3.637 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.346 9.259 -5.228 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.234 9.172 -6.304 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.159 10.581 -6.473 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.755 10.766 -5.707 1.00 0.00 H new ATOM 960 N ASP A 64 8.319 13.058 -2.050 1.00 0.00 N ATOM 961 CA ASP A 64 8.052 14.406 -1.561 1.00 0.00 C ATOM 962 C ASP A 64 7.727 14.388 -0.070 1.00 0.00 C ATOM 963 O ASP A 64 7.807 15.414 0.604 1.00 0.00 O ATOM 964 CB ASP A 64 6.897 15.035 -2.340 1.00 0.00 C ATOM 965 CG ASP A 64 6.916 14.657 -3.808 1.00 0.00 C ATOM 966 OD1 ASP A 64 7.876 15.042 -4.508 1.00 0.00 O ATOM 967 OD2 ASP A 64 5.970 13.976 -4.257 1.00 0.00 O ATOM 0 H ASP A 64 7.593 12.679 -2.658 1.00 0.00 H new ATOM 0 HA ASP A 64 8.950 15.005 -1.712 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.951 14.721 -1.899 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.947 16.120 -2.246 1.00 0.00 H new ATOM 972 N GLN A 65 7.356 13.216 0.435 1.00 0.00 N ATOM 973 CA GLN A 65 7.017 13.065 1.845 1.00 0.00 C ATOM 974 C GLN A 65 5.789 13.897 2.201 1.00 0.00 C ATOM 975 O GLN A 65 5.721 14.494 3.275 1.00 0.00 O ATOM 976 CB GLN A 65 8.199 13.478 2.724 1.00 0.00 C ATOM 977 CG GLN A 65 9.517 12.845 2.306 1.00 0.00 C ATOM 978 CD GLN A 65 10.700 13.404 3.072 1.00 0.00 C ATOM 979 OE1 GLN A 65 11.297 12.718 3.903 1.00 0.00 O ATOM 980 NE2 GLN A 65 11.047 14.656 2.795 1.00 0.00 N ATOM 0 H GLN A 65 7.283 12.358 -0.111 1.00 0.00 H new ATOM 0 HA GLN A 65 6.788 12.015 2.027 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.301 14.563 2.695 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.986 13.205 3.757 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.464 11.767 2.462 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.671 13.006 1.239 1.00 0.00 H new ATOM 0 HE21 GLN A 65 10.524 15.188 2.099 1.00 0.00 H new ATOM 0 HE22 GLN A 65 11.836 15.085 3.278 1.00 0.00 H new ATOM 989 N ASP A 66 4.821 13.933 1.292 1.00 0.00 N ATOM 990 CA ASP A 66 3.594 14.690 1.509 1.00 0.00 C ATOM 991 C ASP A 66 2.614 13.903 2.373 1.00 0.00 C ATOM 992 O ASP A 66 1.636 14.452 2.878 1.00 0.00 O ATOM 993 CB ASP A 66 2.944 15.044 0.171 1.00 0.00 C ATOM 994 CG ASP A 66 3.914 15.706 -0.788 1.00 0.00 C ATOM 995 OD1 ASP A 66 4.961 16.204 -0.323 1.00 0.00 O ATOM 996 OD2 ASP A 66 3.628 15.722 -2.003 1.00 0.00 O ATOM 0 H ASP A 66 4.863 13.446 0.397 1.00 0.00 H new ATOM 0 HA ASP A 66 3.853 15.610 2.033 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.546 14.138 -0.287 1.00 0.00 H new ATOM 0 HB3 ASP A 66 2.099 15.710 0.346 1.00 0.00 H new ATOM 1001 N GLY A 67 2.884 12.612 2.538 1.00 0.00 N ATOM 1002 CA GLY A 67 2.016 11.768 3.340 1.00 0.00 C ATOM 1003 C GLY A 67 1.155 10.852 2.494 1.00 0.00 C ATOM 1004 O GLY A 67 0.500 9.949 3.015 1.00 0.00 O ATOM 0 H GLY A 67 3.688 12.135 2.131 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.623 11.168 4.017 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.374 12.396 3.958 1.00 0.00 H new ATOM 1008 N ARG A 68 1.155 11.083 1.185 1.00 0.00 N ATOM 1009 CA ARG A 68 0.366 10.273 0.266 1.00 0.00 C ATOM 1010 C ARG A 68 1.198 9.855 -0.943 1.00 0.00 C ATOM 1011 O ARG A 68 2.263 10.417 -1.199 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.871 11.046 -0.196 1.00 0.00 C ATOM 1013 CG ARG A 68 -1.737 11.549 0.947 1.00 0.00 C ATOM 1014 CD ARG A 68 -2.954 10.661 1.156 1.00 0.00 C ATOM 1015 NE ARG A 68 -4.150 11.212 0.527 1.00 0.00 N ATOM 1016 CZ ARG A 68 -4.767 12.307 0.956 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -4.304 12.964 2.010 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -5.850 12.748 0.329 1.00 0.00 N ATOM 0 H ARG A 68 1.693 11.825 0.737 1.00 0.00 H new ATOM 0 HA ARG A 68 0.048 9.374 0.795 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -0.553 11.895 -0.801 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.471 10.403 -0.840 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.148 11.583 1.864 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.061 12.569 0.738 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -2.754 9.670 0.748 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -3.132 10.536 2.224 1.00 0.00 H new ATOM 0 HE ARG A 68 -4.533 10.730 -0.286 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -3.471 12.629 2.494 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -4.780 13.805 2.337 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -6.209 12.246 -0.483 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -6.323 13.589 0.659 1.00 0.00 H new ATOM 1032 N ILE A 69 0.706 8.865 -1.680 1.00 0.00 N ATOM 1033 CA ILE A 69 1.404 8.373 -2.861 1.00 0.00 C ATOM 1034 C ILE A 69 0.603 8.648 -4.129 1.00 0.00 C ATOM 1035 O ILE A 69 -0.593 8.361 -4.194 1.00 0.00 O ATOM 1036 CB ILE A 69 1.682 6.861 -2.761 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.263 6.517 -1.389 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.629 6.423 -3.868 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.649 5.062 -1.243 1.00 0.00 C ATOM 0 H ILE A 69 -0.173 8.388 -1.480 1.00 0.00 H new ATOM 0 HA ILE A 69 2.353 8.907 -2.911 1.00 0.00 H new ATOM 0 HB ILE A 69 0.741 6.325 -2.881 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.141 7.137 -1.210 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.532 6.769 -0.621 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.816 5.352 -3.784 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.180 6.638 -4.837 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.571 6.964 -3.776 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.053 4.891 -0.245 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.769 4.436 -1.390 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.403 4.809 -1.988 1.00 0.00 H new ATOM 1051 N SER A 70 1.269 9.206 -5.134 1.00 0.00 N ATOM 1052 CA SER A 70 0.619 9.522 -6.400 1.00 0.00 C ATOM 1053 C SER A 70 0.827 8.401 -7.414 1.00 0.00 C ATOM 1054 O SER A 70 1.688 7.539 -7.234 1.00 0.00 O ATOM 1055 CB SER A 70 1.158 10.839 -6.960 1.00 0.00 C ATOM 1056 OG SER A 70 2.430 10.656 -7.557 1.00 0.00 O ATOM 0 H SER A 70 2.259 9.449 -5.096 1.00 0.00 H new ATOM 0 HA SER A 70 -0.450 9.625 -6.214 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.461 11.237 -7.697 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.231 11.576 -6.160 1.00 0.00 H new ATOM 0 HG SER A 70 3.120 10.653 -6.861 1.00 0.00 H new ATOM 1062 N PHE A 71 0.035 8.421 -8.481 1.00 0.00 N ATOM 1063 CA PHE A 71 0.132 7.406 -9.524 1.00 0.00 C ATOM 1064 C PHE A 71 1.580 7.217 -9.966 1.00 0.00 C ATOM 1065 O PHE A 71 2.108 6.106 -9.943 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.733 7.794 -10.724 1.00 0.00 C ATOM 1067 CG PHE A 71 -2.175 7.401 -10.575 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -2.864 6.831 -11.634 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.842 7.602 -9.377 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.192 6.468 -11.501 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.168 7.239 -9.237 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.845 6.673 -10.301 1.00 0.00 C ATOM 0 H PHE A 71 -0.681 9.129 -8.646 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.230 6.463 -9.114 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.672 8.872 -10.872 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.328 7.325 -11.621 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.358 6.668 -12.574 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.320 8.047 -8.543 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.718 6.025 -12.334 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.675 7.397 -8.297 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.882 6.392 -10.194 1.00 0.00 H new ATOM 1082 N ASP A 72 2.216 8.312 -10.370 1.00 0.00 N ATOM 1083 CA ASP A 72 3.603 8.269 -10.819 1.00 0.00 C ATOM 1084 C ASP A 72 4.508 7.699 -9.731 1.00 0.00 C ATOM 1085 O ASP A 72 5.420 6.922 -10.014 1.00 0.00 O ATOM 1086 CB ASP A 72 4.078 9.669 -11.213 1.00 0.00 C ATOM 1087 CG ASP A 72 3.442 10.154 -12.500 1.00 0.00 C ATOM 1088 OD1 ASP A 72 2.516 9.478 -12.997 1.00 0.00 O ATOM 1089 OD2 ASP A 72 3.869 11.211 -13.010 1.00 0.00 O ATOM 0 H ASP A 72 1.793 9.240 -10.396 1.00 0.00 H new ATOM 0 HA ASP A 72 3.657 7.617 -11.691 1.00 0.00 H new ATOM 0 HB2 ASP A 72 3.845 10.368 -10.410 1.00 0.00 H new ATOM 0 HB3 ASP A 72 5.162 9.663 -11.326 1.00 0.00 H new ATOM 1094 N GLU A 73 4.249 8.091 -8.487 1.00 0.00 N ATOM 1095 CA GLU A 73 5.043 7.620 -7.358 1.00 0.00 C ATOM 1096 C GLU A 73 5.032 6.096 -7.283 1.00 0.00 C ATOM 1097 O GLU A 73 6.069 5.448 -7.422 1.00 0.00 O ATOM 1098 CB GLU A 73 4.510 8.211 -6.050 1.00 0.00 C ATOM 1099 CG GLU A 73 5.298 9.415 -5.561 1.00 0.00 C ATOM 1100 CD GLU A 73 4.618 10.126 -4.407 1.00 0.00 C ATOM 1101 OE1 GLU A 73 3.599 10.808 -4.649 1.00 0.00 O ATOM 1102 OE2 GLU A 73 5.102 10.000 -3.263 1.00 0.00 O ATOM 0 H GLU A 73 3.497 8.732 -8.236 1.00 0.00 H new ATOM 0 HA GLU A 73 6.071 7.951 -7.506 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.469 8.501 -6.190 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.525 7.440 -5.280 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.292 9.093 -5.250 1.00 0.00 H new ATOM 0 HG3 GLU A 73 5.434 10.115 -6.385 1.00 0.00 H new ATOM 1109 N PHE A 74 3.850 5.530 -7.062 1.00 0.00 N ATOM 1110 CA PHE A 74 3.702 4.082 -6.967 1.00 0.00 C ATOM 1111 C PHE A 74 4.279 3.393 -8.200 1.00 0.00 C ATOM 1112 O PHE A 74 5.160 2.540 -8.092 1.00 0.00 O ATOM 1113 CB PHE A 74 2.227 3.708 -6.803 1.00 0.00 C ATOM 1114 CG PHE A 74 1.903 3.120 -5.459 1.00 0.00 C ATOM 1115 CD1 PHE A 74 0.853 3.617 -4.706 1.00 0.00 C ATOM 1116 CD2 PHE A 74 2.651 2.070 -4.950 1.00 0.00 C ATOM 1117 CE1 PHE A 74 0.552 3.078 -3.469 1.00 0.00 C ATOM 1118 CE2 PHE A 74 2.354 1.526 -3.715 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.303 2.031 -2.973 1.00 0.00 C ATOM 0 H PHE A 74 2.981 6.051 -6.945 1.00 0.00 H new ATOM 0 HA PHE A 74 4.255 3.743 -6.091 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.616 4.597 -6.959 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.953 2.993 -7.579 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.262 4.436 -5.089 1.00 0.00 H new ATOM 0 HD2 PHE A 74 3.475 1.673 -5.525 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.270 3.475 -2.891 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.943 0.707 -3.330 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.070 1.608 -2.007 1.00 0.00 H new ATOM 1129 N ILE A 75 3.775 3.770 -9.371 1.00 0.00 N ATOM 1130 CA ILE A 75 4.241 3.191 -10.624 1.00 0.00 C ATOM 1131 C ILE A 75 5.760 3.258 -10.730 1.00 0.00 C ATOM 1132 O ILE A 75 6.405 2.306 -11.170 1.00 0.00 O ATOM 1133 CB ILE A 75 3.621 3.906 -11.840 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.093 3.849 -11.768 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.119 3.280 -13.134 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.408 4.825 -12.698 1.00 0.00 C ATOM 0 H ILE A 75 3.044 4.474 -9.477 1.00 0.00 H new ATOM 0 HA ILE A 75 3.925 2.148 -10.626 1.00 0.00 H new ATOM 0 HB ILE A 75 3.929 4.952 -11.824 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.763 2.838 -12.008 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.778 4.052 -10.745 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.672 3.796 -13.984 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.204 3.367 -13.186 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.838 2.227 -13.160 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.327 4.729 -12.594 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.708 5.842 -12.444 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.694 4.609 -13.727 1.00 0.00 H new ATOM 1148 N LYS A 76 6.328 4.388 -10.322 1.00 0.00 N ATOM 1149 CA LYS A 76 7.772 4.579 -10.368 1.00 0.00 C ATOM 1150 C LYS A 76 8.487 3.519 -9.538 1.00 0.00 C ATOM 1151 O LYS A 76 9.496 2.957 -9.967 1.00 0.00 O ATOM 1152 CB LYS A 76 8.139 5.975 -9.857 1.00 0.00 C ATOM 1153 CG LYS A 76 8.157 7.035 -10.946 1.00 0.00 C ATOM 1154 CD LYS A 76 8.199 8.436 -10.358 1.00 0.00 C ATOM 1155 CE LYS A 76 8.323 9.493 -11.446 1.00 0.00 C ATOM 1156 NZ LYS A 76 9.746 9.792 -11.768 1.00 0.00 N ATOM 0 H LYS A 76 5.809 5.186 -9.955 1.00 0.00 H new ATOM 0 HA LYS A 76 8.094 4.482 -11.405 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.427 6.270 -9.086 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.121 5.934 -9.385 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.024 6.883 -11.589 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.272 6.929 -11.573 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.295 8.615 -9.776 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.041 8.519 -9.671 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.811 9.150 -12.345 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.824 10.407 -11.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 9.789 10.516 -12.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.228 10.143 -10.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.216 8.926 -12.100 1.00 0.00 H new ATOM 1170 N ILE A 77 7.960 3.249 -8.348 1.00 0.00 N ATOM 1171 CA ILE A 77 8.548 2.254 -7.460 1.00 0.00 C ATOM 1172 C ILE A 77 8.386 0.848 -8.026 1.00 0.00 C ATOM 1173 O ILE A 77 9.232 -0.021 -7.811 1.00 0.00 O ATOM 1174 CB ILE A 77 7.914 2.307 -6.058 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.589 3.387 -5.209 1.00 0.00 C ATOM 1176 CG2 ILE A 77 8.017 0.950 -5.378 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.217 4.796 -5.616 1.00 0.00 C ATOM 0 H ILE A 77 7.127 3.706 -7.977 1.00 0.00 H new ATOM 0 HA ILE A 77 9.609 2.490 -7.379 1.00 0.00 H new ATOM 0 HB ILE A 77 6.859 2.560 -6.162 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.320 3.237 -4.163 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.670 3.270 -5.280 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.564 1.004 -4.388 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.495 0.203 -5.976 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.066 0.670 -5.283 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.732 5.509 -4.972 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.511 4.965 -6.652 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.140 4.931 -5.518 1.00 0.00 H new ATOM 1189 N PHE A 78 7.294 0.630 -8.752 1.00 0.00 N ATOM 1190 CA PHE A 78 7.021 -0.671 -9.350 1.00 0.00 C ATOM 1191 C PHE A 78 7.949 -0.931 -10.533 1.00 0.00 C ATOM 1192 O PHE A 78 8.352 -2.068 -10.781 1.00 0.00 O ATOM 1193 CB PHE A 78 5.562 -0.750 -9.806 1.00 0.00 C ATOM 1194 CG PHE A 78 4.650 -1.379 -8.791 1.00 0.00 C ATOM 1195 CD1 PHE A 78 4.497 -0.815 -7.535 1.00 0.00 C ATOM 1196 CD2 PHE A 78 3.945 -2.533 -9.093 1.00 0.00 C ATOM 1197 CE1 PHE A 78 3.660 -1.391 -6.598 1.00 0.00 C ATOM 1198 CE2 PHE A 78 3.105 -3.112 -8.162 1.00 0.00 C ATOM 1199 CZ PHE A 78 2.963 -2.541 -6.913 1.00 0.00 C ATOM 0 H PHE A 78 6.584 1.338 -8.940 1.00 0.00 H new ATOM 0 HA PHE A 78 7.201 -1.435 -8.594 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.205 0.255 -10.030 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.510 -1.321 -10.733 1.00 0.00 H new ATOM 0 HD1 PHE A 78 5.038 0.086 -7.285 1.00 0.00 H new ATOM 0 HD2 PHE A 78 4.054 -2.985 -10.068 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.551 -0.943 -5.621 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.560 -4.010 -8.411 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.308 -2.993 -6.183 1.00 0.00 H new ATOM 1209 N HIS A 79 8.283 0.130 -11.260 1.00 0.00 N ATOM 1210 CA HIS A 79 9.164 0.017 -12.417 1.00 0.00 C ATOM 1211 C HIS A 79 10.625 0.178 -12.006 1.00 0.00 C ATOM 1212 O HIS A 79 11.533 -0.220 -12.734 1.00 0.00 O ATOM 1213 CB HIS A 79 8.799 1.067 -13.467 1.00 0.00 C ATOM 1214 CG HIS A 79 8.098 0.500 -14.662 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.657 0.475 -15.923 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.874 -0.068 -14.784 1.00 0.00 C ATOM 1217 CE1 HIS A 79 7.808 -0.080 -16.768 1.00 0.00 C ATOM 1218 NE2 HIS A 79 6.718 -0.420 -16.103 1.00 0.00 N ATOM 0 H HIS A 79 7.957 1.077 -11.069 1.00 0.00 H new ATOM 0 HA HIS A 79 9.033 -0.976 -12.846 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.162 1.823 -13.007 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.708 1.572 -13.795 1.00 0.00 H new ATOM 0 HD2 HIS A 79 6.155 -0.216 -13.992 1.00 0.00 H new ATOM 0 HE1 HIS A 79 7.976 -0.231 -17.824 1.00 0.00 H new ATOM 0 HE2 HIS A 79 5.895 -0.870 -16.503 1.00 0.00 H new ATOM 1226 N GLY A 80 10.843 0.765 -10.833 1.00 0.00 N ATOM 1227 CA GLY A 80 12.195 0.969 -10.346 1.00 0.00 C ATOM 1228 C GLY A 80 12.717 -0.223 -9.569 1.00 0.00 C ATOM 1229 O GLY A 80 13.637 -0.910 -10.017 1.00 0.00 O ATOM 0 H GLY A 80 10.108 1.103 -10.212 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.856 1.166 -11.190 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.219 1.853 -9.709 1.00 0.00 H new ATOM 1233 N LEU A 81 12.132 -0.470 -8.403 1.00 0.00 N ATOM 1234 CA LEU A 81 12.545 -1.588 -7.561 1.00 0.00 C ATOM 1235 C LEU A 81 12.569 -2.889 -8.356 1.00 0.00 C ATOM 1236 O LEU A 81 11.572 -3.275 -8.967 1.00 0.00 O ATOM 1237 CB LEU A 81 11.604 -1.725 -6.363 1.00 0.00 C ATOM 1238 CG LEU A 81 11.656 -0.594 -5.336 1.00 0.00 C ATOM 1239 CD1 LEU A 81 10.679 -0.860 -4.200 1.00 0.00 C ATOM 1240 CD2 LEU A 81 13.070 -0.428 -4.797 1.00 0.00 C ATOM 0 H LEU A 81 11.370 0.088 -8.018 1.00 0.00 H new ATOM 0 HA LEU A 81 13.554 -1.386 -7.201 1.00 0.00 H new ATOM 0 HB2 LEU A 81 10.583 -1.804 -6.736 1.00 0.00 H new ATOM 0 HB3 LEU A 81 11.830 -2.662 -5.854 1.00 0.00 H new ATOM 0 HG LEU A 81 11.365 0.333 -5.829 1.00 0.00 H new ATOM 0 HD11 LEU A 81 10.730 -0.045 -3.478 1.00 0.00 H new ATOM 0 HD12 LEU A 81 9.667 -0.929 -4.599 1.00 0.00 H new ATOM 0 HD13 LEU A 81 10.940 -1.797 -3.708 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.089 0.381 -4.067 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.388 -1.355 -4.319 1.00 0.00 H new ATOM 0 HD23 LEU A 81 13.747 -0.192 -5.618 1.00 0.00 H new ATOM 1252 N LYS A 82 13.713 -3.563 -8.343 1.00 0.00 N ATOM 1253 CA LYS A 82 13.867 -4.824 -9.060 1.00 0.00 C ATOM 1254 C LYS A 82 12.742 -5.792 -8.707 1.00 0.00 C ATOM 1255 O LYS A 82 12.133 -6.399 -9.588 1.00 0.00 O ATOM 1256 CB LYS A 82 15.221 -5.459 -8.734 1.00 0.00 C ATOM 1257 CG LYS A 82 15.498 -5.568 -7.244 1.00 0.00 C ATOM 1258 CD LYS A 82 16.930 -5.996 -6.973 1.00 0.00 C ATOM 1259 CE LYS A 82 17.920 -4.907 -7.359 1.00 0.00 C ATOM 1260 NZ LYS A 82 18.580 -5.195 -8.663 1.00 0.00 N ATOM 0 H LYS A 82 14.548 -3.257 -7.844 1.00 0.00 H new ATOM 0 HA LYS A 82 13.820 -4.613 -10.128 1.00 0.00 H new ATOM 0 HB2 LYS A 82 15.262 -6.454 -9.177 1.00 0.00 H new ATOM 0 HB3 LYS A 82 16.011 -4.870 -9.200 1.00 0.00 H new ATOM 0 HG2 LYS A 82 15.308 -4.607 -6.766 1.00 0.00 H new ATOM 0 HG3 LYS A 82 14.812 -6.287 -6.797 1.00 0.00 H new ATOM 0 HD2 LYS A 82 17.045 -6.236 -5.916 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.151 -6.905 -7.532 1.00 0.00 H new ATOM 0 HE2 LYS A 82 17.402 -3.950 -7.417 1.00 0.00 H new ATOM 0 HE3 LYS A 82 18.678 -4.813 -6.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 18.745 -4.304 -9.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 19.489 -5.671 -8.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 17.967 -5.812 -9.233 1.00 0.00 H new ATOM 1274 N SER A 83 12.470 -5.929 -7.413 1.00 0.00 N ATOM 1275 CA SER A 83 11.420 -6.825 -6.944 1.00 0.00 C ATOM 1276 C SER A 83 11.290 -6.761 -5.426 1.00 0.00 C ATOM 1277 O SER A 83 12.165 -7.228 -4.695 1.00 0.00 O ATOM 1278 CB SER A 83 11.711 -8.261 -7.382 1.00 0.00 C ATOM 1279 OG SER A 83 11.001 -9.192 -6.584 1.00 0.00 O ATOM 0 H SER A 83 12.962 -5.431 -6.671 1.00 0.00 H new ATOM 0 HA SER A 83 10.477 -6.502 -7.386 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.434 -8.388 -8.428 1.00 0.00 H new ATOM 0 HB3 SER A 83 12.781 -8.457 -7.310 1.00 0.00 H new ATOM 0 HG SER A 83 11.203 -10.102 -6.885 1.00 0.00 H new ATOM 1285 N THR A 84 10.190 -6.179 -4.955 1.00 0.00 N ATOM 1286 CA THR A 84 9.945 -6.052 -3.525 1.00 0.00 C ATOM 1287 C THR A 84 8.659 -6.764 -3.122 1.00 0.00 C ATOM 1288 O THR A 84 7.696 -6.806 -3.888 1.00 0.00 O ATOM 1289 CB THR A 84 9.856 -4.575 -3.099 1.00 0.00 C ATOM 1290 OG1 THR A 84 10.286 -3.729 -4.170 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.709 -4.314 -1.867 1.00 0.00 C ATOM 0 H THR A 84 9.455 -5.788 -5.545 1.00 0.00 H new ATOM 0 HA THR A 84 10.789 -6.518 -3.017 1.00 0.00 H new ATOM 0 HB THR A 84 8.817 -4.353 -2.856 1.00 0.00 H new ATOM 0 HG1 THR A 84 9.503 -3.369 -4.637 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.630 -3.264 -1.585 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.360 -4.938 -1.044 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.749 -4.553 -2.087 1.00 0.00 H new ATOM 1299 N ASP A 85 8.649 -7.323 -1.917 1.00 0.00 N ATOM 1300 CA ASP A 85 7.479 -8.032 -1.412 1.00 0.00 C ATOM 1301 C ASP A 85 6.253 -7.125 -1.410 1.00 0.00 C ATOM 1302 O ASP A 85 5.176 -7.520 -1.857 1.00 0.00 O ATOM 1303 CB ASP A 85 7.744 -8.556 0.001 1.00 0.00 C ATOM 1304 CG ASP A 85 9.111 -9.198 0.134 1.00 0.00 C ATOM 1305 OD1 ASP A 85 9.982 -8.608 0.806 1.00 0.00 O ATOM 1306 OD2 ASP A 85 9.309 -10.292 -0.435 1.00 0.00 O ATOM 0 H ASP A 85 9.438 -7.299 -1.271 1.00 0.00 H new ATOM 0 HA ASP A 85 7.283 -8.876 -2.073 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.661 -7.734 0.712 1.00 0.00 H new ATOM 0 HB3 ASP A 85 6.977 -9.284 0.265 1.00 0.00 H new ATOM 1311 N VAL A 86 6.424 -5.908 -0.903 1.00 0.00 N ATOM 1312 CA VAL A 86 5.331 -4.945 -0.843 1.00 0.00 C ATOM 1313 C VAL A 86 4.688 -4.758 -2.214 1.00 0.00 C ATOM 1314 O VAL A 86 3.471 -4.618 -2.324 1.00 0.00 O ATOM 1315 CB VAL A 86 5.815 -3.578 -0.325 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.251 -3.683 1.129 1.00 0.00 C ATOM 1317 CG2 VAL A 86 6.948 -3.050 -1.192 1.00 0.00 C ATOM 0 H VAL A 86 7.309 -5.566 -0.528 1.00 0.00 H new ATOM 0 HA VAL A 86 4.592 -5.347 -0.150 1.00 0.00 H new ATOM 0 HB VAL A 86 4.986 -2.873 -0.382 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.590 -2.708 1.479 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.410 -4.015 1.738 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.066 -4.402 1.213 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.277 -2.083 -0.811 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.781 -3.752 -1.169 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.598 -2.936 -2.218 1.00 0.00 H new ATOM 1327 N ALA A 87 5.515 -4.754 -3.254 1.00 0.00 N ATOM 1328 CA ALA A 87 5.027 -4.587 -4.617 1.00 0.00 C ATOM 1329 C ALA A 87 4.084 -5.720 -5.006 1.00 0.00 C ATOM 1330 O ALA A 87 3.006 -5.485 -5.554 1.00 0.00 O ATOM 1331 CB ALA A 87 6.195 -4.512 -5.590 1.00 0.00 C ATOM 0 H ALA A 87 6.526 -4.865 -3.179 1.00 0.00 H new ATOM 0 HA ALA A 87 4.468 -3.653 -4.664 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.816 -4.387 -6.604 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.829 -3.664 -5.333 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.777 -5.431 -5.531 1.00 0.00 H new ATOM 1337 N LYS A 88 4.495 -6.951 -4.720 1.00 0.00 N ATOM 1338 CA LYS A 88 3.688 -8.122 -5.040 1.00 0.00 C ATOM 1339 C LYS A 88 2.408 -8.142 -4.210 1.00 0.00 C ATOM 1340 O LYS A 88 1.313 -8.323 -4.744 1.00 0.00 O ATOM 1341 CB LYS A 88 4.488 -9.402 -4.792 1.00 0.00 C ATOM 1342 CG LYS A 88 3.700 -10.673 -5.056 1.00 0.00 C ATOM 1343 CD LYS A 88 3.164 -11.275 -3.767 1.00 0.00 C ATOM 1344 CE LYS A 88 2.849 -12.754 -3.932 1.00 0.00 C ATOM 1345 NZ LYS A 88 4.041 -13.608 -3.672 1.00 0.00 N ATOM 0 H LYS A 88 5.384 -7.163 -4.267 1.00 0.00 H new ATOM 0 HA LYS A 88 3.417 -8.069 -6.095 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.374 -9.395 -5.427 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.836 -9.408 -3.759 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.871 -10.455 -5.729 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.337 -11.399 -5.560 1.00 0.00 H new ATOM 0 HD2 LYS A 88 3.897 -11.145 -2.971 1.00 0.00 H new ATOM 0 HD3 LYS A 88 2.264 -10.742 -3.462 1.00 0.00 H new ATOM 0 HE2 LYS A 88 2.047 -13.033 -3.249 1.00 0.00 H new ATOM 0 HE3 LYS A 88 2.485 -12.937 -4.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 3.785 -14.608 -3.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.798 -13.360 -4.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 4.374 -13.453 -2.699 1.00 0.00 H new ATOM 1359 N THR A 89 2.552 -7.953 -2.902 1.00 0.00 N ATOM 1360 CA THR A 89 1.407 -7.949 -1.999 1.00 0.00 C ATOM 1361 C THR A 89 0.388 -6.892 -2.409 1.00 0.00 C ATOM 1362 O THR A 89 -0.819 -7.102 -2.293 1.00 0.00 O ATOM 1363 CB THR A 89 1.841 -7.691 -0.545 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.750 -8.712 -0.116 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.634 -7.659 0.382 1.00 0.00 C ATOM 0 H THR A 89 3.451 -7.801 -2.444 1.00 0.00 H new ATOM 0 HA THR A 89 0.949 -8.936 -2.064 1.00 0.00 H new ATOM 0 HB THR A 89 2.338 -6.722 -0.504 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.624 -8.569 -0.535 1.00 0.00 H new ATOM 0 HG21 THR A 89 0.965 -7.475 1.404 1.00 0.00 H new ATOM 0 HG22 THR A 89 -0.043 -6.863 0.071 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.114 -8.616 0.335 1.00 0.00 H new ATOM 1373 N PHE A 90 0.882 -5.755 -2.889 1.00 0.00 N ATOM 1374 CA PHE A 90 0.013 -4.664 -3.315 1.00 0.00 C ATOM 1375 C PHE A 90 -0.725 -5.028 -4.600 1.00 0.00 C ATOM 1376 O PHE A 90 -1.955 -5.078 -4.629 1.00 0.00 O ATOM 1377 CB PHE A 90 0.829 -3.387 -3.527 1.00 0.00 C ATOM 1378 CG PHE A 90 0.044 -2.271 -4.154 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.563 -1.305 -3.368 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.088 -2.188 -5.531 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -1.286 -0.276 -3.942 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -0.809 -1.162 -6.111 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.409 -0.205 -5.316 1.00 0.00 C ATOM 0 H PHE A 90 1.879 -5.565 -2.993 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.723 -4.491 -2.530 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.219 -3.051 -2.566 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.688 -3.615 -4.158 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.470 -1.357 -2.293 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.378 -2.934 -6.158 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.754 0.471 -3.318 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.903 -1.108 -7.186 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.973 0.597 -5.768 1.00 0.00 H new ATOM 1393 N ARG A 91 0.034 -5.278 -5.662 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.546 -5.635 -6.950 1.00 0.00 C ATOM 1395 C ARG A 91 -1.526 -6.796 -6.802 1.00 0.00 C ATOM 1396 O ARG A 91 -2.528 -6.871 -7.514 1.00 0.00 O ATOM 1397 CB ARG A 91 0.554 -6.005 -7.945 1.00 0.00 C ATOM 1398 CG ARG A 91 0.207 -5.678 -9.388 1.00 0.00 C ATOM 1399 CD ARG A 91 -0.017 -4.187 -9.583 1.00 0.00 C ATOM 1400 NE ARG A 91 0.004 -3.810 -10.994 1.00 0.00 N ATOM 1401 CZ ARG A 91 1.097 -3.847 -11.748 1.00 0.00 C ATOM 1402 NH1 ARG A 91 2.251 -4.243 -11.230 1.00 0.00 N ATOM 1403 NH2 ARG A 91 1.035 -3.488 -13.024 1.00 0.00 N ATOM 0 H ARG A 91 1.053 -5.240 -5.655 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.090 -4.769 -7.327 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.470 -5.480 -7.673 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.762 -7.072 -7.863 1.00 0.00 H new ATOM 0 HG2 ARG A 91 1.011 -6.015 -10.042 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.691 -6.223 -9.680 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -0.975 -3.904 -9.147 1.00 0.00 H new ATOM 0 HD3 ARG A 91 0.753 -3.632 -9.048 1.00 0.00 H new ATOM 0 HE ARG A 91 -0.868 -3.502 -11.424 1.00 0.00 H new ATOM 0 HH11 ARG A 91 2.302 -4.520 -10.250 1.00 0.00 H new ATOM 0 HH12 ARG A 91 3.088 -4.270 -11.812 1.00 0.00 H new ATOM 0 HH21 ARG A 91 0.148 -3.184 -13.426 1.00 0.00 H new ATOM 0 HH22 ARG A 91 1.874 -3.516 -13.603 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.228 -7.700 -5.876 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.081 -8.857 -5.633 1.00 0.00 C ATOM 1419 C LYS A 92 -3.304 -8.469 -4.808 1.00 0.00 C ATOM 1420 O LYS A 92 -4.439 -8.603 -5.264 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.294 -9.954 -4.911 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.506 -10.854 -5.849 1.00 0.00 C ATOM 1423 CD LYS A 92 -0.621 -12.314 -5.445 1.00 0.00 C ATOM 1424 CE LYS A 92 -0.387 -13.239 -6.629 1.00 0.00 C ATOM 1425 NZ LYS A 92 0.793 -14.122 -6.420 1.00 0.00 N ATOM 0 H LYS A 92 -0.401 -7.654 -5.281 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.420 -9.235 -6.597 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.607 -9.491 -4.203 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.986 -10.565 -4.331 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.871 -10.727 -6.868 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.542 -10.556 -5.846 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.104 -12.534 -4.661 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.610 -12.500 -5.026 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -1.274 -13.851 -6.792 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -0.240 -12.644 -7.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.656 -15.013 -6.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 1.649 -13.646 -6.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.899 -14.325 -5.406 1.00 0.00 H new ATOM 1439 N ALA A 93 -3.064 -7.985 -3.594 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.146 -7.573 -2.707 1.00 0.00 C ATOM 1441 C ALA A 93 -5.097 -6.613 -3.413 1.00 0.00 C ATOM 1442 O ALA A 93 -6.311 -6.825 -3.428 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.582 -6.931 -1.449 1.00 0.00 C ATOM 0 H ALA A 93 -2.130 -7.868 -3.202 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.711 -8.462 -2.425 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.401 -6.628 -0.796 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -2.948 -7.648 -0.927 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.992 -6.056 -1.720 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.540 -5.556 -3.995 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.341 -4.564 -4.702 1.00 0.00 C ATOM 1451 C ILE A 94 -6.160 -5.209 -5.814 1.00 0.00 C ATOM 1452 O ILE A 94 -7.204 -4.692 -6.209 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.457 -3.457 -5.307 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.141 -2.095 -5.165 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.160 -3.757 -6.769 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.348 -1.104 -4.343 1.00 0.00 C ATOM 0 H ILE A 94 -3.538 -5.365 -3.991 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.015 -4.121 -3.969 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.513 -3.427 -4.763 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.311 -1.678 -6.157 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.120 -2.235 -4.706 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.535 -2.966 -7.183 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.638 -4.711 -6.846 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.095 -3.810 -7.327 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -4.893 -0.162 -4.284 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.200 -1.501 -3.339 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.379 -0.935 -4.813 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.682 -6.344 -6.312 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.371 -7.063 -7.378 1.00 0.00 C ATOM 1470 C ASN A 95 -7.289 -8.138 -6.804 1.00 0.00 C ATOM 1471 O ASN A 95 -7.671 -9.079 -7.500 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.357 -7.697 -8.332 1.00 0.00 C ATOM 1473 CG ASN A 95 -4.904 -6.738 -9.415 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -5.535 -5.709 -9.653 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -3.803 -7.073 -10.079 1.00 0.00 N ATOM 0 H ASN A 95 -4.820 -6.786 -5.995 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.980 -6.348 -7.930 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.490 -8.035 -7.764 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.799 -8.580 -8.794 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.450 -6.467 -10.819 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.311 -7.936 -9.848 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.639 -7.991 -5.531 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.514 -8.947 -4.863 1.00 0.00 C ATOM 1484 C LYS A 96 -7.850 -10.316 -4.765 1.00 0.00 C ATOM 1485 O LYS A 96 -8.506 -11.317 -4.477 1.00 0.00 O ATOM 1486 CB LYS A 96 -9.843 -9.066 -5.613 1.00 0.00 C ATOM 1487 CG LYS A 96 -11.002 -8.383 -4.909 1.00 0.00 C ATOM 1488 CD LYS A 96 -12.341 -8.915 -5.393 1.00 0.00 C ATOM 1489 CE LYS A 96 -12.902 -9.961 -4.442 1.00 0.00 C ATOM 1490 NZ LYS A 96 -14.323 -10.283 -4.749 1.00 0.00 N ATOM 0 H LYS A 96 -7.330 -7.219 -4.941 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.705 -8.582 -3.854 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -9.729 -8.636 -6.608 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -10.081 -10.121 -5.747 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -10.916 -8.536 -3.833 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -10.952 -7.308 -5.083 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.048 -8.091 -5.488 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.224 -9.350 -6.386 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.302 -10.869 -4.505 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -12.825 -9.599 -3.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -14.669 -10.999 -4.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.900 -9.422 -4.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -14.394 -10.653 -5.719 1.00 0.00 H new ATOM 1504 N LYS A 97 -6.544 -10.353 -5.004 1.00 0.00 N ATOM 1505 CA LYS A 97 -5.788 -11.599 -4.940 1.00 0.00 C ATOM 1506 C LYS A 97 -6.279 -12.587 -5.995 1.00 0.00 C ATOM 1507 O LYS A 97 -6.423 -13.769 -5.689 1.00 0.00 O ATOM 1508 CB LYS A 97 -5.907 -12.221 -3.548 1.00 0.00 C ATOM 1509 CG LYS A 97 -5.720 -11.223 -2.417 1.00 0.00 C ATOM 1510 CD LYS A 97 -7.028 -10.943 -1.698 1.00 0.00 C ATOM 1511 CE LYS A 97 -7.295 -9.450 -1.587 1.00 0.00 C ATOM 1512 NZ LYS A 97 -8.684 -9.168 -1.132 1.00 0.00 N ATOM 0 H LYS A 97 -5.986 -9.534 -5.244 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.741 -11.371 -5.140 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.887 -12.688 -3.451 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.165 -13.013 -3.449 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.989 -11.610 -1.707 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -5.316 -10.292 -2.815 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -7.848 -11.421 -2.233 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -6.998 -11.383 -0.701 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -6.587 -9.005 -0.888 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -7.127 -8.978 -2.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -8.742 -8.192 -0.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.341 -9.287 -1.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.940 -9.828 -0.370 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.583 7.871 -1.279 1.00 0.00 CA HETATM 1528 CA CA A 102 4.023 12.682 -2.261 1.00 0.00 CA