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 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0.079) 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= 0.0217 K(o=0.022,f=-2.8!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ -161:sc= -0.107 (180deg=-0.108) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot -60:sc= 1.03 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 58:sc= 0.77 USER MOD Single : A 160 THR OG1 : rot 180:sc= -1.36 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 ASN : amide:sc= -0.767 K(o=-0.77,f=-8.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 100 2.199 0.013 -0.006 1.00 0.00 N ATOM 2 CA MET A 100 2.589 -0.083 -1.408 1.00 0.00 C ATOM 3 C MET A 100 3.013 -1.506 -1.758 1.00 0.00 C ATOM 4 O MET A 100 3.337 -2.303 -0.875 1.00 0.00 O ATOM 5 CB MET A 100 3.729 0.891 -1.711 1.00 0.00 C ATOM 6 CG MET A 100 3.344 2.351 -1.534 1.00 0.00 C ATOM 7 SD MET A 100 3.981 3.056 -0.002 1.00 0.00 S ATOM 8 CE MET A 100 4.477 4.684 -0.559 1.00 0.00 C ATOM 0 HA MET A 100 1.725 0.180 -2.018 1.00 0.00 H new ATOM 0 HB2 MET A 100 4.572 0.665 -1.059 1.00 0.00 H new ATOM 0 HB3 MET A 100 4.067 0.734 -2.735 1.00 0.00 H new ATOM 0 HG2 MET A 100 3.721 2.927 -2.379 1.00 0.00 H new ATOM 0 HG3 MET A 100 2.258 2.440 -1.547 1.00 0.00 H new ATOM 0 HE1 MET A 100 4.893 5.244 0.279 1.00 0.00 H new ATOM 0 HE2 MET A 100 5.231 4.587 -1.341 1.00 0.00 H new ATOM 0 HE3 MET A 100 3.610 5.213 -0.955 1.00 0.00 H new ATOM 18 N LEU A 101 3.010 -1.819 -3.049 1.00 0.00 N ATOM 19 CA LEU A 101 3.395 -3.147 -3.515 1.00 0.00 C ATOM 20 C LEU A 101 4.715 -3.095 -4.278 1.00 0.00 C ATOM 21 O LEU A 101 5.058 -2.075 -4.878 1.00 0.00 O ATOM 22 CB LEU A 101 2.299 -3.733 -4.406 1.00 0.00 C ATOM 23 CG LEU A 101 2.671 -4.998 -5.182 1.00 0.00 C ATOM 24 CD1 LEU A 101 2.911 -6.158 -4.228 1.00 0.00 C ATOM 25 CD2 LEU A 101 1.581 -5.347 -6.185 1.00 0.00 C ATOM 0 H LEU A 101 2.745 -1.172 -3.792 1.00 0.00 H new ATOM 0 HA LEU A 101 3.527 -3.788 -2.643 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.432 -3.954 -3.784 1.00 0.00 H new ATOM 0 HB3 LEU A 101 1.992 -2.969 -5.121 1.00 0.00 H new ATOM 0 HG LEU A 101 3.594 -4.808 -5.729 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.174 -7.049 -4.798 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.726 -5.908 -3.549 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.005 -6.350 -3.653 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.862 -6.249 -6.728 1.00 0.00 H new ATOM 0 HD22 LEU A 101 0.643 -5.518 -5.658 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.457 -4.524 -6.889 1.00 0.00 H new ATOM 37 N THR A 102 5.450 -4.201 -4.255 1.00 0.00 N ATOM 38 CA THR A 102 6.731 -4.283 -4.946 1.00 0.00 C ATOM 39 C THR A 102 6.660 -5.246 -6.125 1.00 0.00 C ATOM 40 O THR A 102 6.136 -6.353 -6.005 1.00 0.00 O ATOM 41 CB THR A 102 7.855 -4.736 -3.994 1.00 0.00 C ATOM 42 OG1 THR A 102 7.830 -3.951 -2.797 1.00 0.00 O ATOM 43 CG2 THR A 102 9.215 -4.607 -4.663 1.00 0.00 C ATOM 0 H THR A 102 5.180 -5.054 -3.765 1.00 0.00 H new ATOM 0 HA THR A 102 6.957 -3.282 -5.312 1.00 0.00 H new ATOM 0 HB THR A 102 7.689 -5.784 -3.744 1.00 0.00 H new ATOM 0 HG1 THR A 102 8.546 -4.247 -2.197 1.00 0.00 H new ATOM 0 HG21 THR A 102 9.993 -4.932 -3.972 1.00 0.00 H new ATOM 0 HG22 THR A 102 9.241 -5.229 -5.558 1.00 0.00 H new ATOM 0 HG23 THR A 102 9.387 -3.567 -4.939 1.00 0.00 H new ATOM 51 N CYS A 103 7.191 -4.817 -7.265 1.00 0.00 N ATOM 52 CA CYS A 103 7.188 -5.642 -8.468 1.00 0.00 C ATOM 53 C CYS A 103 8.534 -5.566 -9.182 1.00 0.00 C ATOM 54 O CYS A 103 9.231 -4.553 -9.112 1.00 0.00 O ATOM 55 CB CYS A 103 6.071 -5.197 -9.414 1.00 0.00 C ATOM 56 SG CYS A 103 4.457 -4.965 -8.601 1.00 0.00 S ATOM 0 H CYS A 103 7.629 -3.903 -7.381 1.00 0.00 H new ATOM 0 HA CYS A 103 7.012 -6.675 -8.170 1.00 0.00 H new ATOM 0 HB2 CYS A 103 6.364 -4.261 -9.890 1.00 0.00 H new ATOM 0 HB3 CYS A 103 5.964 -5.938 -10.206 1.00 0.00 H new ATOM 61 N LEU A 104 8.894 -6.645 -9.869 1.00 0.00 N ATOM 62 CA LEU A 104 10.157 -6.702 -10.597 1.00 0.00 C ATOM 63 C LEU A 104 10.063 -5.934 -11.912 1.00 0.00 C ATOM 64 O LEU A 104 8.996 -5.850 -12.517 1.00 0.00 O ATOM 65 CB LEU A 104 10.546 -8.156 -10.870 1.00 0.00 C ATOM 66 CG LEU A 104 11.014 -8.964 -9.658 1.00 0.00 C ATOM 67 CD1 LEU A 104 11.068 -10.446 -9.994 1.00 0.00 C ATOM 68 CD2 LEU A 104 12.374 -8.473 -9.183 1.00 0.00 C ATOM 0 H LEU A 104 8.329 -7.492 -9.937 1.00 0.00 H new ATOM 0 HA LEU A 104 10.925 -6.236 -9.979 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.688 -8.664 -11.311 1.00 0.00 H new ATOM 0 HB3 LEU A 104 11.340 -8.165 -11.616 1.00 0.00 H new ATOM 0 HG LEU A 104 10.296 -8.821 -8.850 1.00 0.00 H new ATOM 0 HD11 LEU A 104 11.403 -11.005 -9.120 1.00 0.00 H new ATOM 0 HD12 LEU A 104 10.076 -10.789 -10.286 1.00 0.00 H new ATOM 0 HD13 LEU A 104 11.764 -10.607 -10.817 1.00 0.00 H new ATOM 0 HD21 LEU A 104 12.691 -9.059 -8.320 1.00 0.00 H new ATOM 0 HD22 LEU A 104 13.102 -8.586 -9.986 1.00 0.00 H new ATOM 0 HD23 LEU A 104 12.304 -7.422 -8.902 1.00 0.00 H new ATOM 80 N ASN A 105 11.188 -5.378 -12.348 1.00 0.00 N ATOM 81 CA ASN A 105 11.233 -4.618 -13.592 1.00 0.00 C ATOM 82 C ASN A 105 12.420 -5.047 -14.449 1.00 0.00 C ATOM 83 O ASN A 105 13.185 -4.211 -14.933 1.00 0.00 O ATOM 84 CB ASN A 105 11.318 -3.119 -13.296 1.00 0.00 C ATOM 85 CG ASN A 105 10.819 -2.273 -14.451 1.00 0.00 C ATOM 86 OD1 ASN A 105 11.590 -1.881 -15.328 1.00 0.00 O ATOM 87 ND2 ASN A 105 9.522 -1.986 -14.457 1.00 0.00 N ATOM 0 H ASN A 105 12.081 -5.439 -11.859 1.00 0.00 H new ATOM 0 HA ASN A 105 10.316 -4.820 -14.146 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.733 -2.894 -12.405 1.00 0.00 H new ATOM 0 HB3 ASN A 105 12.352 -2.853 -13.074 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.128 -1.420 -15.209 1.00 0.00 H new ATOM 0 HD22 ASN A 105 8.920 -2.332 -13.710 1.00 0.00 H new ATOM 180 N GLY A 112 17.593 -8.689 -10.126 1.00 0.00 N ATOM 181 CA GLY A 112 17.394 -7.984 -8.874 1.00 0.00 C ATOM 182 C GLY A 112 16.831 -6.591 -9.076 1.00 0.00 C ATOM 183 O GLY A 112 16.843 -5.769 -8.160 1.00 0.00 O ATOM 0 HA2 GLY A 112 16.717 -8.558 -8.241 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.344 -7.915 -8.344 1.00 0.00 H new ATOM 187 N LYS A 113 16.339 -6.322 -10.281 1.00 0.00 N ATOM 188 CA LYS A 113 15.770 -5.019 -10.602 1.00 0.00 C ATOM 189 C LYS A 113 14.272 -4.994 -10.316 1.00 0.00 C ATOM 190 O LYS A 113 13.508 -5.777 -10.881 1.00 0.00 O ATOM 191 CB LYS A 113 16.025 -4.677 -12.072 1.00 0.00 C ATOM 192 CG LYS A 113 17.349 -3.973 -12.312 1.00 0.00 C ATOM 193 CD LYS A 113 17.146 -2.590 -12.908 1.00 0.00 C ATOM 194 CE LYS A 113 18.473 -1.929 -13.248 1.00 0.00 C ATOM 195 NZ LYS A 113 19.161 -1.411 -12.034 1.00 0.00 N ATOM 0 H LYS A 113 16.323 -6.990 -11.052 1.00 0.00 H new ATOM 0 HA LYS A 113 16.255 -4.273 -9.972 1.00 0.00 H new ATOM 0 HB2 LYS A 113 15.999 -5.595 -12.660 1.00 0.00 H new ATOM 0 HB3 LYS A 113 15.215 -4.044 -12.435 1.00 0.00 H new ATOM 0 HG2 LYS A 113 17.893 -3.888 -11.371 1.00 0.00 H new ATOM 0 HG3 LYS A 113 17.964 -4.572 -12.983 1.00 0.00 H new ATOM 0 HD2 LYS A 113 16.535 -2.666 -13.808 1.00 0.00 H new ATOM 0 HD3 LYS A 113 16.598 -1.966 -12.203 1.00 0.00 H new ATOM 0 HE2 LYS A 113 19.118 -2.648 -13.752 1.00 0.00 H new ATOM 0 HE3 LYS A 113 18.302 -1.110 -13.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 20.061 -0.968 -12.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 18.556 -0.706 -11.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 19.347 -2.197 -11.379 1.00 0.00 H new ATOM 209 N PHE A 114 13.858 -4.088 -9.436 1.00 0.00 N ATOM 210 CA PHE A 114 12.450 -3.961 -9.075 1.00 0.00 C ATOM 211 C PHE A 114 12.115 -2.522 -8.694 1.00 0.00 C ATOM 212 O PHE A 114 13.005 -1.686 -8.541 1.00 0.00 O ATOM 213 CB PHE A 114 12.113 -4.899 -7.914 1.00 0.00 C ATOM 214 CG PHE A 114 12.911 -4.627 -6.672 1.00 0.00 C ATOM 215 CD1 PHE A 114 14.187 -5.147 -6.525 1.00 0.00 C ATOM 216 CD2 PHE A 114 12.386 -3.852 -5.651 1.00 0.00 C ATOM 217 CE1 PHE A 114 14.923 -4.899 -5.381 1.00 0.00 C ATOM 218 CE2 PHE A 114 13.118 -3.600 -4.506 1.00 0.00 C ATOM 219 CZ PHE A 114 14.389 -4.123 -4.371 1.00 0.00 C ATOM 0 H PHE A 114 14.477 -3.431 -8.960 1.00 0.00 H new ATOM 0 HA PHE A 114 11.851 -4.238 -9.943 1.00 0.00 H new ATOM 0 HB2 PHE A 114 11.052 -4.809 -7.681 1.00 0.00 H new ATOM 0 HB3 PHE A 114 12.284 -5.929 -8.228 1.00 0.00 H new ATOM 0 HD1 PHE A 114 14.611 -5.752 -7.312 1.00 0.00 H new ATOM 0 HD2 PHE A 114 11.393 -3.440 -5.751 1.00 0.00 H new ATOM 0 HE1 PHE A 114 15.915 -5.312 -5.277 1.00 0.00 H new ATOM 0 HE2 PHE A 114 12.696 -2.994 -3.717 1.00 0.00 H new ATOM 0 HZ PHE A 114 14.964 -3.926 -3.478 1.00 0.00 H new ATOM 229 N GLN A 115 10.824 -2.242 -8.544 1.00 0.00 N ATOM 230 CA GLN A 115 10.370 -0.904 -8.182 1.00 0.00 C ATOM 231 C GLN A 115 9.100 -0.969 -7.340 1.00 0.00 C ATOM 232 O GLN A 115 8.410 -1.988 -7.319 1.00 0.00 O ATOM 233 CB GLN A 115 10.121 -0.070 -9.440 1.00 0.00 C ATOM 234 CG GLN A 115 10.245 1.428 -9.212 1.00 0.00 C ATOM 235 CD GLN A 115 10.662 2.176 -10.463 1.00 0.00 C ATOM 236 OE1 GLN A 115 9.930 2.211 -11.452 1.00 0.00 O ATOM 237 NE2 GLN A 115 11.844 2.780 -10.425 1.00 0.00 N ATOM 0 H GLN A 115 10.075 -2.923 -8.667 1.00 0.00 H new ATOM 0 HA GLN A 115 11.152 -0.430 -7.589 1.00 0.00 H new ATOM 0 HB2 GLN A 115 10.829 -0.371 -10.212 1.00 0.00 H new ATOM 0 HB3 GLN A 115 9.123 -0.290 -9.820 1.00 0.00 H new ATOM 0 HG2 GLN A 115 9.290 1.819 -8.861 1.00 0.00 H new ATOM 0 HG3 GLN A 115 10.974 1.612 -8.423 1.00 0.00 H new ATOM 0 HE21 GLN A 115 12.418 2.725 -9.584 1.00 0.00 H new ATOM 0 HE22 GLN A 115 12.178 3.299 -11.237 1.00 0.00 H new ATOM 246 N ILE A 116 8.799 0.125 -6.648 1.00 0.00 N ATOM 247 CA ILE A 116 7.612 0.192 -5.805 1.00 0.00 C ATOM 248 C ILE A 116 6.420 0.746 -6.578 1.00 0.00 C ATOM 249 O ILE A 116 6.454 1.875 -7.068 1.00 0.00 O ATOM 250 CB ILE A 116 7.854 1.066 -4.560 1.00 0.00 C ATOM 251 CG1 ILE A 116 8.909 0.425 -3.657 1.00 0.00 C ATOM 252 CG2 ILE A 116 6.553 1.274 -3.799 1.00 0.00 C ATOM 253 CD1 ILE A 116 9.240 1.251 -2.434 1.00 0.00 C ATOM 0 H ILE A 116 9.361 0.976 -6.655 1.00 0.00 H new ATOM 0 HA ILE A 116 7.393 -0.827 -5.486 1.00 0.00 H new ATOM 0 HB ILE A 116 8.223 2.039 -4.883 1.00 0.00 H new ATOM 0 HG12 ILE A 116 8.555 -0.556 -3.338 1.00 0.00 H new ATOM 0 HG13 ILE A 116 9.820 0.264 -4.234 1.00 0.00 H new ATOM 0 HG21 ILE A 116 6.740 1.893 -2.922 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.829 1.769 -4.445 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.157 0.308 -3.484 1.00 0.00 H new ATOM 0 HD11 ILE A 116 9.995 0.735 -1.840 1.00 0.00 H new ATOM 0 HD12 ILE A 116 9.624 2.223 -2.744 1.00 0.00 H new ATOM 0 HD13 ILE A 116 8.340 1.391 -1.835 1.00 0.00 H new ATOM 265 N CYS A 117 5.365 -0.056 -6.681 1.00 0.00 N ATOM 266 CA CYS A 117 4.160 0.354 -7.393 1.00 0.00 C ATOM 267 C CYS A 117 3.290 1.252 -6.518 1.00 0.00 C ATOM 268 O CYS A 117 3.014 0.930 -5.362 1.00 0.00 O ATOM 269 CB CYS A 117 3.361 -0.874 -7.835 1.00 0.00 C ATOM 270 SG CYS A 117 4.374 -2.188 -8.588 1.00 0.00 S ATOM 0 H CYS A 117 5.320 -0.993 -6.281 1.00 0.00 H new ATOM 0 HA CYS A 117 4.463 0.919 -8.274 1.00 0.00 H new ATOM 0 HB2 CYS A 117 2.837 -1.284 -6.971 1.00 0.00 H new ATOM 0 HB3 CYS A 117 2.600 -0.561 -8.550 1.00 0.00 H new ATOM 275 N ARG A 118 2.862 2.378 -7.078 1.00 0.00 N ATOM 276 CA ARG A 118 2.025 3.324 -6.349 1.00 0.00 C ATOM 277 C ARG A 118 0.559 3.168 -6.745 1.00 0.00 C ATOM 278 O ARG A 118 0.188 2.217 -7.430 1.00 0.00 O ATOM 279 CB ARG A 118 2.486 4.758 -6.616 1.00 0.00 C ATOM 280 CG ARG A 118 3.993 4.940 -6.520 1.00 0.00 C ATOM 281 CD ARG A 118 4.412 6.339 -6.942 1.00 0.00 C ATOM 282 NE ARG A 118 5.686 6.732 -6.345 1.00 0.00 N ATOM 283 CZ ARG A 118 6.256 7.915 -6.543 1.00 0.00 C ATOM 284 NH1 ARG A 118 5.668 8.817 -7.316 1.00 0.00 N ATOM 285 NH2 ARG A 118 7.417 8.199 -5.965 1.00 0.00 N ATOM 0 H ARG A 118 3.081 2.658 -8.034 1.00 0.00 H new ATOM 0 HA ARG A 118 2.122 3.111 -5.284 1.00 0.00 H new ATOM 0 HB2 ARG A 118 2.155 5.058 -7.610 1.00 0.00 H new ATOM 0 HB3 ARG A 118 2.002 5.425 -5.903 1.00 0.00 H new ATOM 0 HG2 ARG A 118 4.319 4.754 -5.496 1.00 0.00 H new ATOM 0 HG3 ARG A 118 4.491 4.204 -7.151 1.00 0.00 H new ATOM 0 HD2 ARG A 118 4.492 6.381 -8.028 1.00 0.00 H new ATOM 0 HD3 ARG A 118 3.640 7.052 -6.651 1.00 0.00 H new ATOM 0 HE ARG A 118 6.164 6.061 -5.743 1.00 0.00 H new ATOM 0 HH11 ARG A 118 4.775 8.603 -7.761 1.00 0.00 H new ATOM 0 HH12 ARG A 118 6.108 9.725 -7.466 1.00 0.00 H new ATOM 0 HH21 ARG A 118 7.872 7.508 -5.368 1.00 0.00 H new ATOM 0 HH22 ARG A 118 7.854 9.108 -6.118 1.00 0.00 H new ATOM 299 N ASN A 119 -0.270 4.111 -6.306 1.00 0.00 N ATOM 300 CA ASN A 119 -1.695 4.078 -6.613 1.00 0.00 C ATOM 301 C ASN A 119 -1.926 3.809 -8.097 1.00 0.00 C ATOM 302 O ASN A 119 -1.085 4.132 -8.935 1.00 0.00 O ATOM 303 CB ASN A 119 -2.354 5.400 -6.214 1.00 0.00 C ATOM 304 CG ASN A 119 -1.640 6.602 -6.800 1.00 0.00 C ATOM 305 OD1 ASN A 119 -0.483 6.871 -6.475 1.00 0.00 O ATOM 306 ND2 ASN A 119 -2.328 7.333 -7.670 1.00 0.00 N ATOM 0 H ASN A 119 0.021 4.906 -5.737 1.00 0.00 H new ATOM 0 HA ASN A 119 -2.146 3.267 -6.041 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -3.392 5.400 -6.546 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.367 5.483 -5.127 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -1.900 8.154 -8.098 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -3.285 7.073 -7.910 1.00 0.00 H new ATOM 313 N GLY A 120 -3.073 3.216 -8.414 1.00 0.00 N ATOM 314 CA GLY A 120 -3.395 2.915 -9.797 1.00 0.00 C ATOM 315 C GLY A 120 -2.964 1.519 -10.201 1.00 0.00 C ATOM 316 O GLY A 120 -3.504 0.945 -11.146 1.00 0.00 O ATOM 0 H GLY A 120 -3.785 2.939 -7.738 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -4.470 3.018 -9.948 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.911 3.644 -10.447 1.00 0.00 H new ATOM 320 N GLU A 121 -1.987 0.972 -9.484 1.00 0.00 N ATOM 321 CA GLU A 121 -1.483 -0.365 -9.776 1.00 0.00 C ATOM 322 C GLU A 121 -1.168 -1.121 -8.488 1.00 0.00 C ATOM 323 O GLU A 121 -0.111 -0.932 -7.887 1.00 0.00 O ATOM 324 CB GLU A 121 -0.230 -0.282 -10.651 1.00 0.00 C ATOM 325 CG GLU A 121 -0.378 0.654 -11.838 1.00 0.00 C ATOM 326 CD GLU A 121 0.806 0.590 -12.783 1.00 0.00 C ATOM 327 OE1 GLU A 121 1.922 0.959 -12.361 1.00 0.00 O ATOM 328 OE2 GLU A 121 0.618 0.171 -13.944 1.00 0.00 O ATOM 0 H GLU A 121 -1.529 1.433 -8.698 1.00 0.00 H new ATOM 0 HA GLU A 121 -2.259 -0.908 -10.315 1.00 0.00 H new ATOM 0 HB2 GLU A 121 0.609 0.050 -10.039 1.00 0.00 H new ATOM 0 HB3 GLU A 121 0.016 -1.280 -11.014 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -1.287 0.402 -12.383 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -0.495 1.676 -11.478 1.00 0.00 H new ATOM 335 N LYS A 122 -2.094 -1.977 -8.071 1.00 0.00 N ATOM 336 CA LYS A 122 -1.917 -2.763 -6.855 1.00 0.00 C ATOM 337 C LYS A 122 -1.590 -4.215 -7.189 1.00 0.00 C ATOM 338 O LYS A 122 -1.618 -5.084 -6.316 1.00 0.00 O ATOM 339 CB LYS A 122 -3.181 -2.699 -5.994 1.00 0.00 C ATOM 340 CG LYS A 122 -3.545 -1.292 -5.552 1.00 0.00 C ATOM 341 CD LYS A 122 -4.124 -1.281 -4.147 1.00 0.00 C ATOM 342 CE LYS A 122 -3.033 -1.141 -3.097 1.00 0.00 C ATOM 343 NZ LYS A 122 -3.397 -1.826 -1.825 1.00 0.00 N ATOM 0 H LYS A 122 -2.975 -2.145 -8.557 1.00 0.00 H new ATOM 0 HA LYS A 122 -1.082 -2.340 -6.296 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.014 -3.122 -6.555 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -3.041 -3.323 -5.112 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -2.659 -0.658 -5.586 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -4.268 -0.867 -6.248 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -4.832 -0.458 -4.050 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -4.681 -2.202 -3.974 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -2.103 -1.559 -3.482 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -2.851 -0.084 -2.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -2.628 -1.708 -1.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -4.271 -1.410 -1.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -3.546 -2.839 -2.007 1.00 0.00 H new ATOM 357 N ILE A 123 -1.279 -4.471 -8.455 1.00 0.00 N ATOM 358 CA ILE A 123 -0.943 -5.817 -8.902 1.00 0.00 C ATOM 359 C ILE A 123 0.135 -5.786 -9.980 1.00 0.00 C ATOM 360 O ILE A 123 0.241 -4.823 -10.740 1.00 0.00 O ATOM 361 CB ILE A 123 -2.180 -6.553 -9.450 1.00 0.00 C ATOM 362 CG1 ILE A 123 -2.549 -6.014 -10.834 1.00 0.00 C ATOM 363 CG2 ILE A 123 -3.352 -6.407 -8.490 1.00 0.00 C ATOM 364 CD1 ILE A 123 -2.177 -6.948 -11.965 1.00 0.00 C ATOM 0 H ILE A 123 -1.253 -3.764 -9.190 1.00 0.00 H new ATOM 0 HA ILE A 123 -0.567 -6.354 -8.031 1.00 0.00 H new ATOM 0 HB ILE A 123 -1.942 -7.613 -9.544 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.622 -5.825 -10.867 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -2.052 -5.056 -10.986 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.219 -6.932 -8.891 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -3.085 -6.833 -7.523 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -3.593 -5.351 -8.368 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -2.468 -6.502 -12.916 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.100 -7.117 -11.958 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.695 -7.899 -11.837 1.00 0.00 H new ATOM 376 N CYS A 124 0.933 -6.847 -10.042 1.00 0.00 N ATOM 377 CA CYS A 124 2.003 -6.943 -11.027 1.00 0.00 C ATOM 378 C CYS A 124 1.656 -7.962 -12.109 1.00 0.00 C ATOM 379 O CYS A 124 0.675 -8.697 -11.993 1.00 0.00 O ATOM 380 CB CYS A 124 3.317 -7.332 -10.348 1.00 0.00 C ATOM 381 SG CYS A 124 3.508 -6.665 -8.663 1.00 0.00 S ATOM 0 H CYS A 124 0.858 -7.653 -9.421 1.00 0.00 H new ATOM 0 HA CYS A 124 2.120 -5.966 -11.496 1.00 0.00 H new ATOM 0 HB2 CYS A 124 3.385 -8.419 -10.307 1.00 0.00 H new ATOM 0 HB3 CYS A 124 4.148 -6.984 -10.962 1.00 0.00 H new ATOM 386 N PHE A 125 2.467 -8.000 -13.161 1.00 0.00 N ATOM 387 CA PHE A 125 2.247 -8.928 -14.264 1.00 0.00 C ATOM 388 C PHE A 125 3.568 -9.311 -14.925 1.00 0.00 C ATOM 389 O PHE A 125 4.560 -8.589 -14.821 1.00 0.00 O ATOM 390 CB PHE A 125 1.306 -8.308 -15.299 1.00 0.00 C ATOM 391 CG PHE A 125 1.963 -7.266 -16.158 1.00 0.00 C ATOM 392 CD1 PHE A 125 2.063 -5.954 -15.725 1.00 0.00 C ATOM 393 CD2 PHE A 125 2.482 -7.599 -17.399 1.00 0.00 C ATOM 394 CE1 PHE A 125 2.667 -4.993 -16.514 1.00 0.00 C ATOM 395 CE2 PHE A 125 3.087 -6.642 -18.193 1.00 0.00 C ATOM 396 CZ PHE A 125 3.180 -5.338 -17.749 1.00 0.00 C ATOM 0 H PHE A 125 3.283 -7.398 -13.273 1.00 0.00 H new ATOM 0 HA PHE A 125 1.788 -9.831 -13.861 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.911 -9.098 -15.938 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.457 -7.860 -14.784 1.00 0.00 H new ATOM 0 HD1 PHE A 125 1.664 -5.679 -14.760 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.413 -8.618 -17.750 1.00 0.00 H new ATOM 0 HE1 PHE A 125 2.738 -3.973 -16.165 1.00 0.00 H new ATOM 0 HE2 PHE A 125 3.486 -6.914 -19.159 1.00 0.00 H new ATOM 0 HZ PHE A 125 3.653 -4.589 -18.367 1.00 0.00 H new ATOM 406 N LYS A 126 3.573 -10.453 -15.604 1.00 0.00 N ATOM 407 CA LYS A 126 4.770 -10.933 -16.284 1.00 0.00 C ATOM 408 C LYS A 126 4.404 -11.728 -17.533 1.00 0.00 C ATOM 409 O LYS A 126 3.911 -12.853 -17.444 1.00 0.00 O ATOM 410 CB LYS A 126 5.603 -11.803 -15.339 1.00 0.00 C ATOM 411 CG LYS A 126 6.488 -12.806 -16.058 1.00 0.00 C ATOM 412 CD LYS A 126 7.648 -13.253 -15.184 1.00 0.00 C ATOM 413 CE LYS A 126 7.532 -14.723 -14.812 1.00 0.00 C ATOM 414 NZ LYS A 126 6.613 -14.932 -13.659 1.00 0.00 N ATOM 0 H LYS A 126 2.761 -11.063 -15.698 1.00 0.00 H new ATOM 0 HA LYS A 126 5.359 -10.067 -16.586 1.00 0.00 H new ATOM 0 HB2 LYS A 126 6.227 -11.158 -14.720 1.00 0.00 H new ATOM 0 HB3 LYS A 126 4.933 -12.339 -14.666 1.00 0.00 H new ATOM 0 HG2 LYS A 126 5.895 -13.673 -16.349 1.00 0.00 H new ATOM 0 HG3 LYS A 126 6.873 -12.361 -16.976 1.00 0.00 H new ATOM 0 HD2 LYS A 126 8.588 -13.083 -15.710 1.00 0.00 H new ATOM 0 HD3 LYS A 126 7.676 -12.648 -14.277 1.00 0.00 H new ATOM 0 HE2 LYS A 126 7.171 -15.288 -15.671 1.00 0.00 H new ATOM 0 HE3 LYS A 126 8.519 -15.114 -14.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 6.798 -15.862 -13.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 6.771 -14.188 -12.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 5.628 -14.892 -13.989 1.00 0.00 H new ATOM 428 N LYS A 127 4.650 -11.137 -18.698 1.00 0.00 N ATOM 429 CA LYS A 127 4.350 -11.791 -19.966 1.00 0.00 C ATOM 430 C LYS A 127 5.623 -12.310 -20.626 1.00 0.00 C ATOM 431 O LYS A 127 6.720 -11.820 -20.354 1.00 0.00 O ATOM 432 CB LYS A 127 3.636 -10.818 -20.908 1.00 0.00 C ATOM 433 CG LYS A 127 2.146 -10.693 -20.638 1.00 0.00 C ATOM 434 CD LYS A 127 1.776 -9.290 -20.188 1.00 0.00 C ATOM 435 CE LYS A 127 1.212 -8.467 -21.336 1.00 0.00 C ATOM 436 NZ LYS A 127 2.288 -7.907 -22.199 1.00 0.00 N ATOM 0 H LYS A 127 5.056 -10.206 -18.790 1.00 0.00 H new ATOM 0 HA LYS A 127 3.696 -12.639 -19.763 1.00 0.00 H new ATOM 0 HB2 LYS A 127 4.097 -9.834 -20.818 1.00 0.00 H new ATOM 0 HB3 LYS A 127 3.784 -11.147 -21.937 1.00 0.00 H new ATOM 0 HG2 LYS A 127 1.589 -10.945 -21.541 1.00 0.00 H new ATOM 0 HG3 LYS A 127 1.853 -11.411 -19.872 1.00 0.00 H new ATOM 0 HD2 LYS A 127 1.042 -9.346 -19.384 1.00 0.00 H new ATOM 0 HD3 LYS A 127 2.657 -8.793 -19.781 1.00 0.00 H new ATOM 0 HE2 LYS A 127 0.551 -9.090 -21.938 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.607 -7.653 -20.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.862 -7.353 -22.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 2.905 -7.292 -21.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 2.850 -8.684 -22.601 1.00 0.00 H new ATOM 450 N LEU A 128 5.471 -13.304 -21.494 1.00 0.00 N ATOM 451 CA LEU A 128 6.609 -13.890 -22.193 1.00 0.00 C ATOM 452 C LEU A 128 7.018 -13.029 -23.384 1.00 0.00 C ATOM 453 O LEU A 128 6.173 -12.589 -24.165 1.00 0.00 O ATOM 454 CB LEU A 128 6.270 -15.305 -22.666 1.00 0.00 C ATOM 455 CG LEU A 128 7.437 -16.291 -22.724 1.00 0.00 C ATOM 456 CD1 LEU A 128 6.959 -17.657 -23.189 1.00 0.00 C ATOM 457 CD2 LEU A 128 8.532 -15.767 -23.642 1.00 0.00 C ATOM 0 H LEU A 128 4.571 -13.721 -21.731 1.00 0.00 H new ATOM 0 HA LEU A 128 7.446 -13.937 -21.496 1.00 0.00 H new ATOM 0 HB2 LEU A 128 5.507 -15.715 -22.004 1.00 0.00 H new ATOM 0 HB3 LEU A 128 5.827 -15.238 -23.660 1.00 0.00 H new ATOM 0 HG LEU A 128 7.850 -16.395 -21.721 1.00 0.00 H new ATOM 0 HD11 LEU A 128 7.803 -18.345 -23.224 1.00 0.00 H new ATOM 0 HD12 LEU A 128 6.210 -18.036 -22.494 1.00 0.00 H new ATOM 0 HD13 LEU A 128 6.520 -17.570 -24.183 1.00 0.00 H new ATOM 0 HD21 LEU A 128 9.355 -16.481 -23.671 1.00 0.00 H new ATOM 0 HD22 LEU A 128 8.131 -15.633 -24.647 1.00 0.00 H new ATOM 0 HD23 LEU A 128 8.895 -14.811 -23.266 1.00 0.00 H new ATOM 660 N ILE A 139 8.300 -9.622 -19.800 1.00 0.00 N ATOM 661 CA ILE A 139 7.793 -8.270 -19.598 1.00 0.00 C ATOM 662 C ILE A 139 7.206 -8.106 -18.200 1.00 0.00 C ATOM 663 O ILE A 139 6.012 -8.320 -17.988 1.00 0.00 O ATOM 664 CB ILE A 139 6.717 -7.912 -20.640 1.00 0.00 C ATOM 665 CG1 ILE A 139 7.262 -8.106 -22.056 1.00 0.00 C ATOM 666 CG2 ILE A 139 6.242 -6.480 -20.441 1.00 0.00 C ATOM 667 CD1 ILE A 139 8.482 -7.264 -22.355 1.00 0.00 C ATOM 0 HA ILE A 139 8.640 -7.594 -19.715 1.00 0.00 H new ATOM 0 HB ILE A 139 5.865 -8.579 -20.504 1.00 0.00 H new ATOM 0 HG12 ILE A 139 7.512 -9.157 -22.199 1.00 0.00 H new ATOM 0 HG13 ILE A 139 6.479 -7.864 -22.774 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.482 -6.242 -21.185 1.00 0.00 H new ATOM 0 HG22 ILE A 139 5.819 -6.373 -19.442 1.00 0.00 H new ATOM 0 HG23 ILE A 139 7.085 -5.798 -20.553 1.00 0.00 H new ATOM 0 HD11 ILE A 139 8.813 -7.453 -23.376 1.00 0.00 H new ATOM 0 HD12 ILE A 139 8.232 -6.209 -22.244 1.00 0.00 H new ATOM 0 HD13 ILE A 139 9.281 -7.522 -21.660 1.00 0.00 H new ATOM 679 N ARG A 140 8.052 -7.724 -17.250 1.00 0.00 N ATOM 680 CA ARG A 140 7.617 -7.530 -15.872 1.00 0.00 C ATOM 681 C ARG A 140 7.314 -6.060 -15.599 1.00 0.00 C ATOM 682 O ARG A 140 8.026 -5.172 -16.066 1.00 0.00 O ATOM 683 CB ARG A 140 8.689 -8.030 -14.901 1.00 0.00 C ATOM 684 CG ARG A 140 9.032 -9.500 -15.077 1.00 0.00 C ATOM 685 CD ARG A 140 9.918 -10.004 -13.948 1.00 0.00 C ATOM 686 NE ARG A 140 9.962 -11.463 -13.896 1.00 0.00 N ATOM 687 CZ ARG A 140 10.756 -12.202 -14.663 1.00 0.00 C ATOM 688 NH1 ARG A 140 11.569 -11.621 -15.535 1.00 0.00 N ATOM 689 NH2 ARG A 140 10.740 -13.524 -14.558 1.00 0.00 N ATOM 0 H ARG A 140 9.043 -7.543 -17.409 1.00 0.00 H new ATOM 0 HA ARG A 140 6.703 -8.105 -15.722 1.00 0.00 H new ATOM 0 HB2 ARG A 140 9.593 -7.436 -15.034 1.00 0.00 H new ATOM 0 HB3 ARG A 140 8.347 -7.865 -13.879 1.00 0.00 H new ATOM 0 HG2 ARG A 140 8.114 -10.087 -15.111 1.00 0.00 H new ATOM 0 HG3 ARG A 140 9.539 -9.645 -16.031 1.00 0.00 H new ATOM 0 HD2 ARG A 140 10.928 -9.615 -14.079 1.00 0.00 H new ATOM 0 HD3 ARG A 140 9.549 -9.618 -12.998 1.00 0.00 H new ATOM 0 HE ARG A 140 9.350 -11.941 -13.235 1.00 0.00 H new ATOM 0 HH11 ARG A 140 11.586 -10.605 -15.618 1.00 0.00 H new ATOM 0 HH12 ARG A 140 12.178 -12.191 -16.123 1.00 0.00 H new ATOM 0 HH21 ARG A 140 10.117 -13.975 -13.888 1.00 0.00 H new ATOM 0 HH22 ARG A 140 11.350 -14.090 -15.148 1.00 0.00 H new ATOM 703 N GLY A 141 6.251 -5.811 -14.840 1.00 0.00 N ATOM 704 CA GLY A 141 5.872 -4.447 -14.519 1.00 0.00 C ATOM 705 C GLY A 141 4.617 -4.379 -13.671 1.00 0.00 C ATOM 706 O GLY A 141 3.987 -5.401 -13.398 1.00 0.00 O ATOM 0 H GLY A 141 5.646 -6.529 -14.442 1.00 0.00 H new ATOM 0 HA2 GLY A 141 6.691 -3.960 -13.990 1.00 0.00 H new ATOM 0 HA3 GLY A 141 5.714 -3.890 -15.443 1.00 0.00 H new ATOM 710 N CYS A 142 4.253 -3.172 -13.253 1.00 0.00 N ATOM 711 CA CYS A 142 3.066 -2.973 -12.430 1.00 0.00 C ATOM 712 C CYS A 142 1.835 -2.732 -13.299 1.00 0.00 C ATOM 713 O CYS A 142 1.949 -2.341 -14.460 1.00 0.00 O ATOM 714 CB CYS A 142 3.271 -1.792 -11.479 1.00 0.00 C ATOM 715 SG CYS A 142 4.785 -1.902 -10.471 1.00 0.00 S ATOM 0 H CYS A 142 4.763 -2.316 -13.471 1.00 0.00 H new ATOM 0 HA CYS A 142 2.905 -3.879 -11.845 1.00 0.00 H new ATOM 0 HB2 CYS A 142 3.302 -0.871 -12.062 1.00 0.00 H new ATOM 0 HB3 CYS A 142 2.410 -1.720 -10.815 1.00 0.00 H new ATOM 720 N ALA A 143 0.659 -2.970 -12.728 1.00 0.00 N ATOM 721 CA ALA A 143 -0.593 -2.777 -13.449 1.00 0.00 C ATOM 722 C ALA A 143 -1.774 -2.696 -12.487 1.00 0.00 C ATOM 723 O ALA A 143 -1.616 -2.873 -11.279 1.00 0.00 O ATOM 724 CB ALA A 143 -0.803 -3.902 -14.452 1.00 0.00 C ATOM 0 H ALA A 143 0.547 -3.297 -11.768 1.00 0.00 H new ATOM 0 HA ALA A 143 -0.531 -1.831 -13.988 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -1.742 -3.745 -14.983 1.00 0.00 H new ATOM 0 HB2 ALA A 143 0.021 -3.912 -15.166 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -0.839 -4.856 -13.926 1.00 0.00 H new ATOM 730 N ASP A 144 -2.956 -2.428 -13.030 1.00 0.00 N ATOM 731 CA ASP A 144 -4.164 -2.323 -12.220 1.00 0.00 C ATOM 732 C ASP A 144 -4.782 -3.698 -11.987 1.00 0.00 C ATOM 733 O ASP A 144 -5.061 -4.082 -10.851 1.00 0.00 O ATOM 734 CB ASP A 144 -5.179 -1.401 -12.896 1.00 0.00 C ATOM 735 CG ASP A 144 -5.388 -1.743 -14.358 1.00 0.00 C ATOM 736 OD1 ASP A 144 -4.594 -1.268 -15.197 1.00 0.00 O ATOM 737 OD2 ASP A 144 -6.345 -2.484 -14.665 1.00 0.00 O ATOM 0 H ASP A 144 -3.104 -2.279 -14.028 1.00 0.00 H new ATOM 0 HA ASP A 144 -3.889 -1.900 -11.254 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -6.132 -1.467 -12.371 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -4.840 -0.369 -12.812 1.00 0.00 H new ATOM 742 N THR A 145 -4.996 -4.437 -13.072 1.00 0.00 N ATOM 743 CA THR A 145 -5.583 -5.768 -12.987 1.00 0.00 C ATOM 744 C THR A 145 -5.017 -6.689 -14.061 1.00 0.00 C ATOM 745 O THR A 145 -4.373 -6.234 -15.008 1.00 0.00 O ATOM 746 CB THR A 145 -7.116 -5.716 -13.127 1.00 0.00 C ATOM 747 OG1 THR A 145 -7.482 -4.789 -14.156 1.00 0.00 O ATOM 748 CG2 THR A 145 -7.766 -5.306 -11.814 1.00 0.00 C ATOM 0 H THR A 145 -4.771 -4.135 -14.020 1.00 0.00 H new ATOM 0 HA THR A 145 -5.328 -6.163 -12.003 1.00 0.00 H new ATOM 0 HB THR A 145 -7.469 -6.712 -13.393 1.00 0.00 H new ATOM 0 HG1 THR A 145 -7.144 -3.898 -13.928 1.00 0.00 H new ATOM 0 HG21 THR A 145 -8.849 -5.276 -11.938 1.00 0.00 H new ATOM 0 HG22 THR A 145 -7.509 -6.029 -11.040 1.00 0.00 H new ATOM 0 HG23 THR A 145 -7.407 -4.319 -11.523 1.00 0.00 H new ATOM 756 N CYS A 146 -5.260 -7.986 -13.911 1.00 0.00 N ATOM 757 CA CYS A 146 -4.775 -8.972 -14.869 1.00 0.00 C ATOM 758 C CYS A 146 -5.136 -8.568 -16.295 1.00 0.00 C ATOM 759 O CYS A 146 -6.295 -8.618 -16.707 1.00 0.00 O ATOM 760 CB CYS A 146 -5.360 -10.351 -14.554 1.00 0.00 C ATOM 761 SG CYS A 146 -4.459 -11.734 -15.325 1.00 0.00 S ATOM 0 H CYS A 146 -5.791 -8.380 -13.134 1.00 0.00 H new ATOM 0 HA CYS A 146 -3.689 -9.018 -14.787 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -5.366 -10.493 -13.473 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -6.398 -10.378 -14.885 1.00 0.00 H new ATOM 766 N PRO A 147 -4.120 -8.157 -17.069 1.00 0.00 N ATOM 767 CA PRO A 147 -4.305 -7.737 -18.461 1.00 0.00 C ATOM 768 C PRO A 147 -4.658 -8.904 -19.377 1.00 0.00 C ATOM 769 O PRO A 147 -4.011 -9.950 -19.344 1.00 0.00 O ATOM 770 CB PRO A 147 -2.940 -7.155 -18.840 1.00 0.00 C ATOM 771 CG PRO A 147 -1.974 -7.833 -17.932 1.00 0.00 C ATOM 772 CD PRO A 147 -2.713 -8.072 -16.644 1.00 0.00 C ATOM 0 HA PRO A 147 -5.130 -7.032 -18.568 1.00 0.00 H new ATOM 0 HB2 PRO A 147 -2.703 -7.349 -19.886 1.00 0.00 H new ATOM 0 HB3 PRO A 147 -2.919 -6.074 -18.704 1.00 0.00 H new ATOM 0 HG2 PRO A 147 -1.627 -8.772 -18.363 1.00 0.00 H new ATOM 0 HG3 PRO A 147 -1.093 -7.213 -17.767 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -2.384 -8.990 -16.156 1.00 0.00 H new ATOM 0 HD3 PRO A 147 -2.556 -7.260 -15.934 1.00 0.00 H new ATOM 780 N VAL A 148 -5.690 -8.717 -20.194 1.00 0.00 N ATOM 781 CA VAL A 148 -6.129 -9.754 -21.120 1.00 0.00 C ATOM 782 C VAL A 148 -5.130 -9.933 -22.258 1.00 0.00 C ATOM 783 O VAL A 148 -4.415 -9.002 -22.622 1.00 0.00 O ATOM 784 CB VAL A 148 -7.513 -9.428 -21.713 1.00 0.00 C ATOM 785 CG1 VAL A 148 -8.062 -10.623 -22.477 1.00 0.00 C ATOM 786 CG2 VAL A 148 -8.474 -8.998 -20.616 1.00 0.00 C ATOM 0 H VAL A 148 -6.237 -7.857 -20.233 1.00 0.00 H new ATOM 0 HA VAL A 148 -6.196 -10.680 -20.549 1.00 0.00 H new ATOM 0 HB VAL A 148 -7.403 -8.600 -22.413 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -9.040 -10.374 -22.888 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -7.381 -10.880 -23.289 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -8.158 -11.473 -21.802 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -9.447 -8.772 -21.053 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -8.581 -9.804 -19.890 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -8.084 -8.110 -20.118 1.00 0.00 H new ATOM 796 N GLY A 149 -5.087 -11.140 -22.816 1.00 0.00 N ATOM 797 CA GLY A 149 -4.173 -11.420 -23.908 1.00 0.00 C ATOM 798 C GLY A 149 -4.229 -12.867 -24.354 1.00 0.00 C ATOM 799 O GLY A 149 -5.264 -13.523 -24.233 1.00 0.00 O ATOM 0 H GLY A 149 -5.669 -11.928 -22.531 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -4.412 -10.773 -24.752 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -3.156 -11.178 -23.598 1.00 0.00 H new ATOM 803 N LYS A 150 -3.113 -13.368 -24.873 1.00 0.00 N ATOM 804 CA LYS A 150 -3.038 -14.747 -25.340 1.00 0.00 C ATOM 805 C LYS A 150 -2.564 -15.674 -24.226 1.00 0.00 C ATOM 806 O LYS A 150 -1.998 -15.239 -23.223 1.00 0.00 O ATOM 807 CB LYS A 150 -2.094 -14.851 -26.540 1.00 0.00 C ATOM 808 CG LYS A 150 -2.750 -14.493 -27.863 1.00 0.00 C ATOM 809 CD LYS A 150 -3.159 -15.736 -28.636 1.00 0.00 C ATOM 810 CE LYS A 150 -2.947 -15.556 -30.132 1.00 0.00 C ATOM 811 NZ LYS A 150 -4.064 -14.801 -30.764 1.00 0.00 N ATOM 0 H LYS A 150 -2.248 -12.839 -24.981 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.038 -15.055 -25.645 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -1.240 -14.193 -26.378 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -1.706 -15.868 -26.600 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -3.627 -13.872 -27.679 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -2.060 -13.900 -28.464 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -2.580 -16.591 -28.286 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -4.208 -15.959 -28.440 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -2.009 -15.029 -30.305 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -2.855 -16.533 -30.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -3.882 -14.700 -31.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -4.956 -15.316 -30.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -4.136 -13.859 -30.330 1.00 0.00 H new ATOM 825 N PRO A 151 -2.798 -16.983 -24.404 1.00 0.00 N ATOM 826 CA PRO A 151 -2.400 -17.998 -23.424 1.00 0.00 C ATOM 827 C PRO A 151 -0.926 -18.372 -23.541 1.00 0.00 C ATOM 828 O PRO A 151 -0.253 -18.605 -22.537 1.00 0.00 O ATOM 829 CB PRO A 151 -3.285 -19.197 -23.776 1.00 0.00 C ATOM 830 CG PRO A 151 -3.618 -19.011 -25.216 1.00 0.00 C ATOM 831 CD PRO A 151 -3.467 -17.573 -25.575 1.00 0.00 C ATOM 0 HA PRO A 151 -2.523 -17.645 -22.400 1.00 0.00 H new ATOM 0 HB2 PRO A 151 -2.761 -20.138 -23.609 1.00 0.00 H new ATOM 0 HB3 PRO A 151 -4.185 -19.219 -23.161 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -2.962 -19.623 -25.835 1.00 0.00 H new ATOM 0 HG3 PRO A 151 -4.638 -19.341 -25.411 1.00 0.00 H new ATOM 0 HD2 PRO A 151 -2.872 -17.448 -26.480 1.00 0.00 H new ATOM 0 HD3 PRO A 151 -4.433 -17.104 -25.761 1.00 0.00 H new ATOM 839 N TYR A 152 -0.431 -18.425 -24.773 1.00 0.00 N ATOM 840 CA TYR A 152 0.964 -18.772 -25.021 1.00 0.00 C ATOM 841 C TYR A 152 1.892 -17.644 -24.580 1.00 0.00 C ATOM 842 O TYR A 152 3.111 -17.810 -24.541 1.00 0.00 O ATOM 843 CB TYR A 152 1.179 -19.075 -26.505 1.00 0.00 C ATOM 844 CG TYR A 152 1.315 -17.836 -27.362 1.00 0.00 C ATOM 845 CD1 TYR A 152 0.193 -17.145 -27.802 1.00 0.00 C ATOM 846 CD2 TYR A 152 2.566 -17.357 -27.731 1.00 0.00 C ATOM 847 CE1 TYR A 152 0.313 -16.014 -28.585 1.00 0.00 C ATOM 848 CE2 TYR A 152 2.695 -16.226 -28.514 1.00 0.00 C ATOM 849 CZ TYR A 152 1.566 -15.558 -28.939 1.00 0.00 C ATOM 850 OH TYR A 152 1.689 -14.431 -29.718 1.00 0.00 O ATOM 0 H TYR A 152 -0.974 -18.232 -25.615 1.00 0.00 H new ATOM 0 HA TYR A 152 1.201 -19.662 -24.437 1.00 0.00 H new ATOM 0 HB2 TYR A 152 2.076 -19.684 -26.617 1.00 0.00 H new ATOM 0 HB3 TYR A 152 0.342 -19.670 -26.871 1.00 0.00 H new ATOM 0 HD1 TYR A 152 -0.790 -17.498 -27.527 1.00 0.00 H new ATOM 0 HD2 TYR A 152 3.453 -17.878 -27.400 1.00 0.00 H new ATOM 0 HE1 TYR A 152 -0.570 -15.489 -28.919 1.00 0.00 H new ATOM 0 HE2 TYR A 152 3.675 -15.867 -28.792 1.00 0.00 H new ATOM 0 HH TYR A 152 2.638 -14.244 -29.876 1.00 0.00 H new ATOM 860 N GLU A 153 1.305 -16.498 -24.249 1.00 0.00 N ATOM 861 CA GLU A 153 2.080 -15.343 -23.812 1.00 0.00 C ATOM 862 C GLU A 153 2.428 -15.451 -22.330 1.00 0.00 C ATOM 863 O GLU A 153 3.064 -14.562 -21.764 1.00 0.00 O ATOM 864 CB GLU A 153 1.301 -14.051 -24.071 1.00 0.00 C ATOM 865 CG GLU A 153 1.466 -13.515 -25.483 1.00 0.00 C ATOM 866 CD GLU A 153 1.089 -12.050 -25.598 1.00 0.00 C ATOM 867 OE1 GLU A 153 0.359 -11.554 -24.716 1.00 0.00 O ATOM 868 OE2 GLU A 153 1.526 -11.401 -26.572 1.00 0.00 O ATOM 0 H GLU A 153 0.297 -16.345 -24.275 1.00 0.00 H new ATOM 0 HA GLU A 153 3.007 -15.321 -24.385 1.00 0.00 H new ATOM 0 HB2 GLU A 153 0.243 -14.230 -23.880 1.00 0.00 H new ATOM 0 HB3 GLU A 153 1.628 -13.291 -23.362 1.00 0.00 H new ATOM 0 HG2 GLU A 153 2.501 -13.646 -25.799 1.00 0.00 H new ATOM 0 HG3 GLU A 153 0.848 -14.100 -26.164 1.00 0.00 H new ATOM 875 N MET A 154 2.004 -16.546 -21.707 1.00 0.00 N ATOM 876 CA MET A 154 2.272 -16.771 -20.291 1.00 0.00 C ATOM 877 C MET A 154 2.036 -15.498 -19.484 1.00 0.00 C ATOM 878 O MET A 154 2.927 -15.027 -18.778 1.00 0.00 O ATOM 879 CB MET A 154 3.709 -17.256 -20.092 1.00 0.00 C ATOM 880 CG MET A 154 3.894 -18.738 -20.374 1.00 0.00 C ATOM 881 SD MET A 154 5.221 -19.470 -19.397 1.00 0.00 S ATOM 882 CE MET A 154 4.513 -21.069 -19.008 1.00 0.00 C ATOM 0 H MET A 154 1.474 -17.291 -22.160 1.00 0.00 H new ATOM 0 HA MET A 154 1.585 -17.539 -19.935 1.00 0.00 H new ATOM 0 HB2 MET A 154 4.370 -16.685 -20.744 1.00 0.00 H new ATOM 0 HB3 MET A 154 4.015 -17.048 -19.067 1.00 0.00 H new ATOM 0 HG2 MET A 154 2.962 -19.263 -20.165 1.00 0.00 H new ATOM 0 HG3 MET A 154 4.108 -18.878 -21.434 1.00 0.00 H new ATOM 0 HE1 MET A 154 5.217 -21.642 -18.405 1.00 0.00 H new ATOM 0 HE2 MET A 154 3.587 -20.931 -18.450 1.00 0.00 H new ATOM 0 HE3 MET A 154 4.303 -21.609 -19.932 1.00 0.00 H new ATOM 892 N ILE A 155 0.832 -14.947 -19.595 1.00 0.00 N ATOM 893 CA ILE A 155 0.480 -13.729 -18.875 1.00 0.00 C ATOM 894 C ILE A 155 0.148 -14.029 -17.418 1.00 0.00 C ATOM 895 O ILE A 155 -0.986 -14.378 -17.089 1.00 0.00 O ATOM 896 CB ILE A 155 -0.718 -13.016 -19.528 1.00 0.00 C ATOM 897 CG1 ILE A 155 -0.553 -12.980 -21.048 1.00 0.00 C ATOM 898 CG2 ILE A 155 -0.863 -11.607 -18.972 1.00 0.00 C ATOM 899 CD1 ILE A 155 -1.694 -12.293 -21.765 1.00 0.00 C ATOM 0 H ILE A 155 0.084 -15.325 -20.176 1.00 0.00 H new ATOM 0 HA ILE A 155 1.350 -13.073 -18.919 1.00 0.00 H new ATOM 0 HB ILE A 155 -1.625 -13.574 -19.294 1.00 0.00 H new ATOM 0 HG12 ILE A 155 0.378 -12.469 -21.292 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -0.463 -14.001 -21.420 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -1.714 -11.116 -19.443 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -1.023 -11.656 -17.895 1.00 0.00 H new ATOM 0 HG23 ILE A 155 0.044 -11.039 -19.179 1.00 0.00 H new ATOM 0 HD11 ILE A 155 -1.509 -12.305 -22.839 1.00 0.00 H new ATOM 0 HD12 ILE A 155 -2.626 -12.817 -21.551 1.00 0.00 H new ATOM 0 HD13 ILE A 155 -1.771 -11.261 -21.422 1.00 0.00 H new ATOM 911 N GLU A 156 1.143 -13.889 -16.548 1.00 0.00 N ATOM 912 CA GLU A 156 0.955 -14.144 -15.125 1.00 0.00 C ATOM 913 C GLU A 156 0.512 -12.877 -14.399 1.00 0.00 C ATOM 914 O GLU A 156 0.951 -11.774 -14.728 1.00 0.00 O ATOM 915 CB GLU A 156 2.248 -14.676 -14.504 1.00 0.00 C ATOM 916 CG GLU A 156 2.126 -14.994 -13.023 1.00 0.00 C ATOM 917 CD GLU A 156 3.315 -15.774 -12.494 1.00 0.00 C ATOM 918 OE1 GLU A 156 3.277 -17.021 -12.545 1.00 0.00 O ATOM 919 OE2 GLU A 156 4.283 -15.136 -12.030 1.00 0.00 O ATOM 0 H GLU A 156 2.087 -13.600 -16.804 1.00 0.00 H new ATOM 0 HA GLU A 156 0.173 -14.896 -15.017 1.00 0.00 H new ATOM 0 HB2 GLU A 156 2.553 -15.577 -15.036 1.00 0.00 H new ATOM 0 HB3 GLU A 156 3.039 -13.939 -14.645 1.00 0.00 H new ATOM 0 HG2 GLU A 156 2.028 -14.064 -12.462 1.00 0.00 H new ATOM 0 HG3 GLU A 156 1.215 -15.567 -12.852 1.00 0.00 H new ATOM 926 N CYS A 157 -0.359 -13.043 -13.409 1.00 0.00 N ATOM 927 CA CYS A 157 -0.863 -11.914 -12.636 1.00 0.00 C ATOM 928 C CYS A 157 -0.828 -12.220 -11.142 1.00 0.00 C ATOM 929 O CYS A 157 -1.058 -13.355 -10.723 1.00 0.00 O ATOM 930 CB CYS A 157 -2.291 -11.573 -13.065 1.00 0.00 C ATOM 931 SG CYS A 157 -2.543 -11.560 -14.869 1.00 0.00 S ATOM 0 H CYS A 157 -0.731 -13.949 -13.123 1.00 0.00 H new ATOM 0 HA CYS A 157 -0.219 -11.056 -12.829 1.00 0.00 H new ATOM 0 HB2 CYS A 157 -2.975 -12.295 -12.619 1.00 0.00 H new ATOM 0 HB3 CYS A 157 -2.555 -10.594 -12.665 1.00 0.00 H new ATOM 936 N CYS A 158 -0.538 -11.199 -10.341 1.00 0.00 N ATOM 937 CA CYS A 158 -0.472 -11.357 -8.894 1.00 0.00 C ATOM 938 C CYS A 158 -0.330 -10.002 -8.205 1.00 0.00 C ATOM 939 O CYS A 158 -0.258 -8.965 -8.863 1.00 0.00 O ATOM 940 CB CYS A 158 0.701 -12.261 -8.511 1.00 0.00 C ATOM 941 SG CYS A 158 2.117 -12.165 -9.653 1.00 0.00 S ATOM 0 H CYS A 158 -0.345 -10.253 -10.671 1.00 0.00 H new ATOM 0 HA CYS A 158 -1.402 -11.819 -8.561 1.00 0.00 H new ATOM 0 HB2 CYS A 158 1.038 -11.996 -7.509 1.00 0.00 H new ATOM 0 HB3 CYS A 158 0.352 -13.293 -8.468 1.00 0.00 H new ATOM 946 N SER A 159 -0.292 -10.021 -6.876 1.00 0.00 N ATOM 947 CA SER A 159 -0.163 -8.795 -6.098 1.00 0.00 C ATOM 948 C SER A 159 0.639 -9.043 -4.824 1.00 0.00 C ATOM 949 O SER A 159 0.115 -8.938 -3.715 1.00 0.00 O ATOM 950 CB SER A 159 -1.545 -8.243 -5.744 1.00 0.00 C ATOM 951 OG SER A 159 -2.241 -9.124 -4.880 1.00 0.00 O ATOM 0 H SER A 159 -0.349 -10.872 -6.316 1.00 0.00 H new ATOM 0 HA SER A 159 0.369 -8.062 -6.705 1.00 0.00 H new ATOM 0 HB2 SER A 159 -1.439 -7.269 -5.267 1.00 0.00 H new ATOM 0 HB3 SER A 159 -2.123 -8.090 -6.655 1.00 0.00 H new ATOM 0 HG SER A 159 -1.711 -9.274 -4.070 1.00 0.00 H new ATOM 957 N THR A 160 1.916 -9.372 -4.991 1.00 0.00 N ATOM 958 CA THR A 160 2.792 -9.636 -3.856 1.00 0.00 C ATOM 959 C THR A 160 4.229 -9.230 -4.165 1.00 0.00 C ATOM 960 O THR A 160 4.626 -9.153 -5.328 1.00 0.00 O ATOM 961 CB THR A 160 2.765 -11.124 -3.460 1.00 0.00 C ATOM 962 OG1 THR A 160 2.725 -11.943 -4.633 1.00 0.00 O ATOM 963 CG2 THR A 160 1.560 -11.428 -2.582 1.00 0.00 C ATOM 0 H THR A 160 2.367 -9.462 -5.902 1.00 0.00 H new ATOM 0 HA THR A 160 2.419 -9.039 -3.023 1.00 0.00 H new ATOM 0 HB THR A 160 3.671 -11.343 -2.896 1.00 0.00 H new ATOM 0 HG1 THR A 160 2.710 -12.888 -4.372 1.00 0.00 H new ATOM 0 HG21 THR A 160 1.562 -12.485 -2.315 1.00 0.00 H new ATOM 0 HG22 THR A 160 1.609 -10.824 -1.676 1.00 0.00 H new ATOM 0 HG23 THR A 160 0.645 -11.193 -3.126 1.00 0.00 H new ATOM 971 N ASP A 161 5.004 -8.974 -3.117 1.00 0.00 N ATOM 972 CA ASP A 161 6.399 -8.578 -3.277 1.00 0.00 C ATOM 973 C ASP A 161 7.107 -9.476 -4.287 1.00 0.00 C ATOM 974 O ASP A 161 7.326 -10.660 -4.034 1.00 0.00 O ATOM 975 CB ASP A 161 7.124 -8.632 -1.931 1.00 0.00 C ATOM 976 CG ASP A 161 7.057 -7.315 -1.184 1.00 0.00 C ATOM 977 OD1 ASP A 161 6.091 -6.556 -1.406 1.00 0.00 O ATOM 978 OD2 ASP A 161 7.971 -7.042 -0.378 1.00 0.00 O ATOM 0 H ASP A 161 4.691 -9.033 -2.148 1.00 0.00 H new ATOM 0 HA ASP A 161 6.420 -7.555 -3.651 1.00 0.00 H new ATOM 0 HB2 ASP A 161 6.685 -9.418 -1.316 1.00 0.00 H new ATOM 0 HB3 ASP A 161 8.168 -8.901 -2.094 1.00 0.00 H new ATOM 983 N LYS A 162 7.461 -8.904 -5.433 1.00 0.00 N ATOM 984 CA LYS A 162 8.144 -9.651 -6.482 1.00 0.00 C ATOM 985 C LYS A 162 7.386 -10.932 -6.819 1.00 0.00 C ATOM 986 O LYS A 162 7.982 -12.002 -6.950 1.00 0.00 O ATOM 987 CB LYS A 162 9.572 -9.990 -6.048 1.00 0.00 C ATOM 988 CG LYS A 162 10.344 -8.797 -5.512 1.00 0.00 C ATOM 989 CD LYS A 162 11.642 -9.226 -4.848 1.00 0.00 C ATOM 990 CE LYS A 162 11.608 -8.979 -3.347 1.00 0.00 C ATOM 991 NZ LYS A 162 12.733 -9.658 -2.648 1.00 0.00 N ATOM 0 H LYS A 162 7.286 -7.925 -5.659 1.00 0.00 H new ATOM 0 HA LYS A 162 8.181 -9.026 -7.374 1.00 0.00 H new ATOM 0 HB2 LYS A 162 9.536 -10.763 -5.281 1.00 0.00 H new ATOM 0 HB3 LYS A 162 10.111 -10.409 -6.898 1.00 0.00 H new ATOM 0 HG2 LYS A 162 10.562 -8.107 -6.327 1.00 0.00 H new ATOM 0 HG3 LYS A 162 9.728 -8.257 -4.793 1.00 0.00 H new ATOM 0 HD2 LYS A 162 11.818 -10.285 -5.040 1.00 0.00 H new ATOM 0 HD3 LYS A 162 12.476 -8.680 -5.289 1.00 0.00 H new ATOM 0 HE2 LYS A 162 11.655 -7.907 -3.154 1.00 0.00 H new ATOM 0 HE3 LYS A 162 10.661 -9.335 -2.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 12.675 -9.465 -1.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 12.674 -10.684 -2.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 13.637 -9.300 -3.017 1.00 0.00 H new ATOM 1005 N CYS A 163 6.070 -10.815 -6.961 1.00 0.00 N ATOM 1006 CA CYS A 163 5.231 -11.962 -7.284 1.00 0.00 C ATOM 1007 C CYS A 163 5.595 -12.535 -8.651 1.00 0.00 C ATOM 1008 O CYS A 163 5.349 -13.707 -8.930 1.00 0.00 O ATOM 1009 CB CYS A 163 3.754 -11.563 -7.263 1.00 0.00 C ATOM 1010 SG CYS A 163 3.187 -10.735 -8.784 1.00 0.00 S ATOM 0 H CYS A 163 5.562 -9.937 -6.857 1.00 0.00 H new ATOM 0 HA CYS A 163 5.404 -12.730 -6.530 1.00 0.00 H new ATOM 0 HB2 CYS A 163 3.150 -12.455 -7.101 1.00 0.00 H new ATOM 0 HB3 CYS A 163 3.579 -10.901 -6.415 1.00 0.00 H new ATOM 1015 N ASN A 164 6.184 -11.697 -9.499 1.00 0.00 N ATOM 1016 CA ASN A 164 6.582 -12.119 -10.837 1.00 0.00 C ATOM 1017 C ASN A 164 8.011 -12.653 -10.837 1.00 0.00 C ATOM 1018 O ASN A 164 8.626 -12.811 -11.891 1.00 0.00 O ATOM 1019 CB ASN A 164 6.462 -10.952 -11.819 1.00 0.00 C ATOM 1020 CG ASN A 164 7.060 -9.671 -11.271 1.00 0.00 C ATOM 1021 OD1 ASN A 164 7.866 -9.698 -10.340 1.00 0.00 O ATOM 1022 ND2 ASN A 164 6.667 -8.541 -11.846 1.00 0.00 N ATOM 0 H ASN A 164 6.396 -10.723 -9.283 1.00 0.00 H new ATOM 0 HA ASN A 164 5.914 -12.921 -11.152 1.00 0.00 H new ATOM 0 HB2 ASN A 164 6.962 -11.213 -12.752 1.00 0.00 H new ATOM 0 HB3 ASN A 164 5.411 -10.787 -12.056 1.00 0.00 H new ATOM 0 HD21 ASN A 164 7.035 -7.648 -11.519 1.00 0.00 H new ATOM 0 HD22 ASN A 164 5.997 -8.566 -12.615 1.00 0.00 H new ATOM 1029 N ARG A 165 8.533 -12.930 -9.646 1.00 0.00 N ATOM 1030 CA ARG A 165 9.889 -13.446 -9.508 1.00 0.00 C ATOM 1031 C ARG A 165 9.932 -14.945 -9.791 1.00 0.00 C ATOM 1032 O ARG A 165 9.086 -15.701 -9.313 1.00 0.00 O ATOM 1033 CB ARG A 165 10.423 -13.166 -8.102 1.00 0.00 C ATOM 1034 CG ARG A 165 11.895 -13.506 -7.931 1.00 0.00 C ATOM 1035 CD ARG A 165 12.636 -12.412 -7.180 1.00 0.00 C ATOM 1036 NE ARG A 165 13.465 -12.950 -6.105 1.00 0.00 N ATOM 1037 CZ ARG A 165 12.980 -13.366 -4.940 1.00 0.00 C ATOM 1038 NH1 ARG A 165 11.677 -13.306 -4.702 1.00 0.00 N ATOM 1039 NH2 ARG A 165 13.799 -13.844 -4.012 1.00 0.00 N ATOM 0 H ARG A 165 8.037 -12.806 -8.763 1.00 0.00 H new ATOM 0 HA ARG A 165 10.520 -12.938 -10.237 1.00 0.00 H new ATOM 0 HB2 ARG A 165 10.273 -12.112 -7.869 1.00 0.00 H new ATOM 0 HB3 ARG A 165 9.840 -13.739 -7.380 1.00 0.00 H new ATOM 0 HG2 ARG A 165 11.992 -14.448 -7.392 1.00 0.00 H new ATOM 0 HG3 ARG A 165 12.352 -13.651 -8.910 1.00 0.00 H new ATOM 0 HD2 ARG A 165 13.263 -11.855 -7.877 1.00 0.00 H new ATOM 0 HD3 ARG A 165 11.916 -11.707 -6.764 1.00 0.00 H new ATOM 0 HE ARG A 165 14.472 -13.010 -6.257 1.00 0.00 H new ATOM 0 HH11 ARG A 165 11.045 -12.940 -5.414 1.00 0.00 H new ATOM 0 HH12 ARG A 165 11.307 -13.626 -3.807 1.00 0.00 H new ATOM 0 HH21 ARG A 165 14.802 -13.892 -4.193 1.00 0.00 H new ATOM 0 HH22 ARG A 165 13.426 -14.163 -3.118 1.00 0.00 H new