USER MOD reduce.3.24.130724 H: found=0, std=0, add=386, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 389 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 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 98:sc= 0.629 USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=-0.0047) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 ASN : amide:sc= -0.447 K(o=-0.45,f=-1.9) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ -106:sc= -0.133 (180deg=-1.94) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= -0.719 (180deg=-0.719) USER MOD Single : A 145 THR OG1 : rot -61:sc= 1.05 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 159 SER OG : rot 55:sc= 0.947 USER MOD Single : A 160 THR OG1 : rot 180:sc= -1.35 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 ASN : amide:sc= -0.615 K(o=-0.61,f=-8.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 100 2.237 0.152 0.027 1.00 0.00 N ATOM 2 CA MET A 100 2.765 0.047 -1.328 1.00 0.00 C ATOM 3 C MET A 100 3.091 -1.403 -1.673 1.00 0.00 C ATOM 4 O MET A 100 3.230 -2.246 -0.786 1.00 0.00 O ATOM 5 CB MET A 100 4.016 0.913 -1.480 1.00 0.00 C ATOM 6 CG MET A 100 3.725 2.405 -1.485 1.00 0.00 C ATOM 7 SD MET A 100 4.041 3.180 0.112 1.00 0.00 S ATOM 8 CE MET A 100 2.454 3.945 0.437 1.00 0.00 C ATOM 0 HA MET A 100 2.000 0.403 -2.018 1.00 0.00 H new ATOM 0 HB2 MET A 100 4.705 0.688 -0.666 1.00 0.00 H new ATOM 0 HB3 MET A 100 4.522 0.647 -2.408 1.00 0.00 H new ATOM 0 HG2 MET A 100 4.337 2.888 -2.246 1.00 0.00 H new ATOM 0 HG3 MET A 100 2.684 2.567 -1.763 1.00 0.00 H new ATOM 0 HE1 MET A 100 2.490 4.466 1.394 1.00 0.00 H new ATOM 0 HE2 MET A 100 2.224 4.657 -0.355 1.00 0.00 H new ATOM 0 HE3 MET A 100 1.680 3.178 0.470 1.00 0.00 H new ATOM 18 N LEU A 101 3.211 -1.686 -2.965 1.00 0.00 N ATOM 19 CA LEU A 101 3.521 -3.034 -3.428 1.00 0.00 C ATOM 20 C LEU A 101 4.863 -3.067 -4.152 1.00 0.00 C ATOM 21 O LEU A 101 5.290 -2.071 -4.737 1.00 0.00 O ATOM 22 CB LEU A 101 2.416 -3.543 -4.355 1.00 0.00 C ATOM 23 CG LEU A 101 2.710 -4.848 -5.097 1.00 0.00 C ATOM 24 CD1 LEU A 101 2.858 -5.999 -4.114 1.00 0.00 C ATOM 25 CD2 LEU A 101 1.613 -5.145 -6.108 1.00 0.00 C ATOM 0 H LEU A 101 3.098 -1.000 -3.711 1.00 0.00 H new ATOM 0 HA LEU A 101 3.584 -3.685 -2.556 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.509 -3.680 -3.766 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.203 -2.769 -5.092 1.00 0.00 H new ATOM 0 HG LEU A 101 3.651 -4.734 -5.635 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.067 -6.919 -4.660 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.679 -5.789 -3.429 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.934 -6.115 -3.548 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.839 -6.077 -6.627 1.00 0.00 H new ATOM 0 HD22 LEU A 101 0.658 -5.239 -5.591 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.555 -4.332 -6.832 1.00 0.00 H new ATOM 37 N THR A 102 5.525 -4.220 -4.110 1.00 0.00 N ATOM 38 CA THR A 102 6.818 -4.383 -4.762 1.00 0.00 C ATOM 39 C THR A 102 6.715 -5.322 -5.958 1.00 0.00 C ATOM 40 O THR A 102 6.187 -6.429 -5.848 1.00 0.00 O ATOM 41 CB THR A 102 7.875 -4.928 -3.784 1.00 0.00 C ATOM 42 OG1 THR A 102 7.757 -4.271 -2.518 1.00 0.00 O ATOM 43 CG2 THR A 102 9.278 -4.726 -4.337 1.00 0.00 C ATOM 0 H THR A 102 5.186 -5.054 -3.631 1.00 0.00 H new ATOM 0 HA THR A 102 7.127 -3.395 -5.105 1.00 0.00 H new ATOM 0 HB THR A 102 7.702 -5.996 -3.655 1.00 0.00 H new ATOM 0 HG1 THR A 102 7.234 -4.830 -1.907 1.00 0.00 H new ATOM 0 HG21 THR A 102 10.008 -5.119 -3.629 1.00 0.00 H new ATOM 0 HG22 THR A 102 9.374 -5.252 -5.287 1.00 0.00 H new ATOM 0 HG23 THR A 102 9.458 -3.662 -4.492 1.00 0.00 H new ATOM 51 N CYS A 103 7.224 -4.875 -7.101 1.00 0.00 N ATOM 52 CA CYS A 103 7.190 -5.676 -8.319 1.00 0.00 C ATOM 53 C CYS A 103 8.570 -5.737 -8.968 1.00 0.00 C ATOM 54 O CYS A 103 9.339 -4.777 -8.911 1.00 0.00 O ATOM 55 CB CYS A 103 6.175 -5.098 -9.307 1.00 0.00 C ATOM 56 SG CYS A 103 4.515 -4.841 -8.602 1.00 0.00 S ATOM 0 H CYS A 103 7.665 -3.962 -7.209 1.00 0.00 H new ATOM 0 HA CYS A 103 6.889 -6.688 -8.050 1.00 0.00 H new ATOM 0 HB2 CYS A 103 6.550 -4.146 -9.682 1.00 0.00 H new ATOM 0 HB3 CYS A 103 6.095 -5.768 -10.163 1.00 0.00 H new ATOM 61 N LEU A 104 8.877 -6.873 -9.585 1.00 0.00 N ATOM 62 CA LEU A 104 10.164 -7.061 -10.246 1.00 0.00 C ATOM 63 C LEU A 104 10.257 -6.210 -11.509 1.00 0.00 C ATOM 64 O LEU A 104 9.242 -5.858 -12.108 1.00 0.00 O ATOM 65 CB LEU A 104 10.371 -8.536 -10.595 1.00 0.00 C ATOM 66 CG LEU A 104 10.770 -9.450 -9.435 1.00 0.00 C ATOM 67 CD1 LEU A 104 10.762 -10.905 -9.876 1.00 0.00 C ATOM 68 CD2 LEU A 104 12.138 -9.060 -8.896 1.00 0.00 C ATOM 0 H LEU A 104 8.253 -7.678 -9.641 1.00 0.00 H new ATOM 0 HA LEU A 104 10.947 -6.744 -9.557 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.449 -8.918 -11.032 1.00 0.00 H new ATOM 0 HB3 LEU A 104 11.140 -8.602 -11.365 1.00 0.00 H new ATOM 0 HG LEU A 104 10.040 -9.331 -8.635 1.00 0.00 H new ATOM 0 HD11 LEU A 104 11.048 -11.541 -9.038 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.762 -11.178 -10.213 1.00 0.00 H new ATOM 0 HD13 LEU A 104 11.470 -11.041 -10.693 1.00 0.00 H new ATOM 0 HD21 LEU A 104 12.406 -9.721 -8.071 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.881 -9.150 -9.689 1.00 0.00 H new ATOM 0 HD23 LEU A 104 12.109 -8.030 -8.541 1.00 0.00 H new ATOM 80 N ASN A 105 11.482 -5.885 -11.909 1.00 0.00 N ATOM 81 CA ASN A 105 11.708 -5.077 -13.102 1.00 0.00 C ATOM 82 C ASN A 105 12.850 -5.648 -13.937 1.00 0.00 C ATOM 83 O ASN A 105 13.632 -4.904 -14.530 1.00 0.00 O ATOM 84 CB ASN A 105 12.019 -3.631 -12.713 1.00 0.00 C ATOM 85 CG ASN A 105 11.587 -2.640 -13.776 1.00 0.00 C ATOM 86 OD1 ASN A 105 10.396 -2.479 -14.043 1.00 0.00 O ATOM 87 ND2 ASN A 105 12.556 -1.971 -14.390 1.00 0.00 N ATOM 0 H ASN A 105 12.334 -6.169 -11.424 1.00 0.00 H new ATOM 0 HA ASN A 105 10.798 -5.097 -13.702 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.518 -3.394 -11.775 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.090 -3.527 -12.537 1.00 0.00 H new ATOM 0 HD21 ASN A 105 12.326 -1.292 -15.115 1.00 0.00 H new ATOM 0 HD22 ASN A 105 13.530 -2.137 -14.136 1.00 0.00 H new ATOM 180 N GLY A 112 17.582 -9.751 -9.441 1.00 0.00 N ATOM 181 CA GLY A 112 17.024 -9.231 -8.206 1.00 0.00 C ATOM 182 C GLY A 112 16.623 -7.774 -8.319 1.00 0.00 C ATOM 183 O GLY A 112 16.566 -7.058 -7.319 1.00 0.00 O ATOM 0 HA2 GLY A 112 16.153 -9.824 -7.927 1.00 0.00 H new ATOM 0 HA3 GLY A 112 17.755 -9.342 -7.405 1.00 0.00 H new ATOM 187 N LYS A 113 16.346 -7.331 -9.541 1.00 0.00 N ATOM 188 CA LYS A 113 15.948 -5.949 -9.783 1.00 0.00 C ATOM 189 C LYS A 113 14.435 -5.791 -9.672 1.00 0.00 C ATOM 190 O LYS A 113 13.677 -6.496 -10.338 1.00 0.00 O ATOM 191 CB LYS A 113 16.420 -5.496 -11.166 1.00 0.00 C ATOM 192 CG LYS A 113 17.816 -4.898 -11.167 1.00 0.00 C ATOM 193 CD LYS A 113 17.800 -3.446 -11.616 1.00 0.00 C ATOM 194 CE LYS A 113 19.209 -2.908 -11.813 1.00 0.00 C ATOM 195 NZ LYS A 113 19.287 -1.963 -12.961 1.00 0.00 N ATOM 0 H LYS A 113 16.390 -7.910 -10.380 1.00 0.00 H new ATOM 0 HA LYS A 113 16.417 -5.323 -9.023 1.00 0.00 H new ATOM 0 HB2 LYS A 113 16.399 -6.348 -11.845 1.00 0.00 H new ATOM 0 HB3 LYS A 113 15.718 -4.759 -11.557 1.00 0.00 H new ATOM 0 HG2 LYS A 113 18.243 -4.966 -10.166 1.00 0.00 H new ATOM 0 HG3 LYS A 113 18.461 -5.477 -11.828 1.00 0.00 H new ATOM 0 HD2 LYS A 113 17.242 -3.359 -12.548 1.00 0.00 H new ATOM 0 HD3 LYS A 113 17.279 -2.841 -10.875 1.00 0.00 H new ATOM 0 HE2 LYS A 113 19.535 -2.403 -10.904 1.00 0.00 H new ATOM 0 HE3 LYS A 113 19.895 -3.739 -11.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 20.263 -1.619 -13.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 19.000 -2.452 -13.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 18.652 -1.157 -12.791 1.00 0.00 H new ATOM 209 N PHE A 114 14.003 -4.860 -8.828 1.00 0.00 N ATOM 210 CA PHE A 114 12.580 -4.609 -8.631 1.00 0.00 C ATOM 211 C PHE A 114 12.331 -3.151 -8.256 1.00 0.00 C ATOM 212 O PHE A 114 13.258 -2.427 -7.893 1.00 0.00 O ATOM 213 CB PHE A 114 12.024 -5.529 -7.542 1.00 0.00 C ATOM 214 CG PHE A 114 12.753 -5.418 -6.234 1.00 0.00 C ATOM 215 CD1 PHE A 114 13.860 -6.210 -5.974 1.00 0.00 C ATOM 216 CD2 PHE A 114 12.332 -4.522 -5.265 1.00 0.00 C ATOM 217 CE1 PHE A 114 14.533 -6.111 -4.771 1.00 0.00 C ATOM 218 CE2 PHE A 114 13.001 -4.418 -4.060 1.00 0.00 C ATOM 219 CZ PHE A 114 14.103 -5.213 -3.813 1.00 0.00 C ATOM 0 H PHE A 114 14.617 -4.267 -8.270 1.00 0.00 H new ATOM 0 HA PHE A 114 12.067 -4.817 -9.570 1.00 0.00 H new ATOM 0 HB2 PHE A 114 10.971 -5.296 -7.383 1.00 0.00 H new ATOM 0 HB3 PHE A 114 12.073 -6.561 -7.890 1.00 0.00 H new ATOM 0 HD1 PHE A 114 14.201 -6.913 -6.720 1.00 0.00 H new ATOM 0 HD2 PHE A 114 11.471 -3.898 -5.453 1.00 0.00 H new ATOM 0 HE1 PHE A 114 15.394 -6.735 -4.580 1.00 0.00 H new ATOM 0 HE2 PHE A 114 12.662 -3.716 -3.312 1.00 0.00 H new ATOM 0 HZ PHE A 114 14.628 -5.133 -2.872 1.00 0.00 H new ATOM 229 N GLN A 115 11.075 -2.728 -8.348 1.00 0.00 N ATOM 230 CA GLN A 115 10.705 -1.356 -8.020 1.00 0.00 C ATOM 231 C GLN A 115 9.422 -1.321 -7.196 1.00 0.00 C ATOM 232 O GLN A 115 8.663 -2.290 -7.170 1.00 0.00 O ATOM 233 CB GLN A 115 10.527 -0.534 -9.298 1.00 0.00 C ATOM 234 CG GLN A 115 10.741 0.957 -9.096 1.00 0.00 C ATOM 235 CD GLN A 115 11.597 1.577 -10.183 1.00 0.00 C ATOM 236 OE1 GLN A 115 11.189 1.653 -11.343 1.00 0.00 O ATOM 237 NE2 GLN A 115 12.791 2.024 -9.814 1.00 0.00 N ATOM 0 H GLN A 115 10.296 -3.315 -8.647 1.00 0.00 H new ATOM 0 HA GLN A 115 11.509 -0.921 -7.426 1.00 0.00 H new ATOM 0 HB2 GLN A 115 11.227 -0.894 -10.052 1.00 0.00 H new ATOM 0 HB3 GLN A 115 9.523 -0.699 -9.689 1.00 0.00 H new ATOM 0 HG2 GLN A 115 9.774 1.459 -9.070 1.00 0.00 H new ATOM 0 HG3 GLN A 115 11.213 1.124 -8.128 1.00 0.00 H new ATOM 0 HE21 GLN A 115 13.089 1.941 -8.842 1.00 0.00 H new ATOM 0 HE22 GLN A 115 13.411 2.451 -10.502 1.00 0.00 H new ATOM 246 N ILE A 116 9.187 -0.198 -6.525 1.00 0.00 N ATOM 247 CA ILE A 116 7.995 -0.037 -5.701 1.00 0.00 C ATOM 248 C ILE A 116 6.855 0.587 -6.499 1.00 0.00 C ATOM 249 O ILE A 116 6.969 1.710 -6.990 1.00 0.00 O ATOM 250 CB ILE A 116 8.280 0.836 -4.465 1.00 0.00 C ATOM 251 CG1 ILE A 116 9.270 0.134 -3.534 1.00 0.00 C ATOM 252 CG2 ILE A 116 6.985 1.151 -3.729 1.00 0.00 C ATOM 253 CD1 ILE A 116 9.626 0.944 -2.307 1.00 0.00 C ATOM 0 H ILE A 116 9.806 0.613 -6.536 1.00 0.00 H new ATOM 0 HA ILE A 116 7.701 -1.034 -5.372 1.00 0.00 H new ATOM 0 HB ILE A 116 8.725 1.774 -4.797 1.00 0.00 H new ATOM 0 HG12 ILE A 116 8.846 -0.820 -3.219 1.00 0.00 H new ATOM 0 HG13 ILE A 116 10.181 -0.090 -4.088 1.00 0.00 H new ATOM 0 HG21 ILE A 116 7.203 1.769 -2.858 1.00 0.00 H new ATOM 0 HG22 ILE A 116 6.309 1.688 -4.395 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.514 0.222 -3.407 1.00 0.00 H new ATOM 0 HD11 ILE A 116 10.332 0.384 -1.693 1.00 0.00 H new ATOM 0 HD12 ILE A 116 10.079 1.887 -2.612 1.00 0.00 H new ATOM 0 HD13 ILE A 116 8.724 1.146 -1.730 1.00 0.00 H new ATOM 265 N CYS A 117 5.755 -0.149 -6.623 1.00 0.00 N ATOM 266 CA CYS A 117 4.593 0.332 -7.360 1.00 0.00 C ATOM 267 C CYS A 117 3.768 1.292 -6.508 1.00 0.00 C ATOM 268 O CYS A 117 3.462 1.005 -5.350 1.00 0.00 O ATOM 269 CB CYS A 117 3.724 -0.846 -7.807 1.00 0.00 C ATOM 270 SG CYS A 117 4.659 -2.214 -8.562 1.00 0.00 S ATOM 0 H CYS A 117 5.644 -1.081 -6.222 1.00 0.00 H new ATOM 0 HA CYS A 117 4.948 0.868 -8.240 1.00 0.00 H new ATOM 0 HB2 CYS A 117 3.176 -1.227 -6.945 1.00 0.00 H new ATOM 0 HB3 CYS A 117 2.984 -0.487 -8.523 1.00 0.00 H new ATOM 275 N ARG A 118 3.410 2.432 -7.089 1.00 0.00 N ATOM 276 CA ARG A 118 2.621 3.435 -6.384 1.00 0.00 C ATOM 277 C ARG A 118 1.152 3.353 -6.786 1.00 0.00 C ATOM 278 O ARG A 118 0.736 2.416 -7.467 1.00 0.00 O ATOM 279 CB ARG A 118 3.163 4.837 -6.673 1.00 0.00 C ATOM 280 CG ARG A 118 4.675 4.939 -6.569 1.00 0.00 C ATOM 281 CD ARG A 118 5.166 6.332 -6.929 1.00 0.00 C ATOM 282 NE ARG A 118 6.313 6.292 -7.833 1.00 0.00 N ATOM 283 CZ ARG A 118 6.700 7.324 -8.574 1.00 0.00 C ATOM 284 NH1 ARG A 118 6.037 8.470 -8.520 1.00 0.00 N ATOM 285 NH2 ARG A 118 7.754 7.210 -9.373 1.00 0.00 N ATOM 0 H ARG A 118 3.654 2.684 -8.047 1.00 0.00 H new ATOM 0 HA ARG A 118 2.699 3.236 -5.315 1.00 0.00 H new ATOM 0 HB2 ARG A 118 2.855 5.137 -7.675 1.00 0.00 H new ATOM 0 HB3 ARG A 118 2.711 5.543 -5.976 1.00 0.00 H new ATOM 0 HG2 ARG A 118 4.988 4.693 -5.554 1.00 0.00 H new ATOM 0 HG3 ARG A 118 5.136 4.207 -7.232 1.00 0.00 H new ATOM 0 HD2 ARG A 118 4.356 6.892 -7.396 1.00 0.00 H new ATOM 0 HD3 ARG A 118 5.440 6.866 -6.019 1.00 0.00 H new ATOM 0 HE ARG A 118 6.845 5.424 -7.899 1.00 0.00 H new ATOM 0 HH11 ARG A 118 5.226 8.562 -7.908 1.00 0.00 H new ATOM 0 HH12 ARG A 118 6.337 9.260 -9.091 1.00 0.00 H new ATOM 0 HH21 ARG A 118 8.267 6.330 -9.418 1.00 0.00 H new ATOM 0 HH22 ARG A 118 8.051 8.003 -9.942 1.00 0.00 H new ATOM 299 N ASN A 119 0.371 4.340 -6.359 1.00 0.00 N ATOM 300 CA ASN A 119 -1.053 4.378 -6.674 1.00 0.00 C ATOM 301 C ASN A 119 -1.289 4.118 -8.159 1.00 0.00 C ATOM 302 O ASN A 119 -0.428 4.393 -8.992 1.00 0.00 O ATOM 303 CB ASN A 119 -1.647 5.732 -6.281 1.00 0.00 C ATOM 304 CG ASN A 119 -3.163 5.708 -6.238 1.00 0.00 C ATOM 305 OD1 ASN A 119 -3.823 5.646 -7.276 1.00 0.00 O ATOM 306 ND2 ASN A 119 -3.721 5.758 -5.035 1.00 0.00 N ATOM 0 H ASN A 119 0.699 5.123 -5.795 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.547 3.592 -6.103 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -1.263 6.024 -5.304 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.318 6.490 -6.992 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -4.737 5.746 -4.943 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -3.134 5.809 -4.202 1.00 0.00 H new ATOM 313 N GLY A 120 -2.464 3.586 -8.481 1.00 0.00 N ATOM 314 CA GLY A 120 -2.793 3.298 -9.865 1.00 0.00 C ATOM 315 C GLY A 120 -2.433 1.881 -10.264 1.00 0.00 C ATOM 316 O GLY A 120 -2.995 1.335 -11.213 1.00 0.00 O ATOM 0 H GLY A 120 -3.194 3.349 -7.809 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.860 3.456 -10.022 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.268 3.999 -10.514 1.00 0.00 H new ATOM 320 N GLU A 121 -1.494 1.284 -9.537 1.00 0.00 N ATOM 321 CA GLU A 121 -1.058 -0.078 -9.823 1.00 0.00 C ATOM 322 C GLU A 121 -0.827 -0.858 -8.532 1.00 0.00 C ATOM 323 O GLU A 121 0.250 -0.794 -7.938 1.00 0.00 O ATOM 324 CB GLU A 121 0.224 -0.063 -10.659 1.00 0.00 C ATOM 325 CG GLU A 121 0.192 0.936 -11.803 1.00 0.00 C ATOM 326 CD GLU A 121 1.452 0.898 -12.646 1.00 0.00 C ATOM 327 OE1 GLU A 121 1.576 -0.015 -13.488 1.00 0.00 O ATOM 328 OE2 GLU A 121 2.315 1.782 -12.462 1.00 0.00 O ATOM 0 H GLU A 121 -1.021 1.721 -8.746 1.00 0.00 H new ATOM 0 HA GLU A 121 -1.847 -0.572 -10.390 1.00 0.00 H new ATOM 0 HB2 GLU A 121 1.069 0.168 -10.010 1.00 0.00 H new ATOM 0 HB3 GLU A 121 0.396 -1.061 -11.063 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -0.671 0.730 -12.436 1.00 0.00 H new ATOM 0 HG3 GLU A 121 0.059 1.940 -11.400 1.00 0.00 H new ATOM 335 N LYS A 122 -1.846 -1.594 -8.102 1.00 0.00 N ATOM 336 CA LYS A 122 -1.757 -2.387 -6.882 1.00 0.00 C ATOM 337 C LYS A 122 -1.499 -3.855 -7.205 1.00 0.00 C ATOM 338 O LYS A 122 -1.541 -4.712 -6.321 1.00 0.00 O ATOM 339 CB LYS A 122 -3.045 -2.253 -6.065 1.00 0.00 C ATOM 340 CG LYS A 122 -3.117 -0.974 -5.250 1.00 0.00 C ATOM 341 CD LYS A 122 -4.430 -0.868 -4.493 1.00 0.00 C ATOM 342 CE LYS A 122 -4.650 0.536 -3.951 1.00 0.00 C ATOM 343 NZ LYS A 122 -5.178 0.516 -2.559 1.00 0.00 N ATOM 0 H LYS A 122 -2.744 -1.658 -8.581 1.00 0.00 H new ATOM 0 HA LYS A 122 -0.920 -2.009 -6.294 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -3.900 -2.292 -6.740 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -3.130 -3.107 -5.393 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -2.286 -0.944 -4.545 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -3.006 -0.114 -5.910 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -5.254 -1.137 -5.153 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -4.435 -1.582 -3.669 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -3.709 1.086 -3.975 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.348 1.069 -4.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -5.315 1.492 -2.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -6.088 0.013 -2.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -4.501 0.029 -1.938 1.00 0.00 H new ATOM 357 N ILE A 123 -1.230 -4.138 -8.475 1.00 0.00 N ATOM 358 CA ILE A 123 -0.962 -5.502 -8.913 1.00 0.00 C ATOM 359 C ILE A 123 0.121 -5.533 -9.986 1.00 0.00 C ATOM 360 O ILE A 123 0.229 -4.616 -10.801 1.00 0.00 O ATOM 361 CB ILE A 123 -2.233 -6.176 -9.464 1.00 0.00 C ATOM 362 CG1 ILE A 123 -2.590 -5.599 -10.835 1.00 0.00 C ATOM 363 CG2 ILE A 123 -3.390 -6.000 -8.492 1.00 0.00 C ATOM 364 CD1 ILE A 123 -2.115 -6.450 -11.992 1.00 0.00 C ATOM 0 H ILE A 123 -1.192 -3.441 -9.219 1.00 0.00 H new ATOM 0 HA ILE A 123 -0.618 -6.052 -8.037 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.039 -7.242 -9.579 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.672 -5.483 -10.900 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -2.156 -4.603 -10.925 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.281 -6.482 -8.896 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -3.134 -6.455 -7.535 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -3.586 -4.937 -8.348 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -2.403 -5.980 -12.932 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.030 -6.546 -11.952 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.569 -7.439 -11.927 1.00 0.00 H new ATOM 376 N CYS A 124 0.921 -6.594 -9.981 1.00 0.00 N ATOM 377 CA CYS A 124 1.996 -6.746 -10.954 1.00 0.00 C ATOM 378 C CYS A 124 1.610 -7.746 -12.039 1.00 0.00 C ATOM 379 O CYS A 124 0.583 -8.419 -11.942 1.00 0.00 O ATOM 380 CB CYS A 124 3.281 -7.201 -10.259 1.00 0.00 C ATOM 381 SG CYS A 124 3.501 -6.521 -8.584 1.00 0.00 S ATOM 0 H CYS A 124 0.845 -7.362 -9.314 1.00 0.00 H new ATOM 0 HA CYS A 124 2.168 -5.777 -11.422 1.00 0.00 H new ATOM 0 HB2 CYS A 124 3.284 -8.289 -10.201 1.00 0.00 H new ATOM 0 HB3 CYS A 124 4.135 -6.912 -10.872 1.00 0.00 H new ATOM 386 N PHE A 125 2.440 -7.839 -13.073 1.00 0.00 N ATOM 387 CA PHE A 125 2.186 -8.757 -14.178 1.00 0.00 C ATOM 388 C PHE A 125 3.494 -9.277 -14.765 1.00 0.00 C ATOM 389 O PHE A 125 4.516 -8.591 -14.739 1.00 0.00 O ATOM 390 CB PHE A 125 1.365 -8.063 -15.267 1.00 0.00 C ATOM 391 CG PHE A 125 2.153 -7.064 -16.066 1.00 0.00 C ATOM 392 CD1 PHE A 125 2.507 -5.842 -15.516 1.00 0.00 C ATOM 393 CD2 PHE A 125 2.540 -7.347 -17.366 1.00 0.00 C ATOM 394 CE1 PHE A 125 3.231 -4.921 -16.249 1.00 0.00 C ATOM 395 CE2 PHE A 125 3.264 -6.429 -18.103 1.00 0.00 C ATOM 396 CZ PHE A 125 3.611 -5.215 -17.544 1.00 0.00 C ATOM 0 H PHE A 125 3.294 -7.290 -13.169 1.00 0.00 H new ATOM 0 HA PHE A 125 1.620 -9.604 -13.791 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.959 -8.817 -15.941 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.516 -7.559 -14.805 1.00 0.00 H new ATOM 0 HD1 PHE A 125 2.214 -5.607 -14.503 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.273 -8.295 -17.808 1.00 0.00 H new ATOM 0 HE1 PHE A 125 3.500 -3.972 -15.809 1.00 0.00 H new ATOM 0 HE2 PHE A 125 3.558 -6.661 -19.116 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.178 -4.497 -18.118 1.00 0.00 H new ATOM 406 N LYS A 126 3.456 -10.495 -15.294 1.00 0.00 N ATOM 407 CA LYS A 126 4.637 -11.110 -15.888 1.00 0.00 C ATOM 408 C LYS A 126 4.245 -12.078 -17.000 1.00 0.00 C ATOM 409 O LYS A 126 3.637 -13.118 -16.746 1.00 0.00 O ATOM 410 CB LYS A 126 5.447 -11.846 -14.819 1.00 0.00 C ATOM 411 CG LYS A 126 6.632 -12.615 -15.376 1.00 0.00 C ATOM 412 CD LYS A 126 6.528 -14.099 -15.067 1.00 0.00 C ATOM 413 CE LYS A 126 6.486 -14.355 -13.568 1.00 0.00 C ATOM 414 NZ LYS A 126 7.249 -15.578 -13.193 1.00 0.00 N ATOM 0 H LYS A 126 2.619 -11.077 -15.323 1.00 0.00 H new ATOM 0 HA LYS A 126 5.250 -10.318 -16.318 1.00 0.00 H new ATOM 0 HB2 LYS A 126 5.806 -11.124 -14.086 1.00 0.00 H new ATOM 0 HB3 LYS A 126 4.791 -12.538 -14.291 1.00 0.00 H new ATOM 0 HG2 LYS A 126 6.687 -12.470 -16.455 1.00 0.00 H new ATOM 0 HG3 LYS A 126 7.555 -12.218 -14.954 1.00 0.00 H new ATOM 0 HD2 LYS A 126 5.630 -14.506 -15.532 1.00 0.00 H new ATOM 0 HD3 LYS A 126 7.379 -14.623 -15.503 1.00 0.00 H new ATOM 0 HE2 LYS A 126 6.897 -13.494 -13.041 1.00 0.00 H new ATOM 0 HE3 LYS A 126 5.450 -14.460 -13.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 6.585 -16.343 -12.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 7.846 -15.873 -13.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 7.849 -15.374 -12.369 1.00 0.00 H new ATOM 428 N LYS A 127 4.598 -11.731 -18.233 1.00 0.00 N ATOM 429 CA LYS A 127 4.287 -12.570 -19.384 1.00 0.00 C ATOM 430 C LYS A 127 5.535 -12.830 -20.221 1.00 0.00 C ATOM 431 O LYS A 127 6.576 -12.207 -20.012 1.00 0.00 O ATOM 432 CB LYS A 127 3.210 -11.908 -20.246 1.00 0.00 C ATOM 433 CG LYS A 127 3.609 -10.542 -20.776 1.00 0.00 C ATOM 434 CD LYS A 127 2.725 -10.113 -21.935 1.00 0.00 C ATOM 435 CE LYS A 127 1.797 -8.976 -21.537 1.00 0.00 C ATOM 436 NZ LYS A 127 1.051 -9.280 -20.285 1.00 0.00 N ATOM 0 H LYS A 127 5.100 -10.873 -18.461 1.00 0.00 H new ATOM 0 HA LYS A 127 3.913 -13.525 -19.016 1.00 0.00 H new ATOM 0 HB2 LYS A 127 2.978 -12.561 -21.087 1.00 0.00 H new ATOM 0 HB3 LYS A 127 2.297 -11.808 -19.659 1.00 0.00 H new ATOM 0 HG2 LYS A 127 3.542 -9.806 -19.975 1.00 0.00 H new ATOM 0 HG3 LYS A 127 4.649 -10.566 -21.100 1.00 0.00 H new ATOM 0 HD2 LYS A 127 3.348 -9.799 -22.772 1.00 0.00 H new ATOM 0 HD3 LYS A 127 2.135 -10.963 -22.278 1.00 0.00 H new ATOM 0 HE2 LYS A 127 2.378 -8.064 -21.401 1.00 0.00 H new ATOM 0 HE3 LYS A 127 1.089 -8.786 -22.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 0.430 -8.480 -20.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 0.476 -10.136 -20.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 1.725 -9.437 -19.509 1.00 0.00 H new ATOM 450 N LEU A 128 5.423 -13.753 -21.170 1.00 0.00 N ATOM 451 CA LEU A 128 6.542 -14.094 -22.041 1.00 0.00 C ATOM 452 C LEU A 128 6.656 -13.104 -23.195 1.00 0.00 C ATOM 453 O LEU A 128 5.649 -12.628 -23.721 1.00 0.00 O ATOM 454 CB LEU A 128 6.375 -15.514 -22.587 1.00 0.00 C ATOM 455 CG LEU A 128 7.558 -16.072 -23.378 1.00 0.00 C ATOM 456 CD1 LEU A 128 8.170 -17.262 -22.654 1.00 0.00 C ATOM 457 CD2 LEU A 128 7.122 -16.467 -24.782 1.00 0.00 C ATOM 0 H LEU A 128 4.569 -14.278 -21.356 1.00 0.00 H new ATOM 0 HA LEU A 128 7.457 -14.043 -21.451 1.00 0.00 H new ATOM 0 HB2 LEU A 128 6.176 -16.183 -21.750 1.00 0.00 H new ATOM 0 HB3 LEU A 128 5.493 -15.534 -23.228 1.00 0.00 H new ATOM 0 HG LEU A 128 8.316 -15.293 -23.460 1.00 0.00 H new ATOM 0 HD11 LEU A 128 9.011 -17.646 -23.232 1.00 0.00 H new ATOM 0 HD12 LEU A 128 8.519 -16.949 -21.670 1.00 0.00 H new ATOM 0 HD13 LEU A 128 7.420 -18.044 -22.541 1.00 0.00 H new ATOM 0 HD21 LEU A 128 7.977 -16.862 -25.331 1.00 0.00 H new ATOM 0 HD22 LEU A 128 6.346 -17.230 -24.721 1.00 0.00 H new ATOM 0 HD23 LEU A 128 6.731 -15.592 -25.301 1.00 0.00 H new ATOM 660 N ILE A 139 8.018 -9.959 -19.807 1.00 0.00 N ATOM 661 CA ILE A 139 7.602 -8.590 -19.530 1.00 0.00 C ATOM 662 C ILE A 139 7.109 -8.444 -18.094 1.00 0.00 C ATOM 663 O ILE A 139 5.950 -8.728 -17.793 1.00 0.00 O ATOM 664 CB ILE A 139 6.488 -8.134 -20.491 1.00 0.00 C ATOM 665 CG1 ILE A 139 6.886 -8.423 -21.940 1.00 0.00 C ATOM 666 CG2 ILE A 139 6.198 -6.653 -20.302 1.00 0.00 C ATOM 667 CD1 ILE A 139 8.123 -7.677 -22.388 1.00 0.00 C ATOM 0 HA ILE A 139 8.479 -7.959 -19.677 1.00 0.00 H new ATOM 0 HB ILE A 139 5.581 -8.694 -20.263 1.00 0.00 H new ATOM 0 HG12 ILE A 139 7.056 -9.494 -22.055 1.00 0.00 H new ATOM 0 HG13 ILE A 139 6.056 -8.160 -22.595 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.409 -6.346 -20.988 1.00 0.00 H new ATOM 0 HG22 ILE A 139 5.877 -6.473 -19.276 1.00 0.00 H new ATOM 0 HG23 ILE A 139 7.100 -6.077 -20.506 1.00 0.00 H new ATOM 0 HD11 ILE A 139 8.345 -7.931 -23.425 1.00 0.00 H new ATOM 0 HD12 ILE A 139 7.950 -6.604 -22.306 1.00 0.00 H new ATOM 0 HD13 ILE A 139 8.966 -7.958 -21.757 1.00 0.00 H new ATOM 679 N ARG A 140 7.998 -7.998 -17.212 1.00 0.00 N ATOM 680 CA ARG A 140 7.653 -7.814 -15.807 1.00 0.00 C ATOM 681 C ARG A 140 7.470 -6.335 -15.482 1.00 0.00 C ATOM 682 O ARG A 140 8.221 -5.486 -15.960 1.00 0.00 O ATOM 683 CB ARG A 140 8.739 -8.414 -14.911 1.00 0.00 C ATOM 684 CG ARG A 140 8.739 -9.933 -14.888 1.00 0.00 C ATOM 685 CD ARG A 140 9.854 -10.477 -14.009 1.00 0.00 C ATOM 686 NE ARG A 140 9.659 -11.888 -13.688 1.00 0.00 N ATOM 687 CZ ARG A 140 10.003 -12.881 -14.500 1.00 0.00 C ATOM 688 NH1 ARG A 140 10.557 -12.619 -15.676 1.00 0.00 N ATOM 689 NH2 ARG A 140 9.794 -14.140 -14.136 1.00 0.00 N ATOM 0 H ARG A 140 8.961 -7.758 -17.445 1.00 0.00 H new ATOM 0 HA ARG A 140 6.711 -8.329 -15.619 1.00 0.00 H new ATOM 0 HB2 ARG A 140 9.713 -8.064 -15.252 1.00 0.00 H new ATOM 0 HB3 ARG A 140 8.605 -8.044 -13.895 1.00 0.00 H new ATOM 0 HG2 ARG A 140 7.777 -10.292 -14.522 1.00 0.00 H new ATOM 0 HG3 ARG A 140 8.856 -10.313 -15.903 1.00 0.00 H new ATOM 0 HD2 ARG A 140 10.810 -10.350 -14.516 1.00 0.00 H new ATOM 0 HD3 ARG A 140 9.903 -9.899 -13.086 1.00 0.00 H new ATOM 0 HE ARG A 140 9.235 -12.124 -12.791 1.00 0.00 H new ATOM 0 HH11 ARG A 140 10.720 -11.653 -15.959 1.00 0.00 H new ATOM 0 HH12 ARG A 140 10.820 -13.384 -16.297 1.00 0.00 H new ATOM 0 HH21 ARG A 140 9.369 -14.346 -13.232 1.00 0.00 H new ATOM 0 HH22 ARG A 140 10.059 -14.902 -14.760 1.00 0.00 H new ATOM 703 N GLY A 141 6.464 -6.034 -14.665 1.00 0.00 N ATOM 704 CA GLY A 141 6.200 -4.657 -14.290 1.00 0.00 C ATOM 705 C GLY A 141 4.919 -4.509 -13.493 1.00 0.00 C ATOM 706 O GLY A 141 4.243 -5.496 -13.201 1.00 0.00 O ATOM 0 H GLY A 141 5.828 -6.719 -14.257 1.00 0.00 H new ATOM 0 HA2 GLY A 141 7.036 -4.277 -13.703 1.00 0.00 H new ATOM 0 HA3 GLY A 141 6.138 -4.044 -15.189 1.00 0.00 H new ATOM 710 N CYS A 142 4.584 -3.273 -13.138 1.00 0.00 N ATOM 711 CA CYS A 142 3.378 -2.998 -12.368 1.00 0.00 C ATOM 712 C CYS A 142 2.187 -2.753 -13.291 1.00 0.00 C ATOM 713 O CYS A 142 2.356 -2.475 -14.478 1.00 0.00 O ATOM 714 CB CYS A 142 3.592 -1.786 -11.460 1.00 0.00 C ATOM 715 SG CYS A 142 5.103 -1.873 -10.446 1.00 0.00 S ATOM 0 H CYS A 142 5.132 -2.445 -13.372 1.00 0.00 H new ATOM 0 HA CYS A 142 3.164 -3.871 -11.752 1.00 0.00 H new ATOM 0 HB2 CYS A 142 3.632 -0.887 -12.075 1.00 0.00 H new ATOM 0 HB3 CYS A 142 2.730 -1.683 -10.800 1.00 0.00 H new ATOM 720 N ALA A 143 0.984 -2.857 -12.736 1.00 0.00 N ATOM 721 CA ALA A 143 -0.234 -2.644 -13.508 1.00 0.00 C ATOM 722 C ALA A 143 -1.435 -2.438 -12.592 1.00 0.00 C ATOM 723 O ALA A 143 -1.326 -2.561 -11.372 1.00 0.00 O ATOM 724 CB ALA A 143 -0.477 -3.819 -14.444 1.00 0.00 C ATOM 0 H ALA A 143 0.827 -3.087 -11.755 1.00 0.00 H new ATOM 0 HA ALA A 143 -0.105 -1.740 -14.103 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -1.390 -3.647 -15.015 1.00 0.00 H new ATOM 0 HB2 ALA A 143 0.365 -3.919 -15.128 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -0.581 -4.734 -13.860 1.00 0.00 H new ATOM 730 N ASP A 144 -2.580 -2.123 -13.187 1.00 0.00 N ATOM 731 CA ASP A 144 -3.803 -1.900 -12.424 1.00 0.00 C ATOM 732 C ASP A 144 -4.554 -3.210 -12.205 1.00 0.00 C ATOM 733 O ASP A 144 -4.890 -3.564 -11.075 1.00 0.00 O ATOM 734 CB ASP A 144 -4.703 -0.896 -13.146 1.00 0.00 C ATOM 735 CG ASP A 144 -4.883 -1.230 -14.614 1.00 0.00 C ATOM 736 OD1 ASP A 144 -4.018 -0.834 -15.422 1.00 0.00 O ATOM 737 OD2 ASP A 144 -5.890 -1.887 -14.954 1.00 0.00 O ATOM 0 H ASP A 144 -2.687 -2.016 -14.196 1.00 0.00 H new ATOM 0 HA ASP A 144 -3.526 -1.494 -11.451 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -5.678 -0.872 -12.660 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -4.276 0.102 -13.053 1.00 0.00 H new ATOM 742 N THR A 145 -4.814 -3.926 -13.294 1.00 0.00 N ATOM 743 CA THR A 145 -5.527 -5.195 -13.222 1.00 0.00 C ATOM 744 C THR A 145 -5.006 -6.179 -14.264 1.00 0.00 C ATOM 745 O THR A 145 -4.304 -5.794 -15.199 1.00 0.00 O ATOM 746 CB THR A 145 -7.041 -5.002 -13.428 1.00 0.00 C ATOM 747 OG1 THR A 145 -7.276 -4.058 -14.479 1.00 0.00 O ATOM 748 CG2 THR A 145 -7.704 -4.517 -12.147 1.00 0.00 C ATOM 0 H THR A 145 -4.541 -3.648 -14.237 1.00 0.00 H new ATOM 0 HA THR A 145 -5.352 -5.599 -12.225 1.00 0.00 H new ATOM 0 HB THR A 145 -7.474 -5.965 -13.701 1.00 0.00 H new ATOM 0 HG1 THR A 145 -6.888 -3.192 -14.234 1.00 0.00 H new ATOM 0 HG21 THR A 145 -8.773 -4.388 -12.317 1.00 0.00 H new ATOM 0 HG22 THR A 145 -7.548 -5.251 -11.356 1.00 0.00 H new ATOM 0 HG23 THR A 145 -7.266 -3.564 -11.849 1.00 0.00 H new ATOM 756 N CYS A 146 -5.354 -7.450 -14.096 1.00 0.00 N ATOM 757 CA CYS A 146 -4.921 -8.490 -15.022 1.00 0.00 C ATOM 758 C CYS A 146 -5.231 -8.098 -16.464 1.00 0.00 C ATOM 759 O CYS A 146 -6.388 -8.026 -16.879 1.00 0.00 O ATOM 760 CB CYS A 146 -5.603 -9.818 -14.685 1.00 0.00 C ATOM 761 SG CYS A 146 -4.672 -11.289 -15.221 1.00 0.00 S ATOM 0 H CYS A 146 -5.935 -7.785 -13.327 1.00 0.00 H new ATOM 0 HA CYS A 146 -3.842 -8.607 -14.920 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -5.757 -9.872 -13.607 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -6.589 -9.836 -15.150 1.00 0.00 H new ATOM 766 N PRO A 147 -4.173 -7.838 -17.246 1.00 0.00 N ATOM 767 CA PRO A 147 -4.306 -7.450 -18.654 1.00 0.00 C ATOM 768 C PRO A 147 -4.795 -8.599 -19.529 1.00 0.00 C ATOM 769 O PRO A 147 -4.830 -9.751 -19.095 1.00 0.00 O ATOM 770 CB PRO A 147 -2.882 -7.048 -19.046 1.00 0.00 C ATOM 771 CG PRO A 147 -2.003 -7.802 -18.110 1.00 0.00 C ATOM 772 CD PRO A 147 -2.766 -7.905 -16.818 1.00 0.00 C ATOM 0 HA PRO A 147 -5.041 -6.657 -18.791 1.00 0.00 H new ATOM 0 HB2 PRO A 147 -2.669 -7.306 -20.083 1.00 0.00 H new ATOM 0 HB3 PRO A 147 -2.733 -5.973 -18.949 1.00 0.00 H new ATOM 0 HG2 PRO A 147 -1.769 -8.791 -18.505 1.00 0.00 H new ATOM 0 HG3 PRO A 147 -1.055 -7.285 -17.963 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -2.549 -8.837 -16.296 1.00 0.00 H new ATOM 0 HD3 PRO A 147 -2.514 -7.092 -16.137 1.00 0.00 H new ATOM 780 N VAL A 148 -5.171 -8.279 -20.763 1.00 0.00 N ATOM 781 CA VAL A 148 -5.657 -9.285 -21.699 1.00 0.00 C ATOM 782 C VAL A 148 -4.563 -9.699 -22.677 1.00 0.00 C ATOM 783 O VAL A 148 -3.662 -8.920 -22.983 1.00 0.00 O ATOM 784 CB VAL A 148 -6.873 -8.772 -22.493 1.00 0.00 C ATOM 785 CG1 VAL A 148 -7.514 -9.906 -23.280 1.00 0.00 C ATOM 786 CG2 VAL A 148 -7.883 -8.123 -21.559 1.00 0.00 C ATOM 0 H VAL A 148 -5.148 -7.331 -21.138 1.00 0.00 H new ATOM 0 HA VAL A 148 -5.958 -10.149 -21.107 1.00 0.00 H new ATOM 0 HB VAL A 148 -6.531 -8.018 -23.202 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -8.371 -9.525 -23.835 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -6.786 -10.322 -23.977 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -7.844 -10.685 -22.593 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -8.736 -7.766 -22.137 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -8.222 -8.854 -20.825 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -7.416 -7.283 -21.045 1.00 0.00 H new ATOM 796 N GLY A 149 -4.649 -10.933 -23.166 1.00 0.00 N ATOM 797 CA GLY A 149 -3.661 -11.429 -24.105 1.00 0.00 C ATOM 798 C GLY A 149 -3.822 -12.910 -24.388 1.00 0.00 C ATOM 799 O GLY A 149 -4.645 -13.583 -23.766 1.00 0.00 O ATOM 0 H GLY A 149 -5.386 -11.597 -22.928 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -3.741 -10.873 -25.039 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -2.663 -11.244 -23.708 1.00 0.00 H new ATOM 803 N LYS A 150 -3.037 -13.419 -25.331 1.00 0.00 N ATOM 804 CA LYS A 150 -3.096 -14.829 -25.697 1.00 0.00 C ATOM 805 C LYS A 150 -2.744 -15.716 -24.507 1.00 0.00 C ATOM 806 O LYS A 150 -2.134 -15.274 -23.532 1.00 0.00 O ATOM 807 CB LYS A 150 -2.143 -15.116 -26.859 1.00 0.00 C ATOM 808 CG LYS A 150 -2.373 -14.227 -28.069 1.00 0.00 C ATOM 809 CD LYS A 150 -3.457 -14.787 -28.975 1.00 0.00 C ATOM 810 CE LYS A 150 -2.978 -14.895 -30.415 1.00 0.00 C ATOM 811 NZ LYS A 150 -2.925 -13.565 -31.083 1.00 0.00 N ATOM 0 H LYS A 150 -2.352 -12.876 -25.856 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.116 -15.055 -26.007 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -1.116 -14.989 -26.516 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -2.252 -16.158 -27.159 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -2.654 -13.227 -27.739 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -1.444 -14.128 -28.630 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -3.760 -15.771 -28.616 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -4.337 -14.146 -28.930 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -1.988 -15.351 -30.435 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -3.644 -15.554 -30.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -2.594 -13.681 -32.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -3.874 -13.140 -31.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -2.270 -12.943 -30.568 1.00 0.00 H new ATOM 825 N PRO A 151 -3.135 -16.996 -24.585 1.00 0.00 N ATOM 826 CA PRO A 151 -2.869 -17.971 -23.523 1.00 0.00 C ATOM 827 C PRO A 151 -1.415 -18.432 -23.510 1.00 0.00 C ATOM 828 O PRO A 151 -0.870 -18.768 -22.458 1.00 0.00 O ATOM 829 CB PRO A 151 -3.796 -19.138 -23.873 1.00 0.00 C ATOM 830 CG PRO A 151 -4.634 -18.633 -24.996 1.00 0.00 C ATOM 831 CD PRO A 151 -3.865 -17.591 -25.717 1.00 0.00 C ATOM 0 HA PRO A 151 -3.043 -17.552 -22.532 1.00 0.00 H new ATOM 0 HB2 PRO A 151 -3.228 -20.020 -24.169 1.00 0.00 H new ATOM 0 HB3 PRO A 151 -4.410 -19.426 -23.019 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -4.895 -19.448 -25.671 1.00 0.00 H new ATOM 0 HG3 PRO A 151 -5.569 -18.221 -24.617 1.00 0.00 H new ATOM 0 HD2 PRO A 151 -3.198 -18.010 -26.471 1.00 0.00 H new ATOM 0 HD3 PRO A 151 -4.508 -16.872 -26.224 1.00 0.00 H new ATOM 839 N TYR A 152 -0.793 -18.444 -24.683 1.00 0.00 N ATOM 840 CA TYR A 152 0.598 -18.866 -24.806 1.00 0.00 C ATOM 841 C TYR A 152 1.545 -17.754 -24.364 1.00 0.00 C ATOM 842 O TYR A 152 2.761 -17.938 -24.330 1.00 0.00 O ATOM 843 CB TYR A 152 0.905 -19.269 -26.249 1.00 0.00 C ATOM 844 CG TYR A 152 -0.004 -20.354 -26.781 1.00 0.00 C ATOM 845 CD1 TYR A 152 0.203 -21.686 -26.447 1.00 0.00 C ATOM 846 CD2 TYR A 152 -1.070 -20.046 -27.617 1.00 0.00 C ATOM 847 CE1 TYR A 152 -0.624 -22.681 -26.932 1.00 0.00 C ATOM 848 CE2 TYR A 152 -1.904 -21.033 -28.105 1.00 0.00 C ATOM 849 CZ TYR A 152 -1.676 -22.349 -27.760 1.00 0.00 C ATOM 850 OH TYR A 152 -2.504 -23.337 -28.244 1.00 0.00 O ATOM 0 H TYR A 152 -1.229 -18.167 -25.562 1.00 0.00 H new ATOM 0 HA TYR A 152 0.749 -19.728 -24.156 1.00 0.00 H new ATOM 0 HB2 TYR A 152 0.821 -18.390 -26.888 1.00 0.00 H new ATOM 0 HB3 TYR A 152 1.938 -19.610 -26.310 1.00 0.00 H new ATOM 0 HD1 TYR A 152 1.025 -21.949 -25.797 1.00 0.00 H new ATOM 0 HD2 TYR A 152 -1.250 -19.017 -27.890 1.00 0.00 H new ATOM 0 HE1 TYR A 152 -0.448 -23.712 -26.664 1.00 0.00 H new ATOM 0 HE2 TYR A 152 -2.729 -20.776 -28.753 1.00 0.00 H new ATOM 0 HH TYR A 152 -3.195 -22.936 -28.811 1.00 0.00 H new ATOM 860 N GLU A 153 0.977 -16.601 -24.025 1.00 0.00 N ATOM 861 CA GLU A 153 1.770 -15.460 -23.585 1.00 0.00 C ATOM 862 C GLU A 153 2.190 -15.619 -22.126 1.00 0.00 C ATOM 863 O GLU A 153 2.906 -14.780 -21.581 1.00 0.00 O ATOM 864 CB GLU A 153 0.978 -14.162 -23.761 1.00 0.00 C ATOM 865 CG GLU A 153 0.787 -13.758 -25.213 1.00 0.00 C ATOM 866 CD GLU A 153 1.550 -12.497 -25.573 1.00 0.00 C ATOM 867 OE1 GLU A 153 2.738 -12.608 -25.941 1.00 0.00 O ATOM 868 OE2 GLU A 153 0.959 -11.401 -25.486 1.00 0.00 O ATOM 0 H GLU A 153 -0.029 -16.433 -24.047 1.00 0.00 H new ATOM 0 HA GLU A 153 2.668 -15.415 -24.201 1.00 0.00 H new ATOM 0 HB2 GLU A 153 0.000 -14.276 -23.293 1.00 0.00 H new ATOM 0 HB3 GLU A 153 1.492 -13.358 -23.234 1.00 0.00 H new ATOM 0 HG2 GLU A 153 1.114 -14.573 -25.859 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -0.274 -13.604 -25.407 1.00 0.00 H new ATOM 875 N MET A 154 1.737 -16.700 -21.501 1.00 0.00 N ATOM 876 CA MET A 154 2.066 -16.970 -20.106 1.00 0.00 C ATOM 877 C MET A 154 1.886 -15.718 -19.253 1.00 0.00 C ATOM 878 O MET A 154 2.738 -15.392 -18.425 1.00 0.00 O ATOM 879 CB MET A 154 3.503 -17.480 -19.988 1.00 0.00 C ATOM 880 CG MET A 154 3.653 -18.956 -20.318 1.00 0.00 C ATOM 881 SD MET A 154 4.887 -19.776 -19.290 1.00 0.00 S ATOM 882 CE MET A 154 5.209 -21.248 -20.257 1.00 0.00 C ATOM 0 H MET A 154 1.141 -17.403 -21.938 1.00 0.00 H new ATOM 0 HA MET A 154 1.385 -17.738 -19.740 1.00 0.00 H new ATOM 0 HB2 MET A 154 4.141 -16.900 -20.655 1.00 0.00 H new ATOM 0 HB3 MET A 154 3.860 -17.305 -18.973 1.00 0.00 H new ATOM 0 HG2 MET A 154 2.691 -19.452 -20.190 1.00 0.00 H new ATOM 0 HG3 MET A 154 3.930 -19.063 -21.367 1.00 0.00 H new ATOM 0 HE1 MET A 154 5.955 -21.860 -19.750 1.00 0.00 H new ATOM 0 HE2 MET A 154 4.287 -21.818 -20.370 1.00 0.00 H new ATOM 0 HE3 MET A 154 5.582 -20.963 -21.241 1.00 0.00 H new ATOM 892 N ILE A 155 0.775 -15.020 -19.461 1.00 0.00 N ATOM 893 CA ILE A 155 0.485 -13.805 -18.711 1.00 0.00 C ATOM 894 C ILE A 155 0.068 -14.128 -17.280 1.00 0.00 C ATOM 895 O ILE A 155 -0.981 -14.730 -17.050 1.00 0.00 O ATOM 896 CB ILE A 155 -0.628 -12.980 -19.384 1.00 0.00 C ATOM 897 CG1 ILE A 155 -0.265 -12.686 -20.841 1.00 0.00 C ATOM 898 CG2 ILE A 155 -0.864 -11.685 -18.620 1.00 0.00 C ATOM 899 CD1 ILE A 155 -1.341 -11.933 -21.592 1.00 0.00 C ATOM 0 H ILE A 155 0.061 -15.275 -20.143 1.00 0.00 H new ATOM 0 HA ILE A 155 1.403 -13.218 -18.696 1.00 0.00 H new ATOM 0 HB ILE A 155 -1.550 -13.561 -19.369 1.00 0.00 H new ATOM 0 HG12 ILE A 155 0.658 -12.107 -20.867 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -0.066 -13.627 -21.354 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -1.653 -11.113 -19.108 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -1.162 -11.915 -17.597 1.00 0.00 H new ATOM 0 HG23 ILE A 155 0.054 -11.098 -18.607 1.00 0.00 H new ATOM 0 HD11 ILE A 155 -1.015 -11.759 -22.618 1.00 0.00 H new ATOM 0 HD12 ILE A 155 -2.260 -12.520 -21.597 1.00 0.00 H new ATOM 0 HD13 ILE A 155 -1.525 -10.976 -21.103 1.00 0.00 H new ATOM 911 N GLU A 156 0.895 -13.723 -16.322 1.00 0.00 N ATOM 912 CA GLU A 156 0.611 -13.969 -14.913 1.00 0.00 C ATOM 913 C GLU A 156 0.264 -12.670 -14.193 1.00 0.00 C ATOM 914 O GLU A 156 0.852 -11.621 -14.461 1.00 0.00 O ATOM 915 CB GLU A 156 1.812 -14.635 -14.237 1.00 0.00 C ATOM 916 CG GLU A 156 1.533 -15.093 -12.815 1.00 0.00 C ATOM 917 CD GLU A 156 2.500 -16.162 -12.346 1.00 0.00 C ATOM 918 OE1 GLU A 156 3.652 -15.815 -12.012 1.00 0.00 O ATOM 919 OE2 GLU A 156 2.104 -17.346 -12.313 1.00 0.00 O ATOM 0 H GLU A 156 1.767 -13.223 -16.496 1.00 0.00 H new ATOM 0 HA GLU A 156 -0.248 -14.638 -14.853 1.00 0.00 H new ATOM 0 HB2 GLU A 156 2.123 -15.494 -14.832 1.00 0.00 H new ATOM 0 HB3 GLU A 156 2.647 -13.935 -14.227 1.00 0.00 H new ATOM 0 HG2 GLU A 156 1.591 -14.236 -12.144 1.00 0.00 H new ATOM 0 HG3 GLU A 156 0.515 -15.478 -12.754 1.00 0.00 H new ATOM 926 N CYS A 157 -0.696 -12.746 -13.277 1.00 0.00 N ATOM 927 CA CYS A 157 -1.124 -11.577 -12.518 1.00 0.00 C ATOM 928 C CYS A 157 -1.112 -11.867 -11.020 1.00 0.00 C ATOM 929 O CYS A 157 -1.416 -12.980 -10.589 1.00 0.00 O ATOM 930 CB CYS A 157 -2.526 -11.146 -12.953 1.00 0.00 C ATOM 931 SG CYS A 157 -2.785 -11.171 -14.756 1.00 0.00 S ATOM 0 H CYS A 157 -1.192 -13.606 -13.042 1.00 0.00 H new ATOM 0 HA CYS A 157 -0.423 -10.767 -12.720 1.00 0.00 H new ATOM 0 HB2 CYS A 157 -3.259 -11.802 -12.482 1.00 0.00 H new ATOM 0 HB3 CYS A 157 -2.716 -10.138 -12.583 1.00 0.00 H new ATOM 936 N CYS A 158 -0.758 -10.859 -10.231 1.00 0.00 N ATOM 937 CA CYS A 158 -0.705 -11.004 -8.781 1.00 0.00 C ATOM 938 C CYS A 158 -0.522 -9.648 -8.105 1.00 0.00 C ATOM 939 O CYS A 158 -0.415 -8.619 -8.773 1.00 0.00 O ATOM 940 CB CYS A 158 0.436 -11.942 -8.383 1.00 0.00 C ATOM 941 SG CYS A 158 1.885 -11.859 -9.482 1.00 0.00 S ATOM 0 H CYS A 158 -0.503 -9.932 -10.571 1.00 0.00 H new ATOM 0 HA CYS A 158 -1.651 -11.431 -8.449 1.00 0.00 H new ATOM 0 HB2 CYS A 158 0.750 -11.704 -7.367 1.00 0.00 H new ATOM 0 HB3 CYS A 158 0.062 -12.966 -8.369 1.00 0.00 H new ATOM 946 N SER A 159 -0.488 -9.655 -6.776 1.00 0.00 N ATOM 947 CA SER A 159 -0.322 -8.426 -6.009 1.00 0.00 C ATOM 948 C SER A 159 0.417 -8.697 -4.702 1.00 0.00 C ATOM 949 O SER A 159 -0.148 -8.560 -3.616 1.00 0.00 O ATOM 950 CB SER A 159 -1.684 -7.794 -5.717 1.00 0.00 C ATOM 951 OG SER A 159 -2.442 -8.601 -4.833 1.00 0.00 O ATOM 0 H SER A 159 -0.573 -10.498 -6.208 1.00 0.00 H new ATOM 0 HA SER A 159 0.272 -7.733 -6.605 1.00 0.00 H new ATOM 0 HB2 SER A 159 -1.543 -6.805 -5.281 1.00 0.00 H new ATOM 0 HB3 SER A 159 -2.232 -7.657 -6.649 1.00 0.00 H new ATOM 0 HG SER A 159 -1.924 -8.769 -4.018 1.00 0.00 H new ATOM 957 N THR A 160 1.684 -9.083 -4.814 1.00 0.00 N ATOM 958 CA THR A 160 2.501 -9.375 -3.643 1.00 0.00 C ATOM 959 C THR A 160 3.972 -9.083 -3.912 1.00 0.00 C ATOM 960 O THR A 160 4.406 -9.039 -5.064 1.00 0.00 O ATOM 961 CB THR A 160 2.352 -10.845 -3.207 1.00 0.00 C ATOM 962 OG1 THR A 160 2.338 -11.698 -4.356 1.00 0.00 O ATOM 963 CG2 THR A 160 1.074 -11.044 -2.405 1.00 0.00 C ATOM 0 H THR A 160 2.167 -9.201 -5.705 1.00 0.00 H new ATOM 0 HA THR A 160 2.146 -8.728 -2.841 1.00 0.00 H new ATOM 0 HB THR A 160 3.203 -11.102 -2.576 1.00 0.00 H new ATOM 0 HG1 THR A 160 2.245 -12.631 -4.070 1.00 0.00 H new ATOM 0 HG21 THR A 160 0.990 -12.089 -2.108 1.00 0.00 H new ATOM 0 HG22 THR A 160 1.101 -10.415 -1.515 1.00 0.00 H new ATOM 0 HG23 THR A 160 0.214 -10.770 -3.017 1.00 0.00 H new ATOM 971 N ASP A 161 4.736 -8.885 -2.844 1.00 0.00 N ATOM 972 CA ASP A 161 6.161 -8.600 -2.965 1.00 0.00 C ATOM 973 C ASP A 161 6.834 -9.583 -3.918 1.00 0.00 C ATOM 974 O ASP A 161 6.962 -10.769 -3.613 1.00 0.00 O ATOM 975 CB ASP A 161 6.834 -8.658 -1.593 1.00 0.00 C ATOM 976 CG ASP A 161 6.840 -7.314 -0.893 1.00 0.00 C ATOM 977 OD1 ASP A 161 6.158 -6.388 -1.381 1.00 0.00 O ATOM 978 OD2 ASP A 161 7.527 -7.186 0.143 1.00 0.00 O ATOM 0 H ASP A 161 4.392 -8.917 -1.884 1.00 0.00 H new ATOM 0 HA ASP A 161 6.271 -7.595 -3.372 1.00 0.00 H new ATOM 0 HB2 ASP A 161 6.317 -9.387 -0.969 1.00 0.00 H new ATOM 0 HB3 ASP A 161 7.860 -9.008 -1.709 1.00 0.00 H new ATOM 983 N LYS A 162 7.260 -9.083 -5.073 1.00 0.00 N ATOM 984 CA LYS A 162 7.919 -9.917 -6.071 1.00 0.00 C ATOM 985 C LYS A 162 7.044 -11.107 -6.450 1.00 0.00 C ATOM 986 O LYS A 162 7.535 -12.225 -6.612 1.00 0.00 O ATOM 987 CB LYS A 162 9.268 -10.410 -5.542 1.00 0.00 C ATOM 988 CG LYS A 162 10.104 -9.319 -4.895 1.00 0.00 C ATOM 989 CD LYS A 162 11.453 -9.848 -4.437 1.00 0.00 C ATOM 990 CE LYS A 162 11.454 -10.158 -2.948 1.00 0.00 C ATOM 991 NZ LYS A 162 12.581 -11.055 -2.569 1.00 0.00 N ATOM 0 H LYS A 162 7.161 -8.104 -5.341 1.00 0.00 H new ATOM 0 HA LYS A 162 8.084 -9.312 -6.963 1.00 0.00 H new ATOM 0 HB2 LYS A 162 9.095 -11.203 -4.815 1.00 0.00 H new ATOM 0 HB3 LYS A 162 9.833 -10.849 -6.364 1.00 0.00 H new ATOM 0 HG2 LYS A 162 10.253 -8.505 -5.604 1.00 0.00 H new ATOM 0 HG3 LYS A 162 9.566 -8.905 -4.042 1.00 0.00 H new ATOM 0 HD2 LYS A 162 11.701 -10.749 -4.997 1.00 0.00 H new ATOM 0 HD3 LYS A 162 12.227 -9.113 -4.657 1.00 0.00 H new ATOM 0 HE2 LYS A 162 11.524 -9.228 -2.384 1.00 0.00 H new ATOM 0 HE3 LYS A 162 10.509 -10.627 -2.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 12.547 -11.242 -1.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 12.500 -11.952 -3.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 13.484 -10.597 -2.807 1.00 0.00 H new ATOM 1005 N CYS A 163 5.746 -10.860 -6.591 1.00 0.00 N ATOM 1006 CA CYS A 163 4.802 -11.911 -6.953 1.00 0.00 C ATOM 1007 C CYS A 163 5.155 -12.516 -8.308 1.00 0.00 C ATOM 1008 O CYS A 163 4.811 -13.662 -8.596 1.00 0.00 O ATOM 1009 CB CYS A 163 3.377 -11.355 -6.985 1.00 0.00 C ATOM 1010 SG CYS A 163 2.962 -10.462 -8.518 1.00 0.00 S ATOM 0 H CYS A 163 5.324 -9.941 -6.460 1.00 0.00 H new ATOM 0 HA CYS A 163 4.862 -12.696 -6.199 1.00 0.00 H new ATOM 0 HB2 CYS A 163 2.674 -12.178 -6.855 1.00 0.00 H new ATOM 0 HB3 CYS A 163 3.241 -10.683 -6.138 1.00 0.00 H new ATOM 1015 N ASN A 164 5.843 -11.738 -9.137 1.00 0.00 N ATOM 1016 CA ASN A 164 6.243 -12.197 -10.462 1.00 0.00 C ATOM 1017 C ASN A 164 7.642 -12.804 -10.429 1.00 0.00 C ATOM 1018 O ASN A 164 8.359 -12.792 -11.429 1.00 0.00 O ATOM 1019 CB ASN A 164 6.201 -11.038 -11.460 1.00 0.00 C ATOM 1020 CG ASN A 164 6.834 -9.775 -10.907 1.00 0.00 C ATOM 1021 OD1 ASN A 164 7.614 -9.824 -9.956 1.00 0.00 O ATOM 1022 ND2 ASN A 164 6.498 -8.636 -11.501 1.00 0.00 N ATOM 0 H ASN A 164 6.135 -10.786 -8.915 1.00 0.00 H new ATOM 0 HA ASN A 164 5.540 -12.967 -10.780 1.00 0.00 H new ATOM 0 HB2 ASN A 164 6.718 -11.330 -12.374 1.00 0.00 H new ATOM 0 HB3 ASN A 164 5.165 -10.833 -11.731 1.00 0.00 H new ATOM 0 HD21 ASN A 164 6.891 -7.754 -11.172 1.00 0.00 H new ATOM 0 HD22 ASN A 164 5.847 -8.643 -12.286 1.00 0.00 H new ATOM 1029 N ARG A 165 8.023 -13.335 -9.272 1.00 0.00 N ATOM 1030 CA ARG A 165 9.336 -13.947 -9.107 1.00 0.00 C ATOM 1031 C ARG A 165 9.347 -15.369 -9.660 1.00 0.00 C ATOM 1032 O ARG A 165 8.732 -16.271 -9.091 1.00 0.00 O ATOM 1033 CB ARG A 165 9.736 -13.959 -7.631 1.00 0.00 C ATOM 1034 CG ARG A 165 11.079 -14.620 -7.369 1.00 0.00 C ATOM 1035 CD ARG A 165 11.409 -14.641 -5.884 1.00 0.00 C ATOM 1036 NE ARG A 165 12.040 -15.895 -5.481 1.00 0.00 N ATOM 1037 CZ ARG A 165 12.233 -16.247 -4.215 1.00 0.00 C ATOM 1038 NH1 ARG A 165 11.846 -15.443 -3.234 1.00 0.00 N ATOM 1039 NH2 ARG A 165 12.813 -17.405 -3.928 1.00 0.00 N ATOM 0 H ARG A 165 7.441 -13.354 -8.435 1.00 0.00 H new ATOM 0 HA ARG A 165 10.058 -13.353 -9.667 1.00 0.00 H new ATOM 0 HB2 ARG A 165 9.768 -12.933 -7.264 1.00 0.00 H new ATOM 0 HB3 ARG A 165 8.967 -14.479 -7.059 1.00 0.00 H new ATOM 0 HG2 ARG A 165 11.065 -15.640 -7.754 1.00 0.00 H new ATOM 0 HG3 ARG A 165 11.860 -14.085 -7.909 1.00 0.00 H new ATOM 0 HD2 ARG A 165 12.073 -13.809 -5.648 1.00 0.00 H new ATOM 0 HD3 ARG A 165 10.496 -14.493 -5.308 1.00 0.00 H new ATOM 0 HE ARG A 165 12.349 -16.536 -6.212 1.00 0.00 H new ATOM 0 HH11 ARG A 165 11.399 -14.552 -3.451 1.00 0.00 H new ATOM 0 HH12 ARG A 165 11.995 -15.715 -2.262 1.00 0.00 H new ATOM 0 HH21 ARG A 165 13.111 -18.026 -4.680 1.00 0.00 H new ATOM 0 HH22 ARG A 165 12.961 -17.674 -2.955 1.00 0.00 H new