USER MOD reduce.3.24.130724 H: found=0, std=0, add=304, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 245 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 133 ASN : amide:sc= -2.03 K(o=-2,f=-0.18) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -1.61! C(o=-1.6!,f=-2.2!) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 LYS NZ :NH3+ -163:sc= -0.0156 (180deg=-0.408) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.122) USER MOD Single : A 163 ASN : amide:sc= -0.112 K(o=-0.11,f=-2!) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N VAL A 132 -20.512 -5.863 -6.671 1.00 0.00 N ATOM 20 CA VAL A 132 -20.583 -4.490 -6.199 1.00 0.00 C ATOM 21 C VAL A 132 -20.181 -4.440 -4.724 1.00 0.00 C ATOM 22 O VAL A 132 -19.218 -3.768 -4.361 1.00 0.00 O ATOM 23 CB VAL A 132 -21.978 -3.918 -6.460 1.00 0.00 C ATOM 24 CG1 VAL A 132 -22.151 -2.562 -5.773 1.00 0.00 C ATOM 25 CG2 VAL A 132 -22.257 -3.813 -7.960 1.00 0.00 C ATOM 0 HA VAL A 132 -19.882 -3.861 -6.747 1.00 0.00 H new ATOM 0 HB VAL A 132 -22.707 -4.606 -6.032 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -23.151 -2.177 -5.974 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -22.017 -2.679 -4.698 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -21.409 -1.862 -6.157 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -23.255 -3.404 -8.117 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -21.519 -3.157 -8.422 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -22.196 -4.803 -8.412 1.00 0.00 H new ATOM 35 N ASN A 133 -20.941 -5.161 -3.913 1.00 0.00 N ATOM 36 CA ASN A 133 -20.678 -5.208 -2.484 1.00 0.00 C ATOM 37 C ASN A 133 -19.165 -5.182 -2.249 1.00 0.00 C ATOM 38 O ASN A 133 -18.695 -4.597 -1.274 1.00 0.00 O ATOM 39 CB ASN A 133 -21.231 -6.492 -1.863 1.00 0.00 C ATOM 40 CG ASN A 133 -21.425 -7.575 -2.926 1.00 0.00 C ATOM 41 OD1 ASN A 133 -22.533 -7.905 -3.317 1.00 0.00 O ATOM 42 ND2 ASN A 133 -20.291 -8.107 -3.371 1.00 0.00 N ATOM 0 H ASN A 133 -21.739 -5.718 -4.218 1.00 0.00 H new ATOM 0 HA ASN A 133 -21.163 -4.348 -2.023 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -20.548 -6.851 -1.093 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -22.182 -6.283 -1.373 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -20.315 -8.838 -4.082 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.397 -7.785 -3.001 1.00 0.00 H new ATOM 48 N MET A 134 -18.446 -5.822 -3.158 1.00 0.00 N ATOM 49 CA MET A 134 -16.998 -5.880 -3.062 1.00 0.00 C ATOM 50 C MET A 134 -16.367 -4.549 -3.476 1.00 0.00 C ATOM 51 O MET A 134 -15.586 -3.966 -2.725 1.00 0.00 O ATOM 52 CB MET A 134 -16.470 -6.998 -3.963 1.00 0.00 C ATOM 53 CG MET A 134 -16.882 -8.372 -3.430 1.00 0.00 C ATOM 54 SD MET A 134 -15.436 -9.290 -2.925 1.00 0.00 S ATOM 55 CE MET A 134 -16.035 -9.993 -1.397 1.00 0.00 C ATOM 0 H MET A 134 -18.839 -6.305 -3.965 1.00 0.00 H new ATOM 0 HA MET A 134 -16.730 -6.081 -2.025 1.00 0.00 H new ATOM 0 HB2 MET A 134 -16.854 -6.866 -4.975 1.00 0.00 H new ATOM 0 HB3 MET A 134 -15.383 -6.938 -4.024 1.00 0.00 H new ATOM 0 HG2 MET A 134 -17.562 -8.255 -2.586 1.00 0.00 H new ATOM 0 HG3 MET A 134 -17.422 -8.923 -4.200 1.00 0.00 H new ATOM 0 HE1 MET A 134 -15.252 -10.602 -0.945 1.00 0.00 H new ATOM 0 HE2 MET A 134 -16.313 -9.192 -0.712 1.00 0.00 H new ATOM 0 HE3 MET A 134 -16.907 -10.615 -1.600 1.00 0.00 H new ATOM 63 N ASP A 135 -16.729 -4.107 -4.671 1.00 0.00 N ATOM 64 CA ASP A 135 -16.208 -2.855 -5.195 1.00 0.00 C ATOM 65 C ASP A 135 -16.332 -1.768 -4.125 1.00 0.00 C ATOM 66 O ASP A 135 -15.479 -0.887 -4.030 1.00 0.00 O ATOM 67 CB ASP A 135 -17.000 -2.400 -6.424 1.00 0.00 C ATOM 68 CG ASP A 135 -16.196 -1.598 -7.449 1.00 0.00 C ATOM 69 OD1 ASP A 135 -15.375 -0.768 -7.004 1.00 0.00 O ATOM 70 OD2 ASP A 135 -16.421 -1.834 -8.656 1.00 0.00 O ATOM 0 H ASP A 135 -17.377 -4.593 -5.292 1.00 0.00 H new ATOM 0 HA ASP A 135 -15.167 -3.014 -5.475 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -17.414 -3.279 -6.917 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -17.843 -1.794 -6.091 1.00 0.00 H new ATOM 74 N LEU A 136 -17.399 -1.868 -3.347 1.00 0.00 N ATOM 75 CA LEU A 136 -17.645 -0.905 -2.287 1.00 0.00 C ATOM 76 C LEU A 136 -16.684 -1.172 -1.127 1.00 0.00 C ATOM 77 O LEU A 136 -15.962 -0.275 -0.695 1.00 0.00 O ATOM 78 CB LEU A 136 -19.120 -0.921 -1.879 1.00 0.00 C ATOM 79 CG LEU A 136 -19.529 0.083 -0.799 1.00 0.00 C ATOM 80 CD1 LEU A 136 -20.743 0.902 -1.244 1.00 0.00 C ATOM 81 CD2 LEU A 136 -19.768 -0.619 0.538 1.00 0.00 C ATOM 0 H LEU A 136 -18.103 -2.601 -3.429 1.00 0.00 H new ATOM 0 HA LEU A 136 -17.446 0.107 -2.640 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -19.724 -0.735 -2.767 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -19.369 -1.923 -1.528 1.00 0.00 H new ATOM 0 HG LEU A 136 -18.706 0.783 -0.652 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -21.013 1.608 -0.459 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -20.499 1.449 -2.155 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -21.582 0.234 -1.436 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -20.057 0.117 1.289 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -20.564 -1.355 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -18.853 -1.120 0.855 1.00 0.00 H new ATOM 92 N ARG A 137 -16.706 -2.410 -0.656 1.00 0.00 N ATOM 93 CA ARG A 137 -15.845 -2.807 0.445 1.00 0.00 C ATOM 94 C ARG A 137 -14.465 -2.163 0.299 1.00 0.00 C ATOM 95 O ARG A 137 -14.034 -1.407 1.168 1.00 0.00 O ATOM 96 CB ARG A 137 -15.686 -4.328 0.499 1.00 0.00 C ATOM 97 CG ARG A 137 -17.037 -5.012 0.723 1.00 0.00 C ATOM 98 CD ARG A 137 -17.055 -5.767 2.055 1.00 0.00 C ATOM 99 NE ARG A 137 -18.369 -6.419 2.248 1.00 0.00 N ATOM 100 CZ ARG A 137 -18.656 -7.243 3.265 1.00 0.00 C ATOM 101 NH1 ARG A 137 -17.724 -7.520 4.186 1.00 0.00 N ATOM 102 NH2 ARG A 137 -19.876 -7.789 3.361 1.00 0.00 N ATOM 0 H ARG A 137 -17.307 -3.151 -1.017 1.00 0.00 H new ATOM 0 HA ARG A 137 -16.312 -2.468 1.370 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -15.243 -4.684 -0.431 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -15.000 -4.597 1.302 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -17.832 -4.267 0.712 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -17.238 -5.704 -0.094 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -16.263 -6.515 2.069 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -16.857 -5.078 2.876 1.00 0.00 H new ATOM 0 HE ARG A 137 -19.102 -6.230 1.564 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -16.796 -7.104 4.113 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -17.943 -8.147 4.960 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -20.586 -7.577 2.660 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -20.095 -8.416 4.135 1.00 0.00 H new ATOM 113 N ALA A 138 -13.810 -2.486 -0.807 1.00 0.00 N ATOM 114 CA ALA A 138 -12.488 -1.947 -1.078 1.00 0.00 C ATOM 115 C ALA A 138 -12.582 -0.428 -1.233 1.00 0.00 C ATOM 116 O ALA A 138 -11.905 0.315 -0.524 1.00 0.00 O ATOM 117 CB ALA A 138 -11.906 -2.625 -2.320 1.00 0.00 C ATOM 0 H ALA A 138 -14.170 -3.114 -1.526 1.00 0.00 H new ATOM 0 HA ALA A 138 -11.813 -2.152 -0.247 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -10.914 -2.221 -2.524 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -11.832 -3.699 -2.147 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -12.556 -2.439 -3.175 1.00 0.00 H new ATOM 123 N ASN A 139 -13.428 -0.012 -2.163 1.00 0.00 N ATOM 124 CA ASN A 139 -13.620 1.405 -2.421 1.00 0.00 C ATOM 125 C ASN A 139 -13.443 2.184 -1.116 1.00 0.00 C ATOM 126 O ASN A 139 -12.848 3.261 -1.107 1.00 0.00 O ATOM 127 CB ASN A 139 -15.028 1.684 -2.951 1.00 0.00 C ATOM 128 CG ASN A 139 -15.315 3.186 -2.981 1.00 0.00 C ATOM 129 OD1 ASN A 139 -14.440 4.016 -2.797 1.00 0.00 O ATOM 130 ND2 ASN A 139 -16.588 3.489 -3.223 1.00 0.00 N ATOM 0 H ASN A 139 -13.989 -0.632 -2.748 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.887 1.714 -3.166 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -15.131 1.270 -3.954 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -15.763 1.182 -2.322 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -16.881 4.465 -3.263 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -17.271 2.745 -3.368 1.00 0.00 H new ATOM 136 N LEU A 140 -13.972 1.610 -0.045 1.00 0.00 N ATOM 137 CA LEU A 140 -13.880 2.237 1.263 1.00 0.00 C ATOM 138 C LEU A 140 -12.476 2.020 1.831 1.00 0.00 C ATOM 139 O LEU A 140 -11.786 2.978 2.175 1.00 0.00 O ATOM 140 CB LEU A 140 -14.999 1.733 2.178 1.00 0.00 C ATOM 141 CG LEU A 140 -16.103 2.741 2.503 1.00 0.00 C ATOM 142 CD1 LEU A 140 -17.107 2.845 1.354 1.00 0.00 C ATOM 143 CD2 LEU A 140 -16.784 2.397 3.830 1.00 0.00 C ATOM 0 H LEU A 140 -14.466 0.718 -0.056 1.00 0.00 H new ATOM 0 HA LEU A 140 -14.027 3.314 1.181 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.457 0.860 1.713 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -14.553 1.398 3.114 1.00 0.00 H new ATOM 0 HG LEU A 140 -15.646 3.723 2.620 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -17.881 3.568 1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -16.593 3.170 0.450 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -17.564 1.871 1.181 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -17.565 3.128 4.039 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -17.226 1.403 3.765 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -16.047 2.415 4.633 1.00 0.00 H new ATOM 172 N GLN A 142 -9.115 0.108 0.717 1.00 0.00 N ATOM 173 CA GLN A 142 -8.347 -0.617 -0.282 1.00 0.00 C ATOM 174 C GLN A 142 -6.853 -0.349 -0.100 1.00 0.00 C ATOM 175 O GLN A 142 -6.040 -1.269 -0.172 1.00 0.00 O ATOM 176 CB GLN A 142 -8.802 -0.251 -1.696 1.00 0.00 C ATOM 177 CG GLN A 142 -9.234 1.215 -1.771 1.00 0.00 C ATOM 178 CD GLN A 142 -9.157 1.737 -3.207 1.00 0.00 C ATOM 179 OE1 GLN A 142 -9.603 1.104 -4.149 1.00 0.00 O ATOM 180 NE2 GLN A 142 -8.567 2.924 -3.320 1.00 0.00 N ATOM 0 HA GLN A 142 -8.524 -1.684 -0.144 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -7.990 -0.431 -2.401 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -9.631 -0.894 -1.993 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -10.253 1.317 -1.397 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -8.596 1.819 -1.126 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -8.216 3.400 -2.489 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -8.466 3.358 -4.237 1.00 0.00 H new ATOM 187 N VAL A 143 -6.535 0.916 0.134 1.00 0.00 N ATOM 188 CA VAL A 143 -5.151 1.317 0.326 1.00 0.00 C ATOM 189 C VAL A 143 -5.112 2.709 0.960 1.00 0.00 C ATOM 190 O VAL A 143 -5.659 3.663 0.408 1.00 0.00 O ATOM 191 CB VAL A 143 -4.395 1.243 -1.002 1.00 0.00 C ATOM 192 CG1 VAL A 143 -5.304 0.736 -2.123 1.00 0.00 C ATOM 193 CG2 VAL A 143 -3.786 2.600 -1.361 1.00 0.00 C ATOM 0 H VAL A 143 -7.212 1.677 0.195 1.00 0.00 H new ATOM 0 HA VAL A 143 -4.647 0.634 1.009 1.00 0.00 H new ATOM 0 HB VAL A 143 -3.579 0.530 -0.885 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -4.742 0.693 -3.056 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -5.669 -0.260 -1.873 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -6.150 1.413 -2.240 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -3.254 2.521 -2.309 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -4.579 3.342 -1.451 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -3.090 2.905 -0.579 1.00 0.00 H new ATOM 203 N LYS A 144 -4.461 2.782 2.112 1.00 0.00 N ATOM 204 CA LYS A 144 -4.343 4.042 2.826 1.00 0.00 C ATOM 205 C LYS A 144 -2.866 4.331 3.101 1.00 0.00 C ATOM 206 O LYS A 144 -2.340 3.955 4.146 1.00 0.00 O ATOM 207 CB LYS A 144 -5.210 4.025 4.088 1.00 0.00 C ATOM 208 CG LYS A 144 -6.464 3.173 3.878 1.00 0.00 C ATOM 209 CD LYS A 144 -7.591 3.618 4.814 1.00 0.00 C ATOM 210 CE LYS A 144 -8.184 4.953 4.363 1.00 0.00 C ATOM 211 NZ LYS A 144 -9.241 5.394 5.300 1.00 0.00 N ATOM 0 H LYS A 144 -4.010 1.989 2.568 1.00 0.00 H new ATOM 0 HA LYS A 144 -4.721 4.862 2.216 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -4.633 3.631 4.925 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -5.497 5.043 4.351 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -6.793 3.253 2.842 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -6.230 2.124 4.058 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -8.372 2.858 4.835 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -7.209 3.711 5.831 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -7.399 5.707 4.310 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -8.598 4.853 3.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -9.633 6.302 4.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -9.998 4.681 5.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -8.836 5.509 6.251 1.00 0.00 H new ATOM 221 N LYS A 145 -2.240 4.998 2.142 1.00 0.00 N ATOM 222 CA LYS A 145 -0.833 5.343 2.267 1.00 0.00 C ATOM 223 C LYS A 145 -0.608 6.751 1.714 1.00 0.00 C ATOM 224 O LYS A 145 -1.354 7.211 0.851 1.00 0.00 O ATOM 225 CB LYS A 145 0.041 4.276 1.606 1.00 0.00 C ATOM 226 CG LYS A 145 -0.100 4.317 0.082 1.00 0.00 C ATOM 227 CD LYS A 145 1.109 3.672 -0.598 1.00 0.00 C ATOM 228 CE LYS A 145 1.100 3.943 -2.104 1.00 0.00 C ATOM 229 NZ LYS A 145 -0.230 3.638 -2.677 1.00 0.00 N ATOM 0 H LYS A 145 -2.680 5.309 1.276 1.00 0.00 H new ATOM 0 HA LYS A 145 -0.536 5.360 3.316 1.00 0.00 H new ATOM 0 HB2 LYS A 145 1.084 4.433 1.883 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -0.242 3.290 1.974 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -1.010 3.797 -0.217 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -0.200 5.350 -0.250 1.00 0.00 H new ATOM 0 HD2 LYS A 145 2.028 4.062 -0.160 1.00 0.00 H new ATOM 0 HD3 LYS A 145 1.101 2.597 -0.418 1.00 0.00 H new ATOM 0 HE2 LYS A 145 1.354 4.986 -2.293 1.00 0.00 H new ATOM 0 HE3 LYS A 145 1.861 3.336 -2.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -0.150 3.546 -3.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -0.584 2.746 -2.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -0.891 4.407 -2.448 1.00 0.00 H new ATOM 239 N GLU A 146 0.426 7.398 2.234 1.00 0.00 N ATOM 240 CA GLU A 146 0.760 8.745 1.803 1.00 0.00 C ATOM 241 C GLU A 146 2.275 8.895 1.658 1.00 0.00 C ATOM 242 O GLU A 146 2.768 9.977 1.341 1.00 0.00 O ATOM 243 CB GLU A 146 0.196 9.785 2.773 1.00 0.00 C ATOM 244 CG GLU A 146 -1.104 10.388 2.236 1.00 0.00 C ATOM 245 CD GLU A 146 -1.787 11.252 3.298 1.00 0.00 C ATOM 246 OE1 GLU A 146 -1.303 12.386 3.504 1.00 0.00 O ATOM 247 OE2 GLU A 146 -2.778 10.759 3.879 1.00 0.00 O ATOM 0 H GLU A 146 1.043 7.014 2.950 1.00 0.00 H new ATOM 0 HA GLU A 146 0.303 8.919 0.829 1.00 0.00 H new ATOM 0 HB2 GLU A 146 0.013 9.322 3.742 1.00 0.00 H new ATOM 0 HB3 GLU A 146 0.930 10.576 2.931 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -0.892 10.991 1.353 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -1.777 9.590 1.923 1.00 0.00 H new ATOM 252 N ASP A 147 2.972 7.794 1.896 1.00 0.00 N ATOM 253 CA ASP A 147 4.423 7.790 1.795 1.00 0.00 C ATOM 254 C ASP A 147 4.931 6.350 1.881 1.00 0.00 C ATOM 255 O ASP A 147 4.488 5.580 2.731 1.00 0.00 O ATOM 256 CB ASP A 147 5.056 8.585 2.939 1.00 0.00 C ATOM 257 CG ASP A 147 4.269 9.819 3.382 1.00 0.00 C ATOM 258 OD1 ASP A 147 3.409 9.653 4.274 1.00 0.00 O ATOM 259 OD2 ASP A 147 4.544 10.901 2.820 1.00 0.00 O ATOM 0 H ASP A 147 2.560 6.899 2.158 1.00 0.00 H new ATOM 0 HA ASP A 147 4.697 8.247 0.844 1.00 0.00 H new ATOM 0 HB2 ASP A 147 5.178 7.924 3.797 1.00 0.00 H new ATOM 0 HB3 ASP A 147 6.054 8.899 2.634 1.00 0.00 H new ATOM 263 N THR A 148 5.855 6.028 0.987 1.00 0.00 N ATOM 264 CA THR A 148 6.429 4.694 0.952 1.00 0.00 C ATOM 265 C THR A 148 6.384 4.056 2.341 1.00 0.00 C ATOM 266 O THR A 148 5.944 2.917 2.493 1.00 0.00 O ATOM 267 CB THR A 148 7.843 4.802 0.378 1.00 0.00 C ATOM 268 OG1 THR A 148 8.428 3.533 0.653 1.00 0.00 O ATOM 269 CG2 THR A 148 8.716 5.791 1.155 1.00 0.00 C ATOM 0 H THR A 148 6.220 6.668 0.282 1.00 0.00 H new ATOM 0 HA THR A 148 5.851 4.032 0.307 1.00 0.00 H new ATOM 0 HB THR A 148 7.788 5.109 -0.667 1.00 0.00 H new ATOM 0 HG1 THR A 148 9.347 3.516 0.312 1.00 0.00 H new ATOM 0 HG21 THR A 148 9.709 5.830 0.707 1.00 0.00 H new ATOM 0 HG22 THR A 148 8.263 6.782 1.120 1.00 0.00 H new ATOM 0 HG23 THR A 148 8.799 5.466 2.192 1.00 0.00 H new ATOM 277 N GLU A 149 6.846 4.818 3.322 1.00 0.00 N ATOM 278 CA GLU A 149 6.864 4.343 4.695 1.00 0.00 C ATOM 279 C GLU A 149 5.443 4.300 5.261 1.00 0.00 C ATOM 280 O GLU A 149 4.991 3.258 5.734 1.00 0.00 O ATOM 281 CB GLU A 149 7.774 5.212 5.565 1.00 0.00 C ATOM 282 CG GLU A 149 9.226 4.739 5.483 1.00 0.00 C ATOM 283 CD GLU A 149 10.117 5.535 6.439 1.00 0.00 C ATOM 284 OE1 GLU A 149 10.297 6.743 6.172 1.00 0.00 O ATOM 285 OE2 GLU A 149 10.598 4.919 7.414 1.00 0.00 O ATOM 0 H GLU A 149 7.211 5.762 3.193 1.00 0.00 H new ATOM 0 HA GLU A 149 7.268 3.331 4.702 1.00 0.00 H new ATOM 0 HB2 GLU A 149 7.708 6.251 5.242 1.00 0.00 H new ATOM 0 HB3 GLU A 149 7.435 5.177 6.600 1.00 0.00 H new ATOM 0 HG2 GLU A 149 9.281 3.678 5.727 1.00 0.00 H new ATOM 0 HG3 GLU A 149 9.591 4.850 4.462 1.00 0.00 H new ATOM 290 N LYS A 150 4.778 5.443 5.192 1.00 0.00 N ATOM 291 CA LYS A 150 3.418 5.549 5.691 1.00 0.00 C ATOM 292 C LYS A 150 2.476 4.781 4.761 1.00 0.00 C ATOM 293 O LYS A 150 1.811 5.377 3.915 1.00 0.00 O ATOM 294 CB LYS A 150 3.029 7.016 5.884 1.00 0.00 C ATOM 295 CG LYS A 150 3.525 7.542 7.232 1.00 0.00 C ATOM 296 CD LYS A 150 4.979 8.012 7.136 1.00 0.00 C ATOM 297 CE LYS A 150 5.808 7.468 8.301 1.00 0.00 C ATOM 298 NZ LYS A 150 5.459 8.167 9.557 1.00 0.00 N ATOM 0 H LYS A 150 5.156 6.305 4.798 1.00 0.00 H new ATOM 0 HA LYS A 150 3.339 5.090 6.677 1.00 0.00 H new ATOM 0 HB2 LYS A 150 3.450 7.617 5.078 1.00 0.00 H new ATOM 0 HB3 LYS A 150 1.945 7.119 5.826 1.00 0.00 H new ATOM 0 HG2 LYS A 150 2.893 8.368 7.559 1.00 0.00 H new ATOM 0 HG3 LYS A 150 3.441 6.759 7.985 1.00 0.00 H new ATOM 0 HD2 LYS A 150 5.411 7.681 6.192 1.00 0.00 H new ATOM 0 HD3 LYS A 150 5.014 9.101 7.137 1.00 0.00 H new ATOM 0 HE2 LYS A 150 5.631 6.398 8.412 1.00 0.00 H new ATOM 0 HE3 LYS A 150 6.870 7.595 8.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 6.031 7.785 10.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 5.650 9.184 9.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 4.450 8.024 9.765 1.00 0.00 H new ATOM 308 N GLU A 151 2.450 3.470 4.949 1.00 0.00 N ATOM 309 CA GLU A 151 1.601 2.614 4.137 1.00 0.00 C ATOM 310 C GLU A 151 0.671 1.789 5.029 1.00 0.00 C ATOM 311 O GLU A 151 1.129 1.090 5.932 1.00 0.00 O ATOM 312 CB GLU A 151 2.439 1.709 3.233 1.00 0.00 C ATOM 313 CG GLU A 151 1.936 1.757 1.789 1.00 0.00 C ATOM 314 CD GLU A 151 2.743 0.813 0.895 1.00 0.00 C ATOM 315 OE1 GLU A 151 2.836 -0.376 1.265 1.00 0.00 O ATOM 316 OE2 GLU A 151 3.247 1.304 -0.139 1.00 0.00 O ATOM 0 H GLU A 151 3.003 2.979 5.652 1.00 0.00 H new ATOM 0 HA GLU A 151 0.989 3.247 3.494 1.00 0.00 H new ATOM 0 HB2 GLU A 151 3.483 2.020 3.268 1.00 0.00 H new ATOM 0 HB3 GLU A 151 2.399 0.684 3.602 1.00 0.00 H new ATOM 0 HG2 GLU A 151 0.882 1.481 1.758 1.00 0.00 H new ATOM 0 HG3 GLU A 151 2.010 2.776 1.408 1.00 0.00 H new ATOM 321 N LYS A 152 -0.618 1.896 4.745 1.00 0.00 N ATOM 322 CA LYS A 152 -1.618 1.169 5.510 1.00 0.00 C ATOM 323 C LYS A 152 -2.283 0.127 4.609 1.00 0.00 C ATOM 324 O LYS A 152 -3.041 0.476 3.705 1.00 0.00 O ATOM 325 CB LYS A 152 -2.604 2.139 6.162 1.00 0.00 C ATOM 326 CG LYS A 152 -2.901 1.730 7.607 1.00 0.00 C ATOM 327 CD LYS A 152 -4.064 2.543 8.178 1.00 0.00 C ATOM 328 CE LYS A 152 -4.112 2.434 9.704 1.00 0.00 C ATOM 329 NZ LYS A 152 -3.790 3.737 10.327 1.00 0.00 N ATOM 0 H LYS A 152 -0.994 2.476 3.995 1.00 0.00 H new ATOM 0 HA LYS A 152 -1.150 0.628 6.332 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -2.193 3.148 6.143 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -3.531 2.161 5.589 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -3.141 0.668 7.646 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -2.013 1.879 8.221 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -3.959 3.588 7.888 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -5.003 2.187 7.755 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -5.103 2.108 10.020 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -3.404 1.677 10.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -3.827 3.645 11.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -2.835 4.033 10.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -4.481 4.450 10.018 1.00 0.00 H new ATOM 339 N ASP A 153 -1.978 -1.132 4.888 1.00 0.00 N ATOM 340 CA ASP A 153 -2.537 -2.227 4.115 1.00 0.00 C ATOM 341 C ASP A 153 -3.737 -2.813 4.863 1.00 0.00 C ATOM 342 O ASP A 153 -3.581 -3.384 5.941 1.00 0.00 O ATOM 343 CB ASP A 153 -1.510 -3.344 3.918 1.00 0.00 C ATOM 344 CG ASP A 153 -1.883 -4.684 4.556 1.00 0.00 C ATOM 345 OD1 ASP A 153 -3.020 -5.137 4.300 1.00 0.00 O ATOM 346 OD2 ASP A 153 -1.023 -5.225 5.284 1.00 0.00 O ATOM 0 H ASP A 153 -1.350 -1.418 5.639 1.00 0.00 H new ATOM 0 HA ASP A 153 -2.834 -1.836 3.142 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -1.361 -3.496 2.849 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -0.555 -3.016 4.329 1.00 0.00 H new ATOM 350 N LEU A 154 -4.905 -2.652 4.260 1.00 0.00 N ATOM 351 CA LEU A 154 -6.131 -3.158 4.856 1.00 0.00 C ATOM 352 C LEU A 154 -6.446 -4.536 4.269 1.00 0.00 C ATOM 353 O LEU A 154 -5.764 -4.996 3.356 1.00 0.00 O ATOM 354 CB LEU A 154 -7.265 -2.145 4.691 1.00 0.00 C ATOM 355 CG LEU A 154 -7.468 -1.588 3.281 1.00 0.00 C ATOM 356 CD1 LEU A 154 -6.574 -0.371 3.037 1.00 0.00 C ATOM 357 CD2 LEU A 154 -7.253 -2.676 2.227 1.00 0.00 C ATOM 0 H LEU A 154 -5.029 -2.179 3.365 1.00 0.00 H new ATOM 0 HA LEU A 154 -6.007 -3.289 5.931 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -8.195 -2.615 5.012 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -7.080 -1.310 5.367 1.00 0.00 H new ATOM 0 HG LEU A 154 -8.501 -1.251 3.193 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.739 0.005 2.027 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -6.817 0.409 3.759 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -5.529 -0.659 3.151 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -7.403 -2.254 1.233 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -6.238 -3.064 2.307 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -7.965 -3.485 2.389 1.00 0.00 H new ATOM 368 N ARG A 155 -7.481 -5.154 4.819 1.00 0.00 N ATOM 369 CA ARG A 155 -7.895 -6.469 4.362 1.00 0.00 C ATOM 370 C ARG A 155 -7.757 -6.571 2.841 1.00 0.00 C ATOM 371 O ARG A 155 -7.737 -5.556 2.147 1.00 0.00 O ATOM 372 CB ARG A 155 -9.345 -6.758 4.755 1.00 0.00 C ATOM 373 CG ARG A 155 -10.286 -5.683 4.206 1.00 0.00 C ATOM 374 CD ARG A 155 -10.987 -4.935 5.342 1.00 0.00 C ATOM 375 NE ARG A 155 -9.989 -4.466 6.329 1.00 0.00 N ATOM 376 CZ ARG A 155 -9.728 -5.089 7.487 1.00 0.00 C ATOM 377 NH1 ARG A 155 -10.389 -6.209 7.809 1.00 0.00 N ATOM 378 NH2 ARG A 155 -8.806 -4.591 8.322 1.00 0.00 N ATOM 0 H ARG A 155 -8.045 -4.768 5.577 1.00 0.00 H new ATOM 0 HA ARG A 155 -7.247 -7.204 4.840 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -9.641 -7.735 4.373 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -9.430 -6.801 5.841 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -9.722 -4.978 3.596 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -11.030 -6.143 3.556 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -11.542 -4.086 4.942 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -11.711 -5.589 5.827 1.00 0.00 H new ATOM 0 HE ARG A 155 -9.467 -3.616 6.115 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -11.091 -6.588 7.173 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -10.190 -6.683 8.690 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -8.303 -3.738 8.076 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -8.607 -5.065 9.203 1.00 0.00 H new ATOM 389 N ASP A 156 -7.664 -7.806 2.369 1.00 0.00 N ATOM 390 CA ASP A 156 -7.527 -8.053 0.944 1.00 0.00 C ATOM 391 C ASP A 156 -6.101 -7.714 0.506 1.00 0.00 C ATOM 392 O ASP A 156 -5.770 -7.814 -0.674 1.00 0.00 O ATOM 393 CB ASP A 156 -8.489 -7.178 0.138 1.00 0.00 C ATOM 394 CG ASP A 156 -8.791 -7.679 -1.275 1.00 0.00 C ATOM 395 OD1 ASP A 156 -9.412 -8.760 -1.373 1.00 0.00 O ATOM 396 OD2 ASP A 156 -8.393 -6.972 -2.225 1.00 0.00 O ATOM 0 H ASP A 156 -7.681 -8.646 2.948 1.00 0.00 H new ATOM 0 HA ASP A 156 -7.755 -9.103 0.761 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -9.428 -7.096 0.686 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -8.071 -6.174 0.069 1.00 0.00 H new ATOM 400 N VAL A 157 -5.295 -7.320 1.481 1.00 0.00 N ATOM 401 CA VAL A 157 -3.912 -6.966 1.211 1.00 0.00 C ATOM 402 C VAL A 157 -3.434 -7.710 -0.038 1.00 0.00 C ATOM 403 O VAL A 157 -2.962 -7.091 -0.990 1.00 0.00 O ATOM 404 CB VAL A 157 -3.049 -7.250 2.443 1.00 0.00 C ATOM 405 CG1 VAL A 157 -3.920 -7.524 3.670 1.00 0.00 C ATOM 406 CG2 VAL A 157 -2.086 -8.410 2.182 1.00 0.00 C ATOM 0 H VAL A 157 -5.573 -7.238 2.459 1.00 0.00 H new ATOM 0 HA VAL A 157 -3.824 -5.899 1.008 1.00 0.00 H new ATOM 0 HB VAL A 157 -2.453 -6.361 2.648 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -3.283 -7.723 4.532 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -4.545 -6.655 3.874 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -4.554 -8.390 3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -1.485 -8.591 3.073 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -2.655 -9.308 1.939 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -1.431 -8.159 1.347 1.00 0.00 H new ATOM 416 N GLY A 158 -3.572 -9.027 0.008 1.00 0.00 N ATOM 417 CA GLY A 158 -3.161 -9.861 -1.108 1.00 0.00 C ATOM 418 C GLY A 158 -1.843 -9.365 -1.707 1.00 0.00 C ATOM 419 O GLY A 158 -0.985 -8.851 -0.991 1.00 0.00 O ATOM 0 H GLY A 158 -3.963 -9.537 0.801 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -3.047 -10.892 -0.773 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -3.937 -9.858 -1.874 1.00 0.00 H new ATOM 423 N ASP A 159 -1.723 -9.535 -3.016 1.00 0.00 N ATOM 424 CA ASP A 159 -0.525 -9.111 -3.720 1.00 0.00 C ATOM 425 C ASP A 159 -0.391 -7.590 -3.618 1.00 0.00 C ATOM 426 O ASP A 159 0.717 -7.068 -3.507 1.00 0.00 O ATOM 427 CB ASP A 159 -0.598 -9.481 -5.203 1.00 0.00 C ATOM 428 CG ASP A 159 -0.469 -10.976 -5.503 1.00 0.00 C ATOM 429 OD1 ASP A 159 0.686 -11.424 -5.672 1.00 0.00 O ATOM 430 OD2 ASP A 159 -1.528 -11.637 -5.557 1.00 0.00 O ATOM 0 H ASP A 159 -2.437 -9.961 -3.607 1.00 0.00 H new ATOM 0 HA ASP A 159 0.329 -9.612 -3.265 1.00 0.00 H new ATOM 0 HB2 ASP A 159 -1.547 -9.126 -5.604 1.00 0.00 H new ATOM 0 HB3 ASP A 159 0.192 -8.950 -5.734 1.00 0.00 H new ATOM 434 N TRP A 160 -1.535 -6.923 -3.659 1.00 0.00 N ATOM 435 CA TRP A 160 -1.559 -5.473 -3.574 1.00 0.00 C ATOM 436 C TRP A 160 -0.564 -5.047 -2.492 1.00 0.00 C ATOM 437 O TRP A 160 0.397 -4.333 -2.774 1.00 0.00 O ATOM 438 CB TRP A 160 -2.978 -4.963 -3.315 1.00 0.00 C ATOM 439 CG TRP A 160 -3.136 -4.208 -1.994 1.00 0.00 C ATOM 440 CD1 TRP A 160 -3.839 -4.574 -0.913 1.00 0.00 C ATOM 441 CD2 TRP A 160 -2.546 -2.935 -1.654 1.00 0.00 C ATOM 442 NE1 TRP A 160 -3.746 -3.634 0.093 1.00 0.00 N ATOM 443 CE2 TRP A 160 -2.936 -2.605 -0.372 1.00 0.00 C ATOM 444 CE3 TRP A 160 -1.712 -2.089 -2.407 1.00 0.00 C ATOM 445 CZ2 TRP A 160 -2.539 -1.426 0.270 1.00 0.00 C ATOM 446 CZ3 TRP A 160 -1.324 -0.915 -1.751 1.00 0.00 C ATOM 447 CH2 TRP A 160 -1.707 -0.569 -0.459 1.00 0.00 C ATOM 0 H TRP A 160 -2.452 -7.360 -3.750 1.00 0.00 H new ATOM 0 HA TRP A 160 -1.257 -5.026 -4.521 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -3.272 -4.307 -4.134 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -3.664 -5.810 -3.322 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -4.407 -5.490 -0.839 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -4.190 -3.685 1.010 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -1.396 -2.327 -3.412 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -2.858 -1.190 1.275 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -0.682 -0.230 -2.285 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -1.364 0.357 -0.021 1.00 0.00 H new ATOM 457 N ARG A 161 -0.828 -5.504 -1.276 1.00 0.00 N ATOM 458 CA ARG A 161 0.032 -5.179 -0.152 1.00 0.00 C ATOM 459 C ARG A 161 1.413 -5.810 -0.340 1.00 0.00 C ATOM 460 O ARG A 161 2.398 -5.105 -0.556 1.00 0.00 O ATOM 461 CB ARG A 161 -0.571 -5.673 1.164 1.00 0.00 C ATOM 462 CG ARG A 161 0.421 -5.511 2.318 1.00 0.00 C ATOM 463 CD ARG A 161 1.111 -6.839 2.636 1.00 0.00 C ATOM 464 NE ARG A 161 0.756 -7.279 4.004 1.00 0.00 N ATOM 465 CZ ARG A 161 1.211 -8.404 4.573 1.00 0.00 C ATOM 466 NH1 ARG A 161 2.043 -9.208 3.896 1.00 0.00 N ATOM 467 NH2 ARG A 161 0.835 -8.724 5.818 1.00 0.00 N ATOM 0 H ARG A 161 -1.626 -6.097 -1.046 1.00 0.00 H new ATOM 0 HA ARG A 161 0.127 -4.094 -0.111 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -1.482 -5.116 1.382 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -0.854 -6.721 1.068 1.00 0.00 H new ATOM 0 HG2 ARG A 161 1.168 -4.762 2.058 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -0.101 -5.147 3.203 1.00 0.00 H new ATOM 0 HD2 ARG A 161 0.811 -7.597 1.912 1.00 0.00 H new ATOM 0 HD3 ARG A 161 2.192 -6.726 2.550 1.00 0.00 H new ATOM 0 HE ARG A 161 0.126 -6.689 4.548 1.00 0.00 H new ATOM 0 HH11 ARG A 161 2.330 -8.964 2.948 1.00 0.00 H new ATOM 0 HH12 ARG A 161 2.389 -10.064 4.329 1.00 0.00 H new ATOM 0 HH21 ARG A 161 0.202 -8.112 6.333 1.00 0.00 H new ATOM 0 HH22 ARG A 161 1.181 -9.580 6.251 1.00 0.00 H new ATOM 478 N LYS A 162 1.442 -7.132 -0.251 1.00 0.00 N ATOM 479 CA LYS A 162 2.685 -7.866 -0.409 1.00 0.00 C ATOM 480 C LYS A 162 3.629 -7.073 -1.315 1.00 0.00 C ATOM 481 O LYS A 162 4.817 -6.951 -1.023 1.00 0.00 O ATOM 482 CB LYS A 162 2.409 -9.288 -0.902 1.00 0.00 C ATOM 483 CG LYS A 162 3.457 -9.727 -1.927 1.00 0.00 C ATOM 484 CD LYS A 162 4.796 -10.024 -1.249 1.00 0.00 C ATOM 485 CE LYS A 162 5.684 -10.891 -2.145 1.00 0.00 C ATOM 486 NZ LYS A 162 6.909 -11.297 -1.422 1.00 0.00 N ATOM 0 H LYS A 162 0.624 -7.714 -0.071 1.00 0.00 H new ATOM 0 HA LYS A 162 3.186 -7.979 0.553 1.00 0.00 H new ATOM 0 HB2 LYS A 162 2.411 -9.976 -0.057 1.00 0.00 H new ATOM 0 HB3 LYS A 162 1.416 -9.335 -1.349 1.00 0.00 H new ATOM 0 HG2 LYS A 162 3.107 -10.615 -2.453 1.00 0.00 H new ATOM 0 HG3 LYS A 162 3.589 -8.945 -2.675 1.00 0.00 H new ATOM 0 HD2 LYS A 162 5.307 -9.089 -1.020 1.00 0.00 H new ATOM 0 HD3 LYS A 162 4.623 -10.533 -0.301 1.00 0.00 H new ATOM 0 HE2 LYS A 162 5.134 -11.776 -2.466 1.00 0.00 H new ATOM 0 HE3 LYS A 162 5.952 -10.338 -3.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 7.675 -11.466 -2.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 7.191 -10.542 -0.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 6.723 -12.169 -0.887 1.00 0.00 H new ATOM 496 N ASN A 163 3.064 -6.557 -2.397 1.00 0.00 N ATOM 497 CA ASN A 163 3.841 -5.778 -3.347 1.00 0.00 C ATOM 498 C ASN A 163 4.348 -4.506 -2.665 1.00 0.00 C ATOM 499 O ASN A 163 5.513 -4.426 -2.278 1.00 0.00 O ATOM 500 CB ASN A 163 2.988 -5.364 -4.547 1.00 0.00 C ATOM 501 CG ASN A 163 2.937 -6.479 -5.594 1.00 0.00 C ATOM 502 OD1 ASN A 163 3.663 -7.456 -5.534 1.00 0.00 O ATOM 503 ND2 ASN A 163 2.040 -6.277 -6.555 1.00 0.00 N ATOM 0 H ASN A 163 2.078 -6.663 -2.637 1.00 0.00 H new ATOM 0 HA ASN A 163 4.671 -6.396 -3.690 1.00 0.00 H new ATOM 0 HB2 ASN A 163 1.978 -5.126 -4.215 1.00 0.00 H new ATOM 0 HB3 ASN A 163 3.398 -4.459 -4.994 1.00 0.00 H new ATOM 0 HD21 ASN A 163 1.929 -6.963 -7.301 1.00 0.00 H new ATOM 0 HD22 ASN A 163 1.463 -5.436 -6.546 1.00 0.00 H new ATOM 509 N ILE A 164 3.447 -3.542 -2.538 1.00 0.00 N ATOM 510 CA ILE A 164 3.788 -2.278 -1.910 1.00 0.00 C ATOM 511 C ILE A 164 4.536 -2.547 -0.603 1.00 0.00 C ATOM 512 O ILE A 164 5.631 -2.028 -0.391 1.00 0.00 O ATOM 513 CB ILE A 164 2.539 -1.411 -1.735 1.00 0.00 C ATOM 514 CG1 ILE A 164 1.347 -2.254 -1.275 1.00 0.00 C ATOM 515 CG2 ILE A 164 2.229 -0.633 -3.014 1.00 0.00 C ATOM 516 CD1 ILE A 164 0.806 -1.752 0.066 1.00 0.00 C ATOM 0 H ILE A 164 2.482 -3.612 -2.860 1.00 0.00 H new ATOM 0 HA ILE A 164 4.459 -1.705 -2.550 1.00 0.00 H new ATOM 0 HB ILE A 164 2.738 -0.679 -0.952 1.00 0.00 H new ATOM 0 HG12 ILE A 164 0.558 -2.216 -2.027 1.00 0.00 H new ATOM 0 HG13 ILE A 164 1.649 -3.297 -1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 164 1.337 -0.025 -2.863 1.00 0.00 H new ATOM 0 HG22 ILE A 164 3.071 0.013 -3.260 1.00 0.00 H new ATOM 0 HG23 ILE A 164 2.057 -1.332 -3.832 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -0.040 -2.368 0.370 1.00 0.00 H new ATOM 0 HD12 ILE A 164 1.590 -1.814 0.821 1.00 0.00 H new ATOM 0 HD13 ILE A 164 0.483 -0.716 -0.037 1.00 0.00 H new ATOM 527 N GLU A 165 3.916 -3.361 0.240 1.00 0.00 N ATOM 528 CA GLU A 165 4.511 -3.706 1.520 1.00 0.00 C ATOM 529 C GLU A 165 6.009 -3.969 1.357 1.00 0.00 C ATOM 530 O GLU A 165 6.823 -3.422 2.100 1.00 0.00 O ATOM 531 CB GLU A 165 3.807 -4.914 2.142 1.00 0.00 C ATOM 532 CG GLU A 165 3.282 -4.583 3.541 1.00 0.00 C ATOM 533 CD GLU A 165 4.279 -5.015 4.618 1.00 0.00 C ATOM 534 OE1 GLU A 165 4.412 -6.244 4.807 1.00 0.00 O ATOM 535 OE2 GLU A 165 4.885 -4.107 5.227 1.00 0.00 O ATOM 0 H GLU A 165 3.008 -3.791 0.061 1.00 0.00 H new ATOM 0 HA GLU A 165 4.383 -2.862 2.198 1.00 0.00 H new ATOM 0 HB2 GLU A 165 2.980 -5.226 1.504 1.00 0.00 H new ATOM 0 HB3 GLU A 165 4.500 -5.754 2.199 1.00 0.00 H new ATOM 0 HG2 GLU A 165 3.098 -3.512 3.620 1.00 0.00 H new ATOM 0 HG3 GLU A 165 2.327 -5.083 3.703 1.00 0.00 H new ATOM 540 N GLU A 166 6.328 -4.805 0.379 1.00 0.00 N ATOM 541 CA GLU A 166 7.714 -5.146 0.109 1.00 0.00 C ATOM 542 C GLU A 166 8.470 -3.922 -0.413 1.00 0.00 C ATOM 543 O GLU A 166 9.278 -3.335 0.304 1.00 0.00 O ATOM 544 CB GLU A 166 7.810 -6.312 -0.877 1.00 0.00 C ATOM 545 CG GLU A 166 7.932 -7.646 -0.138 1.00 0.00 C ATOM 546 CD GLU A 166 9.273 -7.746 0.593 1.00 0.00 C ATOM 547 OE1 GLU A 166 10.299 -7.844 -0.113 1.00 0.00 O ATOM 548 OE2 GLU A 166 9.240 -7.723 1.843 1.00 0.00 O ATOM 0 H GLU A 166 5.650 -5.256 -0.236 1.00 0.00 H new ATOM 0 HA GLU A 166 8.178 -5.464 1.043 1.00 0.00 H new ATOM 0 HB2 GLU A 166 6.927 -6.326 -1.516 1.00 0.00 H new ATOM 0 HB3 GLU A 166 8.673 -6.172 -1.528 1.00 0.00 H new ATOM 0 HG2 GLU A 166 7.115 -7.746 0.577 1.00 0.00 H new ATOM 0 HG3 GLU A 166 7.838 -8.469 -0.847 1.00 0.00 H new ATOM 553 N LYS A 167 8.179 -3.574 -1.658 1.00 0.00 N ATOM 554 CA LYS A 167 8.822 -2.431 -2.284 1.00 0.00 C ATOM 555 C LYS A 167 8.739 -1.227 -1.345 1.00 0.00 C ATOM 556 O LYS A 167 9.656 -0.979 -0.564 1.00 0.00 O ATOM 557 CB LYS A 167 8.224 -2.174 -3.669 1.00 0.00 C ATOM 558 CG LYS A 167 6.717 -2.440 -3.673 1.00 0.00 C ATOM 559 CD LYS A 167 5.974 -1.374 -4.481 1.00 0.00 C ATOM 560 CE LYS A 167 6.589 -1.213 -5.873 1.00 0.00 C ATOM 561 NZ LYS A 167 5.755 -0.318 -6.707 1.00 0.00 N ATOM 0 H LYS A 167 7.507 -4.063 -2.250 1.00 0.00 H new ATOM 0 HA LYS A 167 9.880 -2.632 -2.451 1.00 0.00 H new ATOM 0 HB2 LYS A 167 8.416 -1.143 -3.966 1.00 0.00 H new ATOM 0 HB3 LYS A 167 8.712 -2.814 -4.404 1.00 0.00 H new ATOM 0 HG2 LYS A 167 6.519 -3.425 -4.095 1.00 0.00 H new ATOM 0 HG3 LYS A 167 6.343 -2.451 -2.649 1.00 0.00 H new ATOM 0 HD2 LYS A 167 4.923 -1.649 -4.573 1.00 0.00 H new ATOM 0 HD3 LYS A 167 6.009 -0.422 -3.952 1.00 0.00 H new ATOM 0 HE2 LYS A 167 7.596 -0.806 -5.787 1.00 0.00 H new ATOM 0 HE3 LYS A 167 6.679 -2.188 -6.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 6.186 -0.219 -7.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 4.802 -0.722 -6.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 5.691 0.617 -6.256 1.00 0.00 H new ATOM 571 N SER A 168 7.629 -0.509 -1.450 1.00 0.00 N ATOM 572 CA SER A 168 7.415 0.664 -0.620 1.00 0.00 C ATOM 573 C SER A 168 7.301 0.251 0.848 1.00 0.00 C ATOM 574 O SER A 168 6.207 0.245 1.412 1.00 0.00 O ATOM 575 CB SER A 168 6.162 1.426 -1.056 1.00 0.00 C ATOM 576 OG SER A 168 6.324 2.034 -2.334 1.00 0.00 O ATOM 0 H SER A 168 6.869 -0.718 -2.097 1.00 0.00 H new ATOM 0 HA SER A 168 8.271 1.329 -0.739 1.00 0.00 H new ATOM 0 HB2 SER A 168 5.314 0.742 -1.085 1.00 0.00 H new ATOM 0 HB3 SER A 168 5.928 2.192 -0.317 1.00 0.00 H new ATOM 0 HG SER A 168 5.502 2.509 -2.577 1.00 0.00 H new ATOM 581 N GLY A 169 8.445 -0.083 1.427 1.00 0.00 N ATOM 582 CA GLY A 169 8.488 -0.497 2.819 1.00 0.00 C ATOM 583 C GLY A 169 9.883 -0.996 3.200 1.00 0.00 C ATOM 584 O GLY A 169 10.554 -0.395 4.038 1.00 0.00 O ATOM 0 H GLY A 169 9.350 -0.075 0.957 1.00 0.00 H new ATOM 0 HA2 GLY A 169 8.210 0.340 3.460 1.00 0.00 H new ATOM 0 HA3 GLY A 169 7.756 -1.287 2.990 1.00 0.00 H new