USER MOD reduce.3.24.130724 H: found=0, std=0, add=618, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 619 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 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 ASN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 GLN : amide:sc= -0.0323 X(o=-0.032,f=-0.48) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0 USER MOD Single : A 173 CYS SG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot -88:sc= 1.54 USER MOD Single : A 180 SER OG : rot 82:sc= 0.436 USER MOD Single : A 182 LYS NZ :NH3+ -151:sc= -2.03! (180deg=-3.78!) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 MET CE :methyl -159:sc= -0.113 (180deg=-0.721) USER MOD Single : A 187 MET CE :methyl -168:sc= -0.0138 (180deg=-0.231) USER MOD Single : A 194 CYS SG : rot -17:sc= -2.03! USER MOD Single : A 195 CYS SG : rot 80:sc= -0.744 USER MOD Single : A 198 TYR OH : rot 130:sc= 0 USER MOD Single : A 201 GLN : amide:sc= 1.03 K(o=1,f=-5.1!) USER MOD Single : A 205 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0482) USER MOD Single : A 206 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 THR OG1 : rot 87:sc= 0.701 USER MOD Single : A 215 SER OG : rot 180:sc= 0 USER MOD Single : A 218 THR OG1 : rot 89:sc= 0.757 USER MOD Single : A 223 HIS : no HD1:sc= 0 X(o=0,f=-0.03) USER MOD ----------------------------------------------------------------- ATOM 114 N LYS A 154 7.279 15.360 -6.987 1.00 74.41 N ATOM 115 CA LYS A 154 7.631 13.936 -7.008 1.00 22.25 C ATOM 116 C LYS A 154 6.433 13.074 -7.446 1.00 34.55 C ATOM 117 O LYS A 154 5.279 13.468 -7.263 1.00 73.41 O ATOM 118 CB LYS A 154 8.095 13.501 -5.606 1.00 10.41 C ATOM 119 CG LYS A 154 9.359 14.207 -5.116 1.00 42.44 C ATOM 120 CD LYS A 154 10.594 13.794 -5.917 1.00 40.33 C ATOM 121 CE LYS A 154 10.910 12.308 -5.749 1.00 24.23 C ATOM 122 NZ LYS A 154 12.112 11.896 -6.520 1.00 73.32 N ATOM 0 HA LYS A 154 8.437 13.792 -7.728 1.00 22.25 H new ATOM 0 HB2 LYS A 154 7.290 13.687 -4.895 1.00 10.41 H new ATOM 0 HB3 LYS A 154 8.272 12.426 -5.612 1.00 10.41 H new ATOM 0 HG2 LYS A 154 9.223 15.286 -5.190 1.00 42.44 H new ATOM 0 HG3 LYS A 154 9.517 13.977 -4.062 1.00 42.44 H new ATOM 0 HD2 LYS A 154 10.433 14.014 -6.972 1.00 40.33 H new ATOM 0 HD3 LYS A 154 11.451 14.386 -5.595 1.00 40.33 H new ATOM 0 HE2 LYS A 154 11.066 12.089 -4.693 1.00 24.23 H new ATOM 0 HE3 LYS A 154 10.053 11.718 -6.073 1.00 24.23 H new ATOM 0 HZ1 LYS A 154 12.286 10.881 -6.375 1.00 73.32 H new ATOM 0 HZ2 LYS A 154 11.955 12.079 -7.532 1.00 73.32 H new ATOM 0 HZ3 LYS A 154 12.937 12.439 -6.194 1.00 73.32 H new ATOM 136 N PRO A 155 6.687 11.890 -8.042 1.00 14.35 N ATOM 137 CA PRO A 155 5.621 10.923 -8.356 1.00 15.43 C ATOM 138 C PRO A 155 5.093 10.235 -7.087 1.00 53.13 C ATOM 139 O PRO A 155 5.874 9.821 -6.229 1.00 31.04 O ATOM 140 CB PRO A 155 6.320 9.915 -9.277 1.00 60.22 C ATOM 141 CG PRO A 155 7.757 9.976 -8.877 1.00 15.45 C ATOM 142 CD PRO A 155 8.018 11.402 -8.460 1.00 74.14 C ATOM 0 HA PRO A 155 4.749 11.391 -8.813 1.00 15.43 H new ATOM 0 HB2 PRO A 155 5.914 8.912 -9.147 1.00 60.22 H new ATOM 0 HB3 PRO A 155 6.189 10.179 -10.326 1.00 60.22 H new ATOM 0 HG2 PRO A 155 7.962 9.287 -8.058 1.00 15.45 H new ATOM 0 HG3 PRO A 155 8.404 9.688 -9.705 1.00 15.45 H new ATOM 0 HD2 PRO A 155 8.739 11.456 -7.644 1.00 74.14 H new ATOM 0 HD3 PRO A 155 8.422 11.993 -9.282 1.00 74.14 H new ATOM 150 N ILE A 156 3.772 10.109 -6.964 1.00 71.40 N ATOM 151 CA ILE A 156 3.167 9.585 -5.731 1.00 12.14 C ATOM 152 C ILE A 156 2.217 8.398 -5.980 1.00 2.21 C ATOM 153 O ILE A 156 1.783 8.149 -7.108 1.00 72.32 O ATOM 154 CB ILE A 156 2.422 10.711 -4.953 1.00 53.25 C ATOM 155 CG1 ILE A 156 1.414 11.466 -5.853 1.00 21.15 C ATOM 156 CG2 ILE A 156 3.424 11.689 -4.334 1.00 14.31 C ATOM 157 CD1 ILE A 156 0.063 10.787 -6.002 1.00 24.03 C ATOM 0 H ILE A 156 3.103 10.358 -7.692 1.00 71.40 H new ATOM 0 HA ILE A 156 3.993 9.212 -5.125 1.00 12.14 H new ATOM 0 HB ILE A 156 1.854 10.234 -4.155 1.00 53.25 H new ATOM 0 HG12 ILE A 156 1.260 12.465 -5.444 1.00 21.15 H new ATOM 0 HG13 ILE A 156 1.854 11.591 -6.843 1.00 21.15 H new ATOM 0 HG21 ILE A 156 2.886 12.469 -3.795 1.00 14.31 H new ATOM 0 HG22 ILE A 156 4.076 11.154 -3.643 1.00 14.31 H new ATOM 0 HG23 ILE A 156 4.025 12.142 -5.123 1.00 14.31 H new ATOM 0 HD11 ILE A 156 -0.577 11.387 -6.649 1.00 24.03 H new ATOM 0 HD12 ILE A 156 0.199 9.799 -6.442 1.00 24.03 H new ATOM 0 HD13 ILE A 156 -0.404 10.687 -5.022 1.00 24.03 H new ATOM 169 N VAL A 157 1.911 7.663 -4.909 1.00 51.13 N ATOM 170 CA VAL A 157 0.987 6.522 -4.968 1.00 70.32 C ATOM 171 C VAL A 157 -0.186 6.714 -3.991 1.00 24.31 C ATOM 172 O VAL A 157 0.011 7.142 -2.852 1.00 50.24 O ATOM 173 CB VAL A 157 1.713 5.193 -4.629 1.00 2.42 C ATOM 174 CG1 VAL A 157 0.765 4.000 -4.756 1.00 4.25 C ATOM 175 CG2 VAL A 157 2.941 5.009 -5.518 1.00 45.32 C ATOM 0 H VAL A 157 2.293 7.838 -3.980 1.00 51.13 H new ATOM 0 HA VAL A 157 0.606 6.471 -5.988 1.00 70.32 H new ATOM 0 HB VAL A 157 2.046 5.245 -3.592 1.00 2.42 H new ATOM 0 HG11 VAL A 157 1.300 3.082 -4.513 1.00 4.25 H new ATOM 0 HG12 VAL A 157 -0.072 4.125 -4.068 1.00 4.25 H new ATOM 0 HG13 VAL A 157 0.389 3.941 -5.778 1.00 4.25 H new ATOM 0 HG21 VAL A 157 3.436 4.072 -5.265 1.00 45.32 H new ATOM 0 HG22 VAL A 157 2.633 4.986 -6.563 1.00 45.32 H new ATOM 0 HG23 VAL A 157 3.631 5.838 -5.361 1.00 45.32 H new ATOM 185 N ARG A 158 -1.400 6.392 -4.438 1.00 15.24 N ATOM 186 CA ARG A 158 -2.606 6.557 -3.611 1.00 32.22 C ATOM 187 C ARG A 158 -2.994 5.240 -2.920 1.00 4.42 C ATOM 188 O ARG A 158 -3.580 4.355 -3.540 1.00 12.33 O ATOM 189 CB ARG A 158 -3.773 7.055 -4.477 1.00 15.11 C ATOM 190 CG ARG A 158 -3.497 8.382 -5.175 1.00 74.02 C ATOM 191 CD ARG A 158 -4.605 8.745 -6.159 1.00 74.12 C ATOM 192 NE ARG A 158 -4.349 10.023 -6.815 1.00 52.21 N ATOM 193 CZ ARG A 158 -3.879 10.152 -8.025 1.00 0.43 C ATOM 194 NH1 ARG A 158 -3.609 9.110 -8.750 1.00 61.11 N ATOM 195 NH2 ARG A 158 -3.684 11.331 -8.512 1.00 54.34 N ATOM 0 H ARG A 158 -1.579 6.015 -5.369 1.00 15.24 H new ATOM 0 HA ARG A 158 -2.386 7.294 -2.838 1.00 32.22 H new ATOM 0 HB2 ARG A 158 -4.003 6.300 -5.229 1.00 15.11 H new ATOM 0 HB3 ARG A 158 -4.659 7.162 -3.851 1.00 15.11 H new ATOM 0 HG2 ARG A 158 -3.400 9.171 -4.430 1.00 74.02 H new ATOM 0 HG3 ARG A 158 -2.546 8.324 -5.704 1.00 74.02 H new ATOM 0 HD2 ARG A 158 -4.694 7.961 -6.911 1.00 74.12 H new ATOM 0 HD3 ARG A 158 -5.558 8.791 -5.632 1.00 74.12 H new ATOM 0 HE ARG A 158 -4.552 10.874 -6.291 1.00 52.21 H new ATOM 0 HH11 ARG A 158 -3.764 8.174 -8.375 1.00 61.11 H new ATOM 0 HH12 ARG A 158 -3.242 9.227 -9.694 1.00 61.11 H new ATOM 0 HH21 ARG A 158 -3.897 12.156 -7.951 1.00 54.34 H new ATOM 0 HH22 ARG A 158 -3.317 11.438 -9.458 1.00 54.34 H new ATOM 209 N VAL A 159 -2.666 5.113 -1.639 1.00 22.25 N ATOM 210 CA VAL A 159 -2.954 3.888 -0.884 1.00 53.30 C ATOM 211 C VAL A 159 -4.188 4.054 0.023 1.00 64.21 C ATOM 212 O VAL A 159 -4.261 4.982 0.831 1.00 4.03 O ATOM 213 CB VAL A 159 -1.738 3.469 -0.021 1.00 65.32 C ATOM 214 CG1 VAL A 159 -2.033 2.179 0.741 1.00 60.14 C ATOM 215 CG2 VAL A 159 -0.491 3.315 -0.893 1.00 3.13 C ATOM 0 H VAL A 159 -2.200 5.841 -1.097 1.00 22.25 H new ATOM 0 HA VAL A 159 -3.163 3.108 -1.617 1.00 53.30 H new ATOM 0 HB VAL A 159 -1.548 4.255 0.710 1.00 65.32 H new ATOM 0 HG11 VAL A 159 -1.165 1.904 1.340 1.00 60.14 H new ATOM 0 HG12 VAL A 159 -2.892 2.331 1.395 1.00 60.14 H new ATOM 0 HG13 VAL A 159 -2.253 1.380 0.033 1.00 60.14 H new ATOM 0 HG21 VAL A 159 0.354 3.020 -0.271 1.00 3.13 H new ATOM 0 HG22 VAL A 159 -0.668 2.551 -1.650 1.00 3.13 H new ATOM 0 HG23 VAL A 159 -0.269 4.264 -1.381 1.00 3.13 H new ATOM 225 N PHE A 160 -5.157 3.152 -0.126 1.00 0.32 N ATOM 226 CA PHE A 160 -6.363 3.150 0.712 1.00 74.12 C ATOM 227 C PHE A 160 -6.177 2.261 1.949 1.00 64.43 C ATOM 228 O PHE A 160 -6.179 1.033 1.849 1.00 63.34 O ATOM 229 CB PHE A 160 -7.577 2.662 -0.093 1.00 70.21 C ATOM 230 CG PHE A 160 -8.023 3.612 -1.179 1.00 4.04 C ATOM 231 CD1 PHE A 160 -7.186 3.919 -2.243 1.00 72.25 C ATOM 232 CD2 PHE A 160 -9.284 4.189 -1.141 1.00 50.44 C ATOM 233 CE1 PHE A 160 -7.597 4.781 -3.240 1.00 61.20 C ATOM 234 CE2 PHE A 160 -9.697 5.052 -2.137 1.00 64.25 C ATOM 235 CZ PHE A 160 -8.853 5.347 -3.187 1.00 5.32 C ATOM 0 H PHE A 160 -5.133 2.407 -0.823 1.00 0.32 H new ATOM 0 HA PHE A 160 -6.537 4.174 1.042 1.00 74.12 H new ATOM 0 HB2 PHE A 160 -7.336 1.699 -0.544 1.00 70.21 H new ATOM 0 HB3 PHE A 160 -8.409 2.494 0.591 1.00 70.21 H new ATOM 0 HD1 PHE A 160 -6.201 3.478 -2.291 1.00 72.25 H new ATOM 0 HD2 PHE A 160 -9.951 3.961 -0.323 1.00 50.44 H new ATOM 0 HE1 PHE A 160 -6.935 5.012 -4.061 1.00 61.20 H new ATOM 0 HE2 PHE A 160 -10.681 5.496 -2.094 1.00 64.25 H new ATOM 0 HZ PHE A 160 -9.176 6.021 -3.967 1.00 5.32 H new ATOM 245 N LEU A 161 -6.014 2.890 3.106 1.00 20.23 N ATOM 246 CA LEU A 161 -5.872 2.172 4.375 1.00 40.53 C ATOM 247 C LEU A 161 -7.242 1.720 4.916 1.00 73.14 C ATOM 248 O LEU A 161 -8.269 2.344 4.627 1.00 73.12 O ATOM 249 CB LEU A 161 -5.164 3.065 5.408 1.00 4.50 C ATOM 250 CG LEU A 161 -3.723 3.464 5.057 1.00 45.40 C ATOM 251 CD1 LEU A 161 -3.177 4.458 6.080 1.00 2.34 C ATOM 252 CD2 LEU A 161 -2.828 2.228 4.971 1.00 51.32 C ATOM 0 H LEU A 161 -5.976 3.905 3.196 1.00 20.23 H new ATOM 0 HA LEU A 161 -5.270 1.281 4.196 1.00 40.53 H new ATOM 0 HB2 LEU A 161 -5.752 3.973 5.542 1.00 4.50 H new ATOM 0 HB3 LEU A 161 -5.156 2.546 6.367 1.00 4.50 H new ATOM 0 HG LEU A 161 -3.729 3.948 4.081 1.00 45.40 H new ATOM 0 HD11 LEU A 161 -2.155 4.729 5.815 1.00 2.34 H new ATOM 0 HD12 LEU A 161 -3.800 5.353 6.086 1.00 2.34 H new ATOM 0 HD13 LEU A 161 -3.186 4.003 7.070 1.00 2.34 H new ATOM 0 HD21 LEU A 161 -1.811 2.532 4.721 1.00 51.32 H new ATOM 0 HD22 LEU A 161 -2.827 1.712 5.931 1.00 51.32 H new ATOM 0 HD23 LEU A 161 -3.206 1.558 4.199 1.00 51.32 H new ATOM 264 N PRO A 162 -7.274 0.632 5.715 1.00 13.43 N ATOM 265 CA PRO A 162 -8.527 0.075 6.261 1.00 42.05 C ATOM 266 C PRO A 162 -9.433 1.121 6.937 1.00 20.12 C ATOM 267 O PRO A 162 -8.952 2.020 7.639 1.00 4.24 O ATOM 268 CB PRO A 162 -8.034 -0.951 7.288 1.00 34.32 C ATOM 269 CG PRO A 162 -6.699 -1.375 6.776 1.00 55.24 C ATOM 270 CD PRO A 162 -6.095 -0.152 6.137 1.00 1.22 C ATOM 0 HA PRO A 162 -9.151 -0.340 5.469 1.00 42.05 H new ATOM 0 HB2 PRO A 162 -7.957 -0.512 8.283 1.00 34.32 H new ATOM 0 HB3 PRO A 162 -8.717 -1.797 7.365 1.00 34.32 H new ATOM 0 HG2 PRO A 162 -6.069 -1.744 7.586 1.00 55.24 H new ATOM 0 HG3 PRO A 162 -6.797 -2.185 6.054 1.00 55.24 H new ATOM 0 HD2 PRO A 162 -5.474 0.403 6.840 1.00 1.22 H new ATOM 0 HD3 PRO A 162 -5.462 -0.413 5.289 1.00 1.22 H new ATOM 278 N ASN A 163 -10.747 0.980 6.715 1.00 34.34 N ATOM 279 CA ASN A 163 -11.771 1.868 7.298 1.00 22.45 C ATOM 280 C ASN A 163 -11.836 3.236 6.591 1.00 64.34 C ATOM 281 O ASN A 163 -11.886 4.284 7.242 1.00 71.03 O ATOM 282 CB ASN A 163 -11.557 2.049 8.811 1.00 63.12 C ATOM 283 CG ASN A 163 -11.704 0.747 9.579 1.00 30.44 C ATOM 284 OD1 ASN A 163 -12.433 -0.153 9.170 1.00 44.14 O ATOM 285 ND2 ASN A 163 -11.027 0.634 10.702 1.00 22.24 N ATOM 0 H ASN A 163 -11.135 0.245 6.124 1.00 34.34 H new ATOM 0 HA ASN A 163 -12.732 1.378 7.141 1.00 22.45 H new ATOM 0 HB2 ASN A 163 -10.563 2.461 8.987 1.00 63.12 H new ATOM 0 HB3 ASN A 163 -12.275 2.775 9.192 1.00 63.12 H new ATOM 0 HD21 ASN A 163 -11.100 -0.218 11.258 1.00 22.24 H new ATOM 0 HD22 ASN A 163 -10.429 1.398 11.016 1.00 22.24 H new ATOM 292 N LYS A 164 -11.852 3.208 5.255 1.00 41.22 N ATOM 293 CA LYS A 164 -12.049 4.415 4.433 1.00 43.43 C ATOM 294 C LYS A 164 -10.910 5.438 4.594 1.00 72.31 C ATOM 295 O LYS A 164 -11.074 6.617 4.271 1.00 54.13 O ATOM 296 CB LYS A 164 -13.394 5.079 4.781 1.00 41.21 C ATOM 297 CG LYS A 164 -14.606 4.168 4.596 1.00 35.32 C ATOM 298 CD LYS A 164 -15.894 4.831 5.083 1.00 73.03 C ATOM 299 CE LYS A 164 -16.209 6.107 4.311 1.00 63.24 C ATOM 300 NZ LYS A 164 -17.393 6.812 4.864 1.00 31.15 N ATOM 0 H LYS A 164 -11.730 2.354 4.711 1.00 41.22 H new ATOM 0 HA LYS A 164 -12.049 4.091 3.392 1.00 43.43 H new ATOM 0 HB2 LYS A 164 -13.362 5.418 5.817 1.00 41.21 H new ATOM 0 HB3 LYS A 164 -13.521 5.965 4.159 1.00 41.21 H new ATOM 0 HG2 LYS A 164 -14.707 3.907 3.542 1.00 35.32 H new ATOM 0 HG3 LYS A 164 -14.448 3.237 5.141 1.00 35.32 H new ATOM 0 HD2 LYS A 164 -16.723 4.131 4.979 1.00 73.03 H new ATOM 0 HD3 LYS A 164 -15.803 5.063 6.144 1.00 73.03 H new ATOM 0 HE2 LYS A 164 -15.345 6.771 4.340 1.00 63.24 H new ATOM 0 HE3 LYS A 164 -16.388 5.863 3.264 1.00 63.24 H new ATOM 0 HZ1 LYS A 164 -17.573 7.674 4.311 1.00 31.15 H new ATOM 0 HZ2 LYS A 164 -18.224 6.188 4.813 1.00 31.15 H new ATOM 0 HZ3 LYS A 164 -17.213 7.068 5.856 1.00 31.15 H new ATOM 314 N GLN A 165 -9.756 4.990 5.066 1.00 62.31 N ATOM 315 CA GLN A 165 -8.621 5.888 5.292 1.00 32.11 C ATOM 316 C GLN A 165 -7.745 6.003 4.035 1.00 54.10 C ATOM 317 O GLN A 165 -7.536 5.029 3.316 1.00 32.52 O ATOM 318 CB GLN A 165 -7.782 5.393 6.476 1.00 31.41 C ATOM 319 CG GLN A 165 -8.568 5.253 7.775 1.00 10.44 C ATOM 320 CD GLN A 165 -9.181 6.561 8.249 1.00 14.44 C ATOM 321 OE1 GLN A 165 -8.648 7.640 8.005 1.00 71.52 O ATOM 322 NE2 GLN A 165 -10.300 6.480 8.937 1.00 41.21 N ATOM 0 H GLN A 165 -9.576 4.014 5.301 1.00 62.31 H new ATOM 0 HA GLN A 165 -9.015 6.878 5.522 1.00 32.11 H new ATOM 0 HB2 GLN A 165 -7.346 4.427 6.221 1.00 31.41 H new ATOM 0 HB3 GLN A 165 -6.954 6.084 6.636 1.00 31.41 H new ATOM 0 HG2 GLN A 165 -9.360 4.518 7.635 1.00 10.44 H new ATOM 0 HG3 GLN A 165 -7.908 4.866 8.551 1.00 10.44 H new ATOM 0 HE21 GLN A 165 -10.719 5.569 9.124 1.00 41.21 H new ATOM 0 HE22 GLN A 165 -10.748 7.328 9.283 1.00 41.21 H new ATOM 331 N ARG A 166 -7.245 7.204 3.767 1.00 31.43 N ATOM 332 CA ARG A 166 -6.379 7.445 2.604 1.00 60.41 C ATOM 333 C ARG A 166 -4.975 7.910 3.022 1.00 13.34 C ATOM 334 O ARG A 166 -4.810 8.658 3.990 1.00 40.11 O ATOM 335 CB ARG A 166 -6.998 8.496 1.659 1.00 32.32 C ATOM 336 CG ARG A 166 -8.037 7.958 0.669 1.00 24.13 C ATOM 337 CD ARG A 166 -9.367 7.599 1.325 1.00 74.40 C ATOM 338 NE ARG A 166 -10.357 7.211 0.323 1.00 72.22 N ATOM 339 CZ ARG A 166 -11.571 6.810 0.583 1.00 53.32 C ATOM 340 NH1 ARG A 166 -12.009 6.744 1.797 1.00 33.32 N ATOM 341 NH2 ARG A 166 -12.353 6.486 -0.390 1.00 71.15 N ATOM 0 H ARG A 166 -7.421 8.032 4.337 1.00 31.43 H new ATOM 0 HA ARG A 166 -6.290 6.493 2.081 1.00 60.41 H new ATOM 0 HB2 ARG A 166 -7.465 9.273 2.264 1.00 32.32 H new ATOM 0 HB3 ARG A 166 -6.195 8.971 1.095 1.00 32.32 H new ATOM 0 HG2 ARG A 166 -8.212 8.705 -0.105 1.00 24.13 H new ATOM 0 HG3 ARG A 166 -7.634 7.074 0.174 1.00 24.13 H new ATOM 0 HD2 ARG A 166 -9.219 6.782 2.031 1.00 74.40 H new ATOM 0 HD3 ARG A 166 -9.737 8.451 1.896 1.00 74.40 H new ATOM 0 HE ARG A 166 -10.077 7.257 -0.657 1.00 72.22 H new ATOM 0 HH11 ARG A 166 -11.402 7.008 2.573 1.00 33.32 H new ATOM 0 HH12 ARG A 166 -12.962 6.428 1.979 1.00 33.32 H new ATOM 0 HH21 ARG A 166 -12.021 6.544 -1.353 1.00 71.15 H new ATOM 0 HH22 ARG A 166 -13.304 6.171 -0.197 1.00 71.15 H new ATOM 355 N THR A 167 -3.970 7.454 2.282 1.00 74.52 N ATOM 356 CA THR A 167 -2.590 7.929 2.450 1.00 60.23 C ATOM 357 C THR A 167 -1.862 7.968 1.102 1.00 40.21 C ATOM 358 O THR A 167 -2.008 7.064 0.277 1.00 11.41 O ATOM 359 CB THR A 167 -1.776 7.054 3.435 1.00 25.35 C ATOM 360 OG1 THR A 167 -0.456 7.597 3.597 1.00 13.44 O ATOM 361 CG2 THR A 167 -1.674 5.611 2.949 1.00 63.13 C ATOM 0 H THR A 167 -4.081 6.750 1.552 1.00 74.52 H new ATOM 0 HA THR A 167 -2.661 8.934 2.867 1.00 60.23 H new ATOM 0 HB THR A 167 -2.299 7.057 4.391 1.00 25.35 H new ATOM 0 HG1 THR A 167 0.052 7.040 4.222 1.00 13.44 H new ATOM 0 HG21 THR A 167 -1.096 5.026 3.665 1.00 63.13 H new ATOM 0 HG22 THR A 167 -2.674 5.187 2.857 1.00 63.13 H new ATOM 0 HG23 THR A 167 -1.179 5.588 1.978 1.00 63.13 H new ATOM 369 N VAL A 168 -1.098 9.027 0.870 1.00 61.21 N ATOM 370 CA VAL A 168 -0.335 9.178 -0.372 1.00 23.45 C ATOM 371 C VAL A 168 1.174 9.237 -0.083 1.00 63.41 C ATOM 372 O VAL A 168 1.643 10.122 0.640 1.00 14.12 O ATOM 373 CB VAL A 168 -0.768 10.449 -1.149 1.00 72.02 C ATOM 374 CG1 VAL A 168 -0.004 10.567 -2.461 1.00 44.52 C ATOM 375 CG2 VAL A 168 -2.278 10.447 -1.398 1.00 25.12 C ATOM 0 H VAL A 168 -0.987 9.800 1.526 1.00 61.21 H new ATOM 0 HA VAL A 168 -0.545 8.305 -0.990 1.00 23.45 H new ATOM 0 HB VAL A 168 -0.527 11.318 -0.537 1.00 72.02 H new ATOM 0 HG11 VAL A 168 -0.324 11.465 -2.989 1.00 44.52 H new ATOM 0 HG12 VAL A 168 1.065 10.628 -2.255 1.00 44.52 H new ATOM 0 HG13 VAL A 168 -0.205 9.692 -3.079 1.00 44.52 H new ATOM 0 HG21 VAL A 168 -2.558 11.348 -1.944 1.00 25.12 H new ATOM 0 HG22 VAL A 168 -2.549 9.569 -1.984 1.00 25.12 H new ATOM 0 HG23 VAL A 168 -2.804 10.423 -0.444 1.00 25.12 H new ATOM 385 N VAL A 169 1.926 8.292 -0.649 1.00 43.24 N ATOM 386 CA VAL A 169 3.373 8.188 -0.404 1.00 2.14 C ATOM 387 C VAL A 169 4.191 8.461 -1.681 1.00 13.10 C ATOM 388 O VAL A 169 3.741 8.172 -2.793 1.00 20.23 O ATOM 389 CB VAL A 169 3.747 6.785 0.154 1.00 2.31 C ATOM 390 CG1 VAL A 169 3.083 6.548 1.510 1.00 75.44 C ATOM 391 CG2 VAL A 169 3.365 5.684 -0.837 1.00 34.14 C ATOM 0 H VAL A 169 1.559 7.583 -1.284 1.00 43.24 H new ATOM 0 HA VAL A 169 3.620 8.949 0.336 1.00 2.14 H new ATOM 0 HB VAL A 169 4.828 6.753 0.293 1.00 2.31 H new ATOM 0 HG11 VAL A 169 3.358 5.561 1.882 1.00 75.44 H new ATOM 0 HG12 VAL A 169 3.417 7.308 2.216 1.00 75.44 H new ATOM 0 HG13 VAL A 169 2.000 6.606 1.400 1.00 75.44 H new ATOM 0 HG21 VAL A 169 3.637 4.713 -0.424 1.00 34.14 H new ATOM 0 HG22 VAL A 169 2.291 5.714 -1.018 1.00 34.14 H new ATOM 0 HG23 VAL A 169 3.895 5.840 -1.776 1.00 34.14 H new ATOM 401 N PRO A 170 5.402 9.042 -1.543 1.00 70.42 N ATOM 402 CA PRO A 170 6.300 9.295 -2.683 1.00 14.20 C ATOM 403 C PRO A 170 6.922 8.002 -3.249 1.00 72.51 C ATOM 404 O PRO A 170 7.558 7.238 -2.521 1.00 4.41 O ATOM 405 CB PRO A 170 7.398 10.207 -2.092 1.00 35.21 C ATOM 406 CG PRO A 170 6.900 10.617 -0.741 1.00 75.33 C ATOM 407 CD PRO A 170 5.990 9.513 -0.281 1.00 42.05 C ATOM 0 HA PRO A 170 5.764 9.741 -3.521 1.00 14.20 H new ATOM 0 HB2 PRO A 170 8.348 9.677 -2.015 1.00 35.21 H new ATOM 0 HB3 PRO A 170 7.569 11.076 -2.727 1.00 35.21 H new ATOM 0 HG2 PRO A 170 7.728 10.755 -0.046 1.00 75.33 H new ATOM 0 HG3 PRO A 170 6.366 11.566 -0.794 1.00 75.33 H new ATOM 0 HD2 PRO A 170 6.538 8.722 0.232 1.00 42.05 H new ATOM 0 HD3 PRO A 170 5.230 9.875 0.411 1.00 42.05 H new ATOM 415 N ALA A 171 6.745 7.777 -4.550 1.00 14.44 N ATOM 416 CA ALA A 171 7.268 6.577 -5.218 1.00 20.11 C ATOM 417 C ALA A 171 8.801 6.622 -5.354 1.00 11.54 C ATOM 418 O ALA A 171 9.359 7.535 -5.970 1.00 51.11 O ATOM 419 CB ALA A 171 6.616 6.417 -6.589 1.00 21.43 C ATOM 0 H ALA A 171 6.241 8.412 -5.169 1.00 14.44 H new ATOM 0 HA ALA A 171 7.020 5.715 -4.599 1.00 20.11 H new ATOM 0 HB1 ALA A 171 7.009 5.525 -7.077 1.00 21.43 H new ATOM 0 HB2 ALA A 171 5.537 6.319 -6.470 1.00 21.43 H new ATOM 0 HB3 ALA A 171 6.836 7.292 -7.201 1.00 21.43 H new ATOM 425 N ARG A 172 9.477 5.628 -4.774 1.00 35.12 N ATOM 426 CA ARG A 172 10.943 5.551 -4.808 1.00 4.10 C ATOM 427 C ARG A 172 11.413 4.185 -5.333 1.00 2.43 C ATOM 428 O ARG A 172 10.666 3.204 -5.298 1.00 31.32 O ATOM 429 CB ARG A 172 11.511 5.769 -3.398 1.00 20.13 C ATOM 430 CG ARG A 172 10.963 7.000 -2.679 1.00 64.45 C ATOM 431 CD ARG A 172 11.538 7.123 -1.269 1.00 11.31 C ATOM 432 NE ARG A 172 10.892 8.179 -0.488 1.00 41.54 N ATOM 433 CZ ARG A 172 11.451 9.325 -0.202 1.00 14.20 C ATOM 434 NH1 ARG A 172 12.614 9.627 -0.684 1.00 62.30 N ATOM 435 NH2 ARG A 172 10.836 10.175 0.556 1.00 0.55 N ATOM 0 H ARG A 172 9.031 4.860 -4.272 1.00 35.12 H new ATOM 0 HA ARG A 172 11.305 6.329 -5.480 1.00 4.10 H new ATOM 0 HB2 ARG A 172 11.299 4.887 -2.794 1.00 20.13 H new ATOM 0 HB3 ARG A 172 12.595 5.856 -3.466 1.00 20.13 H new ATOM 0 HG2 ARG A 172 11.205 7.895 -3.252 1.00 64.45 H new ATOM 0 HG3 ARG A 172 9.876 6.939 -2.626 1.00 64.45 H new ATOM 0 HD2 ARG A 172 11.425 6.171 -0.750 1.00 11.31 H new ATOM 0 HD3 ARG A 172 12.607 7.326 -1.333 1.00 11.31 H new ATOM 0 HE ARG A 172 9.946 8.010 -0.146 1.00 41.54 H new ATOM 0 HH11 ARG A 172 13.101 8.968 -1.292 1.00 62.30 H new ATOM 0 HH12 ARG A 172 13.043 10.524 -0.456 1.00 62.30 H new ATOM 0 HH21 ARG A 172 9.914 9.951 0.931 1.00 0.55 H new ATOM 0 HH22 ARG A 172 11.273 11.069 0.779 1.00 0.55 H new ATOM 449 N CYS A 173 12.655 4.124 -5.809 1.00 34.45 N ATOM 450 CA CYS A 173 13.257 2.853 -6.241 1.00 10.01 C ATOM 451 C CYS A 173 14.163 2.287 -5.139 1.00 41.34 C ATOM 452 O CYS A 173 14.895 3.032 -4.481 1.00 72.33 O ATOM 453 CB CYS A 173 14.059 3.045 -7.532 1.00 23.40 C ATOM 454 SG CYS A 173 14.744 1.511 -8.203 1.00 41.34 S ATOM 0 H CYS A 173 13.267 4.934 -5.907 1.00 34.45 H new ATOM 0 HA CYS A 173 12.452 2.144 -6.434 1.00 10.01 H new ATOM 0 HB2 CYS A 173 13.416 3.504 -8.283 1.00 23.40 H new ATOM 0 HB3 CYS A 173 14.874 3.743 -7.342 1.00 23.40 H new ATOM 0 HG CYS A 173 15.403 1.770 -9.293 1.00 41.34 H new ATOM 460 N GLY A 174 14.110 0.972 -4.935 1.00 2.33 N ATOM 461 CA GLY A 174 14.840 0.358 -3.831 1.00 63.42 C ATOM 462 C GLY A 174 14.104 0.511 -2.504 1.00 3.14 C ATOM 463 O GLY A 174 14.665 0.265 -1.434 1.00 2.22 O ATOM 0 H GLY A 174 13.577 0.320 -5.511 1.00 2.33 H new ATOM 0 HA2 GLY A 174 14.992 -0.701 -4.041 1.00 63.42 H new ATOM 0 HA3 GLY A 174 15.828 0.812 -3.752 1.00 63.42 H new ATOM 467 N VAL A 175 12.843 0.939 -2.584 1.00 64.24 N ATOM 468 CA VAL A 175 11.984 1.115 -1.408 1.00 60.23 C ATOM 469 C VAL A 175 10.662 0.358 -1.597 1.00 41.53 C ATOM 470 O VAL A 175 9.898 0.636 -2.526 1.00 52.25 O ATOM 471 CB VAL A 175 11.683 2.615 -1.143 1.00 54.12 C ATOM 472 CG1 VAL A 175 10.768 2.788 0.070 1.00 61.41 C ATOM 473 CG2 VAL A 175 12.980 3.401 -0.952 1.00 73.22 C ATOM 0 H VAL A 175 12.387 1.174 -3.465 1.00 64.24 H new ATOM 0 HA VAL A 175 12.519 0.713 -0.548 1.00 60.23 H new ATOM 0 HB VAL A 175 11.164 3.011 -2.016 1.00 54.12 H new ATOM 0 HG11 VAL A 175 10.574 3.848 0.231 1.00 61.41 H new ATOM 0 HG12 VAL A 175 9.826 2.270 -0.108 1.00 61.41 H new ATOM 0 HG13 VAL A 175 11.251 2.369 0.953 1.00 61.41 H new ATOM 0 HG21 VAL A 175 12.746 4.450 -0.768 1.00 73.22 H new ATOM 0 HG22 VAL A 175 13.529 2.997 -0.101 1.00 73.22 H new ATOM 0 HG23 VAL A 175 13.591 3.318 -1.851 1.00 73.22 H new ATOM 483 N THR A 176 10.394 -0.594 -0.716 1.00 52.05 N ATOM 484 CA THR A 176 9.220 -1.464 -0.851 1.00 24.24 C ATOM 485 C THR A 176 7.940 -0.789 -0.354 1.00 43.04 C ATOM 486 O THR A 176 7.979 0.266 0.284 1.00 14.33 O ATOM 487 CB THR A 176 9.393 -2.786 -0.068 1.00 4.23 C ATOM 488 OG1 THR A 176 9.247 -2.549 1.345 1.00 61.43 O ATOM 489 CG2 THR A 176 10.755 -3.417 -0.349 1.00 63.02 C ATOM 0 H THR A 176 10.970 -0.789 0.103 1.00 52.05 H new ATOM 0 HA THR A 176 9.133 -1.671 -1.918 1.00 24.24 H new ATOM 0 HB THR A 176 8.619 -3.478 -0.400 1.00 4.23 H new ATOM 0 HG1 THR A 176 10.116 -2.305 1.727 1.00 61.43 H new ATOM 0 HG21 THR A 176 10.849 -4.345 0.215 1.00 63.02 H new ATOM 0 HG22 THR A 176 10.845 -3.629 -1.414 1.00 63.02 H new ATOM 0 HG23 THR A 176 11.544 -2.728 -0.048 1.00 63.02 H new ATOM 497 N VAL A 177 6.802 -1.407 -0.656 1.00 42.10 N ATOM 498 CA VAL A 177 5.514 -0.980 -0.108 1.00 12.33 C ATOM 499 C VAL A 177 5.520 -1.106 1.426 1.00 15.24 C ATOM 500 O VAL A 177 4.992 -0.252 2.142 1.00 50.11 O ATOM 501 CB VAL A 177 4.354 -1.829 -0.699 1.00 74.41 C ATOM 502 CG1 VAL A 177 3.000 -1.376 -0.158 1.00 32.40 C ATOM 503 CG2 VAL A 177 4.371 -1.780 -2.229 1.00 53.14 C ATOM 0 H VAL A 177 6.744 -2.211 -1.281 1.00 42.10 H new ATOM 0 HA VAL A 177 5.358 0.063 -0.382 1.00 12.33 H new ATOM 0 HB VAL A 177 4.507 -2.862 -0.386 1.00 74.41 H new ATOM 0 HG11 VAL A 177 2.211 -1.990 -0.592 1.00 32.40 H new ATOM 0 HG12 VAL A 177 2.988 -1.482 0.927 1.00 32.40 H new ATOM 0 HG13 VAL A 177 2.833 -0.332 -0.423 1.00 32.40 H new ATOM 0 HG21 VAL A 177 3.551 -2.381 -2.621 1.00 53.14 H new ATOM 0 HG22 VAL A 177 4.256 -0.748 -2.561 1.00 53.14 H new ATOM 0 HG23 VAL A 177 5.318 -2.176 -2.595 1.00 53.14 H new ATOM 513 N ARG A 178 6.159 -2.167 1.915 1.00 55.42 N ATOM 514 CA ARG A 178 6.281 -2.430 3.353 1.00 32.54 C ATOM 515 C ARG A 178 7.097 -1.330 4.049 1.00 52.23 C ATOM 516 O ARG A 178 6.835 -0.977 5.200 1.00 2.12 O ATOM 517 CB ARG A 178 6.945 -3.798 3.572 1.00 43.53 C ATOM 518 CG ARG A 178 6.797 -4.352 4.985 1.00 65.04 C ATOM 519 CD ARG A 178 7.484 -5.709 5.130 1.00 11.34 C ATOM 520 NE ARG A 178 7.304 -6.277 6.466 1.00 63.12 N ATOM 521 CZ ARG A 178 6.696 -7.408 6.710 1.00 24.21 C ATOM 522 NH1 ARG A 178 6.192 -8.110 5.747 1.00 75.42 N ATOM 523 NH2 ARG A 178 6.610 -7.838 7.925 1.00 21.10 N ATOM 0 H ARG A 178 6.608 -2.870 1.328 1.00 55.42 H new ATOM 0 HA ARG A 178 5.282 -2.435 3.790 1.00 32.54 H new ATOM 0 HB2 ARG A 178 6.518 -4.512 2.868 1.00 43.53 H new ATOM 0 HB3 ARG A 178 8.006 -3.715 3.337 1.00 43.53 H new ATOM 0 HG2 ARG A 178 7.225 -3.648 5.699 1.00 65.04 H new ATOM 0 HG3 ARG A 178 5.739 -4.451 5.229 1.00 65.04 H new ATOM 0 HD2 ARG A 178 7.084 -6.399 4.387 1.00 11.34 H new ATOM 0 HD3 ARG A 178 8.549 -5.600 4.923 1.00 11.34 H new ATOM 0 HE ARG A 178 7.678 -5.756 7.259 1.00 63.12 H new ATOM 0 HH11 ARG A 178 6.267 -7.782 4.784 1.00 75.42 H new ATOM 0 HH12 ARG A 178 5.720 -8.991 5.951 1.00 75.42 H new ATOM 0 HH21 ARG A 178 7.015 -7.296 8.688 1.00 21.10 H new ATOM 0 HH22 ARG A 178 6.137 -8.720 8.122 1.00 21.10 H new ATOM 537 N ASP A 179 8.100 -0.806 3.350 1.00 44.01 N ATOM 538 CA ASP A 179 8.899 0.312 3.858 1.00 12.21 C ATOM 539 C ASP A 179 8.147 1.646 3.743 1.00 31.13 C ATOM 540 O ASP A 179 8.025 2.385 4.719 1.00 0.34 O ATOM 541 CB ASP A 179 10.238 0.392 3.119 1.00 13.21 C ATOM 542 CG ASP A 179 11.225 -0.651 3.608 1.00 20.24 C ATOM 543 OD1 ASP A 179 11.120 -1.825 3.196 1.00 41.31 O ATOM 544 OD2 ASP A 179 12.115 -0.298 4.408 1.00 4.44 O ATOM 0 H ASP A 179 8.382 -1.137 2.427 1.00 44.01 H new ATOM 0 HA ASP A 179 9.087 0.127 4.916 1.00 12.21 H new ATOM 0 HB2 ASP A 179 10.070 0.258 2.050 1.00 13.21 H new ATOM 0 HB3 ASP A 179 10.666 1.386 3.252 1.00 13.21 H new ATOM 549 N SER A 180 7.646 1.942 2.551 1.00 53.02 N ATOM 550 CA SER A 180 6.923 3.197 2.296 1.00 4.10 C ATOM 551 C SER A 180 5.733 3.383 3.250 1.00 11.12 C ATOM 552 O SER A 180 5.514 4.477 3.779 1.00 71.24 O ATOM 553 CB SER A 180 6.429 3.241 0.842 1.00 40.42 C ATOM 554 OG SER A 180 7.509 3.133 -0.074 1.00 65.23 O ATOM 0 H SER A 180 7.724 1.332 1.737 1.00 53.02 H new ATOM 0 HA SER A 180 7.624 4.013 2.472 1.00 4.10 H new ATOM 0 HB2 SER A 180 5.722 2.429 0.671 1.00 40.42 H new ATOM 0 HB3 SER A 180 5.892 4.173 0.666 1.00 40.42 H new ATOM 0 HG SER A 180 7.752 2.190 -0.184 1.00 65.23 H new ATOM 560 N LEU A 181 4.976 2.310 3.483 1.00 3.02 N ATOM 561 CA LEU A 181 3.749 2.389 4.290 1.00 64.44 C ATOM 562 C LEU A 181 3.969 2.098 5.786 1.00 60.35 C ATOM 563 O LEU A 181 3.061 2.321 6.584 1.00 1.00 O ATOM 564 CB LEU A 181 2.688 1.422 3.745 1.00 35.41 C ATOM 565 CG LEU A 181 2.163 1.734 2.334 1.00 53.14 C ATOM 566 CD1 LEU A 181 1.093 0.722 1.925 1.00 42.34 C ATOM 567 CD2 LEU A 181 1.618 3.160 2.262 1.00 15.15 C ATOM 0 H LEU A 181 5.186 1.377 3.128 1.00 3.02 H new ATOM 0 HA LEU A 181 3.410 3.422 4.210 1.00 64.44 H new ATOM 0 HB2 LEU A 181 3.107 0.416 3.742 1.00 35.41 H new ATOM 0 HB3 LEU A 181 1.843 1.413 4.433 1.00 35.41 H new ATOM 0 HG LEU A 181 2.994 1.655 1.633 1.00 53.14 H new ATOM 0 HD11 LEU A 181 0.733 0.958 0.924 1.00 42.34 H new ATOM 0 HD12 LEU A 181 1.520 -0.281 1.930 1.00 42.34 H new ATOM 0 HD13 LEU A 181 0.262 0.766 2.629 1.00 42.34 H new ATOM 0 HD21 LEU A 181 1.252 3.359 1.255 1.00 15.15 H new ATOM 0 HD22 LEU A 181 0.801 3.274 2.974 1.00 15.15 H new ATOM 0 HD23 LEU A 181 2.412 3.866 2.506 1.00 15.15 H new ATOM 579 N LYS A 182 5.152 1.613 6.184 1.00 61.12 N ATOM 580 CA LYS A 182 5.372 1.241 7.599 1.00 12.43 C ATOM 581 C LYS A 182 5.130 2.435 8.540 1.00 2.23 C ATOM 582 O LYS A 182 4.745 2.259 9.695 1.00 21.33 O ATOM 583 CB LYS A 182 6.774 0.653 7.834 1.00 25.11 C ATOM 584 CG LYS A 182 7.921 1.657 7.737 1.00 42.12 C ATOM 585 CD LYS A 182 9.246 1.074 8.245 1.00 65.45 C ATOM 586 CE LYS A 182 9.870 0.061 7.284 1.00 70.00 C ATOM 587 NZ LYS A 182 9.000 -1.122 7.035 1.00 53.44 N ATOM 0 H LYS A 182 5.955 1.470 5.571 1.00 61.12 H new ATOM 0 HA LYS A 182 4.643 0.465 7.831 1.00 12.43 H new ATOM 0 HB2 LYS A 182 6.797 0.192 8.822 1.00 25.11 H new ATOM 0 HB3 LYS A 182 6.944 -0.142 7.108 1.00 25.11 H new ATOM 0 HG2 LYS A 182 8.039 1.973 6.700 1.00 42.12 H new ATOM 0 HG3 LYS A 182 7.672 2.547 8.315 1.00 42.12 H new ATOM 0 HD2 LYS A 182 9.952 1.887 8.413 1.00 65.45 H new ATOM 0 HD3 LYS A 182 9.078 0.594 9.209 1.00 65.45 H new ATOM 0 HE2 LYS A 182 10.084 0.553 6.335 1.00 70.00 H new ATOM 0 HE3 LYS A 182 10.824 -0.276 7.690 1.00 70.00 H new ATOM 0 HZ1 LYS A 182 9.592 -1.949 6.820 1.00 53.44 H new ATOM 0 HZ2 LYS A 182 8.428 -1.316 7.881 1.00 53.44 H new ATOM 0 HZ3 LYS A 182 8.372 -0.927 6.230 1.00 53.44 H new ATOM 601 N LYS A 183 5.355 3.651 8.037 1.00 24.32 N ATOM 602 CA LYS A 183 5.043 4.869 8.793 1.00 21.44 C ATOM 603 C LYS A 183 3.518 5.066 8.899 1.00 25.21 C ATOM 604 O LYS A 183 2.985 5.349 9.976 1.00 23.12 O ATOM 605 CB LYS A 183 5.686 6.095 8.120 1.00 22.45 C ATOM 606 CG LYS A 183 7.215 6.049 8.063 1.00 25.11 C ATOM 607 CD LYS A 183 7.794 7.330 7.463 1.00 73.33 C ATOM 608 CE LYS A 183 9.319 7.375 7.559 1.00 12.44 C ATOM 609 NZ LYS A 183 9.974 6.284 6.783 1.00 4.24 N ATOM 0 H LYS A 183 5.751 3.820 7.112 1.00 24.32 H new ATOM 0 HA LYS A 183 5.451 4.762 9.798 1.00 21.44 H new ATOM 0 HB2 LYS A 183 5.298 6.184 7.105 1.00 22.45 H new ATOM 0 HB3 LYS A 183 5.380 6.993 8.658 1.00 22.45 H new ATOM 0 HG2 LYS A 183 7.613 5.905 9.067 1.00 25.11 H new ATOM 0 HG3 LYS A 183 7.532 5.192 7.468 1.00 25.11 H new ATOM 0 HD2 LYS A 183 7.495 7.407 6.418 1.00 73.33 H new ATOM 0 HD3 LYS A 183 7.374 8.193 7.979 1.00 73.33 H new ATOM 0 HE2 LYS A 183 9.674 8.339 7.195 1.00 12.44 H new ATOM 0 HE3 LYS A 183 9.616 7.301 8.605 1.00 12.44 H new ATOM 0 HZ1 LYS A 183 11.007 6.360 6.881 1.00 4.24 H new ATOM 0 HZ2 LYS A 183 9.658 5.362 7.146 1.00 4.24 H new ATOM 0 HZ3 LYS A 183 9.715 6.368 5.779 1.00 4.24 H new ATOM 623 N ALA A 184 2.826 4.890 7.770 1.00 65.43 N ATOM 624 CA ALA A 184 1.366 5.033 7.710 1.00 63.11 C ATOM 625 C ALA A 184 0.657 3.998 8.600 1.00 5.14 C ATOM 626 O ALA A 184 -0.348 4.296 9.245 1.00 45.23 O ATOM 627 CB ALA A 184 0.883 4.913 6.266 1.00 63.42 C ATOM 0 H ALA A 184 3.256 4.646 6.878 1.00 65.43 H new ATOM 0 HA ALA A 184 1.113 6.023 8.090 1.00 63.11 H new ATOM 0 HB1 ALA A 184 -0.201 5.021 6.235 1.00 63.42 H new ATOM 0 HB2 ALA A 184 1.343 5.695 5.662 1.00 63.42 H new ATOM 0 HB3 ALA A 184 1.162 3.937 5.869 1.00 63.42 H new ATOM 633 N LEU A 185 1.184 2.781 8.629 1.00 30.24 N ATOM 634 CA LEU A 185 0.652 1.730 9.499 1.00 44.24 C ATOM 635 C LEU A 185 0.903 2.066 10.976 1.00 34.42 C ATOM 636 O LEU A 185 -0.001 1.985 11.810 1.00 60.14 O ATOM 637 CB LEU A 185 1.298 0.383 9.151 1.00 20.14 C ATOM 638 CG LEU A 185 1.090 -0.090 7.705 1.00 41.15 C ATOM 639 CD1 LEU A 185 1.832 -1.400 7.460 1.00 2.54 C ATOM 640 CD2 LEU A 185 -0.398 -0.245 7.391 1.00 34.22 C ATOM 0 H LEU A 185 1.981 2.493 8.061 1.00 30.24 H new ATOM 0 HA LEU A 185 -0.424 1.664 9.339 1.00 44.24 H new ATOM 0 HB2 LEU A 185 2.369 0.452 9.343 1.00 20.14 H new ATOM 0 HB3 LEU A 185 0.902 -0.376 9.825 1.00 20.14 H new ATOM 0 HG LEU A 185 1.498 0.668 7.036 1.00 41.15 H new ATOM 0 HD11 LEU A 185 1.674 -1.721 6.430 1.00 2.54 H new ATOM 0 HD12 LEU A 185 2.898 -1.253 7.634 1.00 2.54 H new ATOM 0 HD13 LEU A 185 1.455 -2.164 8.140 1.00 2.54 H new ATOM 0 HD21 LEU A 185 -0.519 -0.581 6.361 1.00 34.22 H new ATOM 0 HD22 LEU A 185 -0.838 -0.979 8.066 1.00 34.22 H new ATOM 0 HD23 LEU A 185 -0.899 0.714 7.521 1.00 34.22 H new ATOM 652 N MET A 186 2.137 2.464 11.283 1.00 31.35 N ATOM 653 CA MET A 186 2.536 2.812 12.652 1.00 45.41 C ATOM 654 C MET A 186 1.666 3.937 13.245 1.00 13.54 C ATOM 655 O MET A 186 1.317 3.909 14.428 1.00 35.31 O ATOM 656 CB MET A 186 4.014 3.224 12.665 1.00 25.35 C ATOM 657 CG MET A 186 4.537 3.629 14.036 1.00 5.44 C ATOM 658 SD MET A 186 6.285 4.069 14.003 1.00 3.12 S ATOM 659 CE MET A 186 7.015 2.497 13.542 1.00 34.12 C ATOM 0 H MET A 186 2.886 2.555 10.597 1.00 31.35 H new ATOM 0 HA MET A 186 2.389 1.931 13.276 1.00 45.41 H new ATOM 0 HB2 MET A 186 4.614 2.395 12.290 1.00 25.35 H new ATOM 0 HB3 MET A 186 4.154 4.056 11.975 1.00 25.35 H new ATOM 0 HG2 MET A 186 3.959 4.476 14.407 1.00 5.44 H new ATOM 0 HG3 MET A 186 4.385 2.808 14.737 1.00 5.44 H new ATOM 0 HE1 MET A 186 8.065 2.484 13.833 1.00 34.12 H new ATOM 0 HE2 MET A 186 6.488 1.689 14.049 1.00 34.12 H new ATOM 0 HE3 MET A 186 6.936 2.361 12.463 1.00 34.12 H new ATOM 669 N MET A 187 1.317 4.931 12.427 1.00 75.12 N ATOM 670 CA MET A 187 0.480 6.051 12.889 1.00 10.41 C ATOM 671 C MET A 187 -0.999 5.641 13.037 1.00 41.25 C ATOM 672 O MET A 187 -1.759 6.277 13.771 1.00 3.43 O ATOM 673 CB MET A 187 0.617 7.247 11.934 1.00 2.54 C ATOM 674 CG MET A 187 0.135 6.969 10.518 1.00 5.10 C ATOM 675 SD MET A 187 0.573 8.274 9.351 1.00 11.12 S ATOM 676 CE MET A 187 -0.294 9.674 10.055 1.00 12.51 C ATOM 0 H MET A 187 1.596 4.988 11.448 1.00 75.12 H new ATOM 0 HA MET A 187 0.835 6.343 13.877 1.00 10.41 H new ATOM 0 HB2 MET A 187 0.055 8.088 12.339 1.00 2.54 H new ATOM 0 HB3 MET A 187 1.663 7.551 11.897 1.00 2.54 H new ATOM 0 HG2 MET A 187 0.560 6.026 10.175 1.00 5.10 H new ATOM 0 HG3 MET A 187 -0.948 6.846 10.527 1.00 5.10 H new ATOM 0 HE1 MET A 187 -0.298 10.497 9.340 1.00 12.51 H new ATOM 0 HE2 MET A 187 -1.321 9.388 10.285 1.00 12.51 H new ATOM 0 HE3 MET A 187 0.208 9.990 10.970 1.00 12.51 H new ATOM 686 N ARG A 188 -1.402 4.572 12.346 1.00 70.21 N ATOM 687 CA ARG A 188 -2.786 4.070 12.420 1.00 14.34 C ATOM 688 C ARG A 188 -2.932 2.921 13.435 1.00 61.10 C ATOM 689 O ARG A 188 -4.045 2.547 13.802 1.00 51.52 O ATOM 690 CB ARG A 188 -3.254 3.589 11.039 1.00 63.53 C ATOM 691 CG ARG A 188 -3.311 4.684 9.976 1.00 14.04 C ATOM 692 CD ARG A 188 -4.280 5.799 10.353 1.00 10.42 C ATOM 693 NE ARG A 188 -5.642 5.304 10.561 1.00 25.22 N ATOM 694 CZ ARG A 188 -6.542 5.914 11.283 1.00 75.22 C ATOM 695 NH1 ARG A 188 -6.278 7.051 11.850 1.00 74.34 N ATOM 696 NH2 ARG A 188 -7.712 5.392 11.423 1.00 25.32 N ATOM 0 H ARG A 188 -0.794 4.034 11.728 1.00 70.21 H new ATOM 0 HA ARG A 188 -3.408 4.900 12.755 1.00 14.34 H new ATOM 0 HB2 ARG A 188 -2.584 2.801 10.696 1.00 63.53 H new ATOM 0 HB3 ARG A 188 -4.244 3.144 11.139 1.00 63.53 H new ATOM 0 HG2 ARG A 188 -2.315 5.103 9.834 1.00 14.04 H new ATOM 0 HG3 ARG A 188 -3.613 4.249 9.023 1.00 14.04 H new ATOM 0 HD2 ARG A 188 -3.931 6.289 11.262 1.00 10.42 H new ATOM 0 HD3 ARG A 188 -4.286 6.554 9.566 1.00 10.42 H new ATOM 0 HE ARG A 188 -5.904 4.426 10.113 1.00 25.22 H new ATOM 0 HH11 ARG A 188 -5.359 7.478 11.734 1.00 74.34 H new ATOM 0 HH12 ARG A 188 -6.990 7.518 12.412 1.00 74.34 H new ATOM 0 HH21 ARG A 188 -7.932 4.505 10.970 1.00 25.32 H new ATOM 0 HH22 ARG A 188 -8.418 5.866 11.987 1.00 25.32 H new ATOM 710 N GLY A 189 -1.807 2.362 13.874 1.00 12.40 N ATOM 711 CA GLY A 189 -1.841 1.222 14.787 1.00 11.12 C ATOM 712 C GLY A 189 -2.078 -0.099 14.062 1.00 73.42 C ATOM 713 O GLY A 189 -2.840 -0.952 14.525 1.00 34.23 O ATOM 0 H GLY A 189 -0.871 2.675 13.616 1.00 12.40 H new ATOM 0 HA2 GLY A 189 -0.899 1.169 15.333 1.00 11.12 H new ATOM 0 HA3 GLY A 189 -2.629 1.375 15.525 1.00 11.12 H new ATOM 717 N LEU A 190 -1.421 -0.260 12.917 1.00 62.21 N ATOM 718 CA LEU A 190 -1.546 -1.469 12.095 1.00 22.43 C ATOM 719 C LEU A 190 -0.165 -2.088 11.819 1.00 21.20 C ATOM 720 O LEU A 190 0.858 -1.407 11.899 1.00 23.13 O ATOM 721 CB LEU A 190 -2.241 -1.134 10.763 1.00 22.13 C ATOM 722 CG LEU A 190 -3.657 -0.541 10.880 1.00 61.42 C ATOM 723 CD1 LEU A 190 -4.205 -0.171 9.503 1.00 52.33 C ATOM 724 CD2 LEU A 190 -4.595 -1.514 11.593 1.00 33.40 C ATOM 0 H LEU A 190 -0.787 0.439 12.530 1.00 62.21 H new ATOM 0 HA LEU A 190 -2.148 -2.193 12.644 1.00 22.43 H new ATOM 0 HB2 LEU A 190 -1.616 -0.429 10.215 1.00 22.13 H new ATOM 0 HB3 LEU A 190 -2.296 -2.043 10.164 1.00 22.13 H new ATOM 0 HG LEU A 190 -3.595 0.369 11.476 1.00 61.42 H new ATOM 0 HD11 LEU A 190 -5.206 0.246 9.610 1.00 52.33 H new ATOM 0 HD12 LEU A 190 -3.552 0.568 9.038 1.00 52.33 H new ATOM 0 HD13 LEU A 190 -4.248 -1.062 8.877 1.00 52.33 H new ATOM 0 HD21 LEU A 190 -5.590 -1.074 11.664 1.00 33.40 H new ATOM 0 HD22 LEU A 190 -4.650 -2.446 11.030 1.00 33.40 H new ATOM 0 HD23 LEU A 190 -4.216 -1.717 12.594 1.00 33.40 H new ATOM 736 N ILE A 191 -0.143 -3.377 11.490 1.00 72.32 N ATOM 737 CA ILE A 191 1.113 -4.088 11.207 1.00 50.40 C ATOM 738 C ILE A 191 1.003 -4.931 9.921 1.00 43.11 C ATOM 739 O ILE A 191 -0.012 -5.595 9.693 1.00 40.34 O ATOM 740 CB ILE A 191 1.526 -4.999 12.398 1.00 15.14 C ATOM 741 CG1 ILE A 191 0.349 -5.889 12.839 1.00 24.14 C ATOM 742 CG2 ILE A 191 2.045 -4.158 13.567 1.00 35.12 C ATOM 743 CD1 ILE A 191 0.662 -6.782 14.028 1.00 34.41 C ATOM 0 H ILE A 191 -0.979 -3.956 11.411 1.00 72.32 H new ATOM 0 HA ILE A 191 1.883 -3.330 11.062 1.00 50.40 H new ATOM 0 HB ILE A 191 2.334 -5.651 12.066 1.00 15.14 H new ATOM 0 HG12 ILE A 191 -0.500 -5.253 13.089 1.00 24.14 H new ATOM 0 HG13 ILE A 191 0.044 -6.513 11.999 1.00 24.14 H new ATOM 0 HG21 ILE A 191 2.329 -4.814 14.390 1.00 35.12 H new ATOM 0 HG22 ILE A 191 2.914 -3.584 13.245 1.00 35.12 H new ATOM 0 HG23 ILE A 191 1.263 -3.476 13.900 1.00 35.12 H new ATOM 0 HD11 ILE A 191 -0.216 -7.377 14.277 1.00 34.41 H new ATOM 0 HD12 ILE A 191 1.490 -7.445 13.777 1.00 34.41 H new ATOM 0 HD13 ILE A 191 0.937 -6.165 14.884 1.00 34.41 H new ATOM 755 N PRO A 192 2.052 -4.920 9.064 1.00 44.13 N ATOM 756 CA PRO A 192 2.043 -5.626 7.766 1.00 33.43 C ATOM 757 C PRO A 192 1.587 -7.093 7.864 1.00 0.44 C ATOM 758 O PRO A 192 0.783 -7.557 7.058 1.00 73.25 O ATOM 759 CB PRO A 192 3.510 -5.547 7.316 1.00 61.24 C ATOM 760 CG PRO A 192 4.031 -4.308 7.960 1.00 14.43 C ATOM 761 CD PRO A 192 3.332 -4.210 9.291 1.00 45.34 C ATOM 0 HA PRO A 192 1.334 -5.174 7.073 1.00 33.43 H new ATOM 0 HB2 PRO A 192 4.071 -6.426 7.634 1.00 61.24 H new ATOM 0 HB3 PRO A 192 3.590 -5.494 6.230 1.00 61.24 H new ATOM 0 HG2 PRO A 192 5.112 -4.360 8.089 1.00 14.43 H new ATOM 0 HG3 PRO A 192 3.825 -3.432 7.345 1.00 14.43 H new ATOM 0 HD2 PRO A 192 3.914 -4.677 10.085 1.00 45.34 H new ATOM 0 HD3 PRO A 192 3.169 -3.173 9.583 1.00 45.34 H new ATOM 769 N GLU A 193 2.094 -7.809 8.867 1.00 2.30 N ATOM 770 CA GLU A 193 1.764 -9.233 9.067 1.00 3.52 C ATOM 771 C GLU A 193 0.248 -9.468 9.262 1.00 53.45 C ATOM 772 O GLU A 193 -0.250 -10.576 9.048 1.00 4.34 O ATOM 773 CB GLU A 193 2.541 -9.769 10.279 1.00 13.24 C ATOM 774 CG GLU A 193 2.233 -9.030 11.580 1.00 11.51 C ATOM 775 CD GLU A 193 3.184 -9.395 12.712 1.00 11.02 C ATOM 776 OE1 GLU A 193 2.934 -10.402 13.408 1.00 52.11 O ATOM 777 OE2 GLU A 193 4.184 -8.672 12.907 1.00 23.24 O ATOM 0 H GLU A 193 2.739 -7.430 9.561 1.00 2.30 H new ATOM 0 HA GLU A 193 2.054 -9.771 8.164 1.00 3.52 H new ATOM 0 HB2 GLU A 193 2.311 -10.826 10.409 1.00 13.24 H new ATOM 0 HB3 GLU A 193 3.609 -9.698 10.075 1.00 13.24 H new ATOM 0 HG2 GLU A 193 2.284 -7.956 11.402 1.00 11.51 H new ATOM 0 HG3 GLU A 193 1.211 -9.254 11.885 1.00 11.51 H new ATOM 784 N CYS A 194 -0.473 -8.422 9.667 1.00 10.01 N ATOM 785 CA CYS A 194 -1.925 -8.509 9.908 1.00 10.14 C ATOM 786 C CYS A 194 -2.740 -7.926 8.739 1.00 21.45 C ATOM 787 O CYS A 194 -3.954 -8.123 8.652 1.00 33.41 O ATOM 788 CB CYS A 194 -2.281 -7.768 11.205 1.00 64.42 C ATOM 789 SG CYS A 194 -4.053 -7.624 11.531 1.00 53.14 S ATOM 0 H CYS A 194 -0.078 -7.497 9.838 1.00 10.01 H new ATOM 0 HA CYS A 194 -2.182 -9.565 9.998 1.00 10.14 H new ATOM 0 HB2 CYS A 194 -1.812 -8.284 12.043 1.00 64.42 H new ATOM 0 HB3 CYS A 194 -1.850 -6.768 11.166 1.00 64.42 H new ATOM 0 HG CYS A 194 -4.716 -7.864 10.439 1.00 53.14 H new ATOM 795 N CYS A 195 -2.070 -7.217 7.833 1.00 40.21 N ATOM 796 CA CYS A 195 -2.753 -6.530 6.727 1.00 4.31 C ATOM 797 C CYS A 195 -2.281 -7.038 5.355 1.00 14.20 C ATOM 798 O CYS A 195 -1.245 -7.694 5.240 1.00 12.24 O ATOM 799 CB CYS A 195 -2.525 -5.018 6.831 1.00 41.05 C ATOM 800 SG CYS A 195 -3.107 -4.291 8.384 1.00 44.42 S ATOM 0 H CYS A 195 -1.057 -7.100 7.838 1.00 40.21 H new ATOM 0 HA CYS A 195 -3.818 -6.748 6.811 1.00 4.31 H new ATOM 0 HB2 CYS A 195 -1.460 -4.813 6.722 1.00 41.05 H new ATOM 0 HB3 CYS A 195 -3.030 -4.527 6.000 1.00 41.05 H new ATOM 0 HG CYS A 195 -2.232 -4.511 9.320 1.00 44.42 H new ATOM 806 N ALA A 196 -3.047 -6.725 4.311 1.00 31.10 N ATOM 807 CA ALA A 196 -2.716 -7.160 2.947 1.00 62.44 C ATOM 808 C ALA A 196 -2.896 -6.028 1.925 1.00 53.12 C ATOM 809 O ALA A 196 -3.910 -5.328 1.937 1.00 62.11 O ATOM 810 CB ALA A 196 -3.577 -8.356 2.558 1.00 74.13 C ATOM 0 H ALA A 196 -3.902 -6.172 4.379 1.00 31.10 H new ATOM 0 HA ALA A 196 -1.665 -7.448 2.938 1.00 62.44 H new ATOM 0 HB1 ALA A 196 -3.325 -8.672 1.546 1.00 74.13 H new ATOM 0 HB2 ALA A 196 -3.393 -9.177 3.251 1.00 74.13 H new ATOM 0 HB3 ALA A 196 -4.629 -8.075 2.599 1.00 74.13 H new ATOM 816 N VAL A 197 -1.909 -5.856 1.044 1.00 31.43 N ATOM 817 CA VAL A 197 -1.986 -4.861 -0.034 1.00 41.43 C ATOM 818 C VAL A 197 -2.407 -5.520 -1.356 1.00 72.11 C ATOM 819 O VAL A 197 -1.950 -6.613 -1.687 1.00 15.31 O ATOM 820 CB VAL A 197 -0.623 -4.148 -0.243 1.00 52.15 C ATOM 821 CG1 VAL A 197 -0.707 -3.123 -1.374 1.00 2.13 C ATOM 822 CG2 VAL A 197 -0.153 -3.482 1.047 1.00 12.22 C ATOM 0 H VAL A 197 -1.042 -6.394 1.054 1.00 31.43 H new ATOM 0 HA VAL A 197 -2.733 -4.125 0.264 1.00 41.43 H new ATOM 0 HB VAL A 197 0.108 -4.906 -0.524 1.00 52.15 H new ATOM 0 HG11 VAL A 197 0.261 -2.639 -1.499 1.00 2.13 H new ATOM 0 HG12 VAL A 197 -0.983 -3.626 -2.301 1.00 2.13 H new ATOM 0 HG13 VAL A 197 -1.459 -2.373 -1.130 1.00 2.13 H new ATOM 0 HG21 VAL A 197 0.804 -2.989 0.874 1.00 12.22 H new ATOM 0 HG22 VAL A 197 -0.889 -2.744 1.364 1.00 12.22 H new ATOM 0 HG23 VAL A 197 -0.037 -4.237 1.825 1.00 12.22 H new ATOM 832 N TYR A 198 -3.284 -4.859 -2.108 1.00 24.25 N ATOM 833 CA TYR A 198 -3.698 -5.358 -3.424 1.00 62.44 C ATOM 834 C TYR A 198 -4.154 -4.218 -4.347 1.00 62.41 C ATOM 835 O TYR A 198 -4.520 -3.131 -3.888 1.00 41.34 O ATOM 836 CB TYR A 198 -4.820 -6.400 -3.283 1.00 11.11 C ATOM 837 CG TYR A 198 -6.070 -5.881 -2.597 1.00 15.23 C ATOM 838 CD1 TYR A 198 -7.089 -5.274 -3.325 1.00 14.24 C ATOM 839 CD2 TYR A 198 -6.229 -5.994 -1.220 1.00 71.35 C ATOM 840 CE1 TYR A 198 -8.228 -4.800 -2.702 1.00 71.23 C ATOM 841 CE2 TYR A 198 -7.364 -5.523 -0.593 1.00 61.44 C ATOM 842 CZ TYR A 198 -8.360 -4.926 -1.336 1.00 42.13 C ATOM 843 OH TYR A 198 -9.490 -4.445 -0.710 1.00 32.03 O ATOM 0 H TYR A 198 -3.722 -3.980 -1.833 1.00 24.25 H new ATOM 0 HA TYR A 198 -2.827 -5.831 -3.878 1.00 62.44 H new ATOM 0 HB2 TYR A 198 -5.088 -6.765 -4.275 1.00 11.11 H new ATOM 0 HB3 TYR A 198 -4.439 -7.253 -2.722 1.00 11.11 H new ATOM 0 HD1 TYR A 198 -6.988 -5.172 -4.395 1.00 14.24 H new ATOM 0 HD2 TYR A 198 -5.451 -6.458 -0.632 1.00 71.35 H new ATOM 0 HE1 TYR A 198 -9.010 -4.333 -3.282 1.00 71.23 H new ATOM 0 HE2 TYR A 198 -7.472 -5.622 0.477 1.00 61.44 H new ATOM 0 HH TYR A 198 -9.861 -5.139 -0.127 1.00 32.03 H new ATOM 853 N ARG A 199 -4.129 -4.481 -5.649 1.00 52.10 N ATOM 854 CA ARG A 199 -4.602 -3.522 -6.655 1.00 21.13 C ATOM 855 C ARG A 199 -5.906 -4.027 -7.295 1.00 11.32 C ATOM 856 O ARG A 199 -6.160 -5.234 -7.321 1.00 35.34 O ATOM 857 CB ARG A 199 -3.527 -3.320 -7.735 1.00 31.03 C ATOM 858 CG ARG A 199 -3.309 -4.545 -8.622 1.00 32.43 C ATOM 859 CD ARG A 199 -2.098 -4.394 -9.536 1.00 24.32 C ATOM 860 NE ARG A 199 -2.106 -3.133 -10.272 1.00 22.20 N ATOM 861 CZ ARG A 199 -2.613 -2.966 -11.462 1.00 53.24 C ATOM 862 NH1 ARG A 199 -3.228 -3.936 -12.068 1.00 12.21 N ATOM 863 NH2 ARG A 199 -2.505 -1.814 -12.040 1.00 64.33 N ATOM 0 H ARG A 199 -3.784 -5.357 -6.040 1.00 52.10 H new ATOM 0 HA ARG A 199 -4.797 -2.567 -6.168 1.00 21.13 H new ATOM 0 HB2 ARG A 199 -3.809 -2.474 -8.362 1.00 31.03 H new ATOM 0 HB3 ARG A 199 -2.585 -3.059 -7.253 1.00 31.03 H new ATOM 0 HG2 ARG A 199 -3.179 -5.426 -7.994 1.00 32.43 H new ATOM 0 HG3 ARG A 199 -4.199 -4.714 -9.228 1.00 32.43 H new ATOM 0 HD2 ARG A 199 -1.187 -4.457 -8.940 1.00 24.32 H new ATOM 0 HD3 ARG A 199 -2.075 -5.223 -10.243 1.00 24.32 H new ATOM 0 HE ARG A 199 -1.683 -2.321 -9.821 1.00 22.20 H new ATOM 0 HH11 ARG A 199 -3.320 -4.844 -11.613 1.00 12.21 H new ATOM 0 HH12 ARG A 199 -3.619 -3.789 -12.999 1.00 12.21 H new ATOM 0 HH21 ARG A 199 -2.027 -1.048 -11.565 1.00 64.33 H new ATOM 0 HH22 ARG A 199 -2.898 -1.672 -12.971 1.00 64.33 H new ATOM 877 N ILE A 200 -6.732 -3.115 -7.804 1.00 41.25 N ATOM 878 CA ILE A 200 -8.009 -3.494 -8.433 1.00 1.12 C ATOM 879 C ILE A 200 -8.056 -3.078 -9.912 1.00 5.33 C ATOM 880 O ILE A 200 -7.936 -1.897 -10.243 1.00 54.05 O ATOM 881 CB ILE A 200 -9.218 -2.870 -7.683 1.00 41.44 C ATOM 882 CG1 ILE A 200 -9.218 -3.314 -6.209 1.00 31.31 C ATOM 883 CG2 ILE A 200 -10.535 -3.261 -8.359 1.00 64.23 C ATOM 884 CD1 ILE A 200 -10.370 -2.758 -5.391 1.00 5.23 C ATOM 0 H ILE A 200 -6.547 -2.112 -7.797 1.00 41.25 H new ATOM 0 HA ILE A 200 -8.077 -4.580 -8.372 1.00 1.12 H new ATOM 0 HB ILE A 200 -9.124 -1.785 -7.721 1.00 41.44 H new ATOM 0 HG12 ILE A 200 -9.251 -4.403 -6.169 1.00 31.31 H new ATOM 0 HG13 ILE A 200 -8.279 -3.007 -5.749 1.00 31.31 H new ATOM 0 HG21 ILE A 200 -11.369 -2.814 -7.818 1.00 64.23 H new ATOM 0 HG22 ILE A 200 -10.536 -2.902 -9.388 1.00 64.23 H new ATOM 0 HG23 ILE A 200 -10.639 -4.346 -8.353 1.00 64.23 H new ATOM 0 HD11 ILE A 200 -10.295 -3.119 -4.365 1.00 5.23 H new ATOM 0 HD12 ILE A 200 -10.328 -1.669 -5.396 1.00 5.23 H new ATOM 0 HD13 ILE A 200 -11.315 -3.087 -5.823 1.00 5.23 H new ATOM 896 N GLN A 201 -8.233 -4.057 -10.798 1.00 0.42 N ATOM 897 CA GLN A 201 -8.307 -3.793 -12.239 1.00 55.33 C ATOM 898 C GLN A 201 -9.103 -4.892 -12.961 1.00 34.44 C ATOM 899 O GLN A 201 -9.048 -6.064 -12.581 1.00 64.32 O ATOM 900 CB GLN A 201 -6.897 -3.671 -12.834 1.00 31.43 C ATOM 901 CG GLN A 201 -6.884 -3.275 -14.309 1.00 4.21 C ATOM 902 CD GLN A 201 -5.484 -3.060 -14.856 1.00 40.20 C ATOM 903 OE1 GLN A 201 -4.521 -3.670 -14.405 1.00 63.31 O ATOM 904 NE2 GLN A 201 -5.360 -2.201 -15.842 1.00 12.35 N ATOM 0 H GLN A 201 -8.328 -5.041 -10.546 1.00 0.42 H new ATOM 0 HA GLN A 201 -8.830 -2.848 -12.384 1.00 55.33 H new ATOM 0 HB2 GLN A 201 -6.335 -2.932 -12.264 1.00 31.43 H new ATOM 0 HB3 GLN A 201 -6.380 -4.624 -12.718 1.00 31.43 H new ATOM 0 HG2 GLN A 201 -7.380 -4.051 -14.892 1.00 4.21 H new ATOM 0 HG3 GLN A 201 -7.463 -2.360 -14.439 1.00 4.21 H new ATOM 0 HE21 GLN A 201 -6.180 -1.709 -16.196 1.00 12.35 H new ATOM 0 HE22 GLN A 201 -4.443 -2.026 -16.254 1.00 12.35 H new ATOM 913 N ASP A 202 -9.859 -4.498 -13.991 1.00 65.22 N ATOM 914 CA ASP A 202 -10.723 -5.426 -14.739 1.00 21.24 C ATOM 915 C ASP A 202 -11.726 -6.128 -13.806 1.00 5.45 C ATOM 916 O ASP A 202 -12.130 -7.268 -14.041 1.00 70.15 O ATOM 917 CB ASP A 202 -9.876 -6.452 -15.512 1.00 0.34 C ATOM 918 CG ASP A 202 -9.001 -5.793 -16.567 1.00 63.22 C ATOM 919 OD1 ASP A 202 -9.556 -5.237 -17.546 1.00 53.44 O ATOM 920 OD2 ASP A 202 -7.760 -5.819 -16.426 1.00 32.42 O ATOM 0 H ASP A 202 -9.892 -3.536 -14.330 1.00 65.22 H new ATOM 0 HA ASP A 202 -11.296 -4.845 -15.461 1.00 21.24 H new ATOM 0 HB2 ASP A 202 -9.247 -7.003 -14.813 1.00 0.34 H new ATOM 0 HB3 ASP A 202 -10.534 -7.178 -15.989 1.00 0.34 H new ATOM 925 N GLY A 203 -12.132 -5.421 -12.750 1.00 25.55 N ATOM 926 CA GLY A 203 -13.090 -5.965 -11.791 1.00 41.42 C ATOM 927 C GLY A 203 -12.454 -6.847 -10.715 1.00 1.44 C ATOM 928 O GLY A 203 -13.045 -7.061 -9.655 1.00 42.04 O ATOM 0 H GLY A 203 -11.813 -4.475 -12.539 1.00 25.55 H new ATOM 0 HA2 GLY A 203 -13.615 -5.140 -11.308 1.00 41.42 H new ATOM 0 HA3 GLY A 203 -13.838 -6.547 -12.329 1.00 41.42 H new ATOM 932 N GLU A 204 -11.246 -7.349 -10.972 1.00 33.24 N ATOM 933 CA GLU A 204 -10.584 -8.286 -10.052 1.00 65.33 C ATOM 934 C GLU A 204 -9.517 -7.608 -9.181 1.00 32.10 C ATOM 935 O GLU A 204 -9.151 -6.450 -9.393 1.00 11.44 O ATOM 936 CB GLU A 204 -9.950 -9.442 -10.835 1.00 2.54 C ATOM 937 CG GLU A 204 -10.962 -10.307 -11.574 1.00 65.21 C ATOM 938 CD GLU A 204 -10.332 -11.549 -12.182 1.00 61.34 C ATOM 939 OE1 GLU A 204 -10.056 -12.506 -11.427 1.00 43.43 O ATOM 940 OE2 GLU A 204 -10.121 -11.577 -13.409 1.00 5.41 O ATOM 0 H GLU A 204 -10.704 -7.126 -11.806 1.00 33.24 H new ATOM 0 HA GLU A 204 -11.357 -8.667 -9.384 1.00 65.33 H new ATOM 0 HB2 GLU A 204 -9.239 -9.035 -11.554 1.00 2.54 H new ATOM 0 HB3 GLU A 204 -9.384 -10.069 -10.146 1.00 2.54 H new ATOM 0 HG2 GLU A 204 -11.752 -10.605 -10.885 1.00 65.21 H new ATOM 0 HG3 GLU A 204 -11.431 -9.718 -12.362 1.00 65.21 H new ATOM 947 N LYS A 205 -9.027 -8.358 -8.191 1.00 63.31 N ATOM 948 CA LYS A 205 -7.975 -7.887 -7.285 1.00 60.13 C ATOM 949 C LYS A 205 -6.677 -8.689 -7.485 1.00 73.31 C ATOM 950 O LYS A 205 -6.710 -9.905 -7.674 1.00 31.14 O ATOM 951 CB LYS A 205 -8.432 -8.027 -5.826 1.00 11.11 C ATOM 952 CG LYS A 205 -9.695 -7.241 -5.486 1.00 4.11 C ATOM 953 CD LYS A 205 -10.128 -7.475 -4.039 1.00 51.24 C ATOM 954 CE LYS A 205 -11.367 -6.662 -3.675 1.00 62.31 C ATOM 955 NZ LYS A 205 -12.565 -7.083 -4.448 1.00 52.25 N ATOM 0 H LYS A 205 -9.347 -9.306 -7.995 1.00 63.31 H new ATOM 0 HA LYS A 205 -7.782 -6.839 -7.512 1.00 60.13 H new ATOM 0 HB2 LYS A 205 -8.605 -9.081 -5.611 1.00 11.11 H new ATOM 0 HB3 LYS A 205 -7.625 -7.697 -5.171 1.00 11.11 H new ATOM 0 HG2 LYS A 205 -9.517 -6.178 -5.646 1.00 4.11 H new ATOM 0 HG3 LYS A 205 -10.500 -7.535 -6.160 1.00 4.11 H new ATOM 0 HD2 LYS A 205 -10.333 -8.535 -3.889 1.00 51.24 H new ATOM 0 HD3 LYS A 205 -9.311 -7.210 -3.368 1.00 51.24 H new ATOM 0 HE2 LYS A 205 -11.569 -6.769 -2.609 1.00 62.31 H new ATOM 0 HE3 LYS A 205 -11.172 -5.605 -3.858 1.00 62.31 H new ATOM 0 HZ1 LYS A 205 -13.404 -6.587 -4.085 1.00 52.25 H new ATOM 0 HZ2 LYS A 205 -12.431 -6.847 -5.452 1.00 52.25 H new ATOM 0 HZ3 LYS A 205 -12.699 -8.109 -4.348 1.00 52.25 H new ATOM 969 N LYS A 206 -5.539 -8.001 -7.451 1.00 62.32 N ATOM 970 CA LYS A 206 -4.229 -8.666 -7.485 1.00 72.22 C ATOM 971 C LYS A 206 -3.474 -8.441 -6.165 1.00 71.22 C ATOM 972 O LYS A 206 -2.982 -7.339 -5.908 1.00 12.02 O ATOM 973 CB LYS A 206 -3.384 -8.158 -8.665 1.00 1.34 C ATOM 974 CG LYS A 206 -2.003 -8.808 -8.750 1.00 55.55 C ATOM 975 CD LYS A 206 -1.180 -8.262 -9.915 1.00 70.24 C ATOM 976 CE LYS A 206 0.226 -8.854 -9.936 1.00 33.31 C ATOM 977 NZ LYS A 206 1.044 -8.318 -11.056 1.00 4.51 N ATOM 0 H LYS A 206 -5.492 -6.983 -7.400 1.00 62.32 H new ATOM 0 HA LYS A 206 -4.401 -9.734 -7.617 1.00 72.22 H new ATOM 0 HB2 LYS A 206 -3.922 -8.345 -9.594 1.00 1.34 H new ATOM 0 HB3 LYS A 206 -3.264 -7.078 -8.577 1.00 1.34 H new ATOM 0 HG2 LYS A 206 -1.466 -8.639 -7.817 1.00 55.55 H new ATOM 0 HG3 LYS A 206 -2.117 -9.886 -8.862 1.00 55.55 H new ATOM 0 HD2 LYS A 206 -1.684 -8.488 -10.855 1.00 70.24 H new ATOM 0 HD3 LYS A 206 -1.117 -7.176 -9.840 1.00 70.24 H new ATOM 0 HE2 LYS A 206 0.723 -8.639 -8.990 1.00 33.31 H new ATOM 0 HE3 LYS A 206 0.161 -9.939 -10.023 1.00 33.31 H new ATOM 0 HZ1 LYS A 206 1.991 -8.748 -11.031 1.00 4.51 H new ATOM 0 HZ2 LYS A 206 0.585 -8.545 -11.961 1.00 4.51 H new ATOM 0 HZ3 LYS A 206 1.130 -7.286 -10.960 1.00 4.51 H new ATOM 991 N PRO A 207 -3.396 -9.475 -5.300 1.00 62.31 N ATOM 992 CA PRO A 207 -2.676 -9.389 -4.014 1.00 10.24 C ATOM 993 C PRO A 207 -1.174 -9.112 -4.200 1.00 42.54 C ATOM 994 O PRO A 207 -0.435 -9.948 -4.727 1.00 31.03 O ATOM 995 CB PRO A 207 -2.907 -10.772 -3.371 1.00 54.41 C ATOM 996 CG PRO A 207 -4.082 -11.346 -4.094 1.00 63.55 C ATOM 997 CD PRO A 207 -4.008 -10.804 -5.494 1.00 64.44 C ATOM 0 HA PRO A 207 -3.037 -8.563 -3.401 1.00 10.24 H new ATOM 0 HB2 PRO A 207 -2.029 -11.408 -3.479 1.00 54.41 H new ATOM 0 HB3 PRO A 207 -3.107 -10.682 -2.303 1.00 54.41 H new ATOM 0 HG2 PRO A 207 -4.047 -12.435 -4.094 1.00 63.55 H new ATOM 0 HG3 PRO A 207 -5.016 -11.058 -3.612 1.00 63.55 H new ATOM 0 HD2 PRO A 207 -3.402 -11.438 -6.141 1.00 64.44 H new ATOM 0 HD3 PRO A 207 -4.994 -10.732 -5.952 1.00 64.44 H new ATOM 1005 N ILE A 208 -0.733 -7.934 -3.765 1.00 20.43 N ATOM 1006 CA ILE A 208 0.655 -7.496 -3.947 1.00 41.34 C ATOM 1007 C ILE A 208 1.506 -7.775 -2.696 1.00 12.41 C ATOM 1008 O ILE A 208 1.087 -7.497 -1.572 1.00 50.11 O ATOM 1009 CB ILE A 208 0.711 -5.980 -4.274 1.00 4.32 C ATOM 1010 CG1 ILE A 208 -0.179 -5.671 -5.492 1.00 62.33 C ATOM 1011 CG2 ILE A 208 2.152 -5.525 -4.523 1.00 5.31 C ATOM 1012 CD1 ILE A 208 -0.293 -4.196 -5.817 1.00 72.43 C ATOM 0 H ILE A 208 -1.321 -7.257 -3.279 1.00 20.43 H new ATOM 0 HA ILE A 208 1.065 -8.066 -4.781 1.00 41.34 H new ATOM 0 HB ILE A 208 0.333 -5.426 -3.415 1.00 4.32 H new ATOM 0 HG12 ILE A 208 0.219 -6.194 -6.361 1.00 62.33 H new ATOM 0 HG13 ILE A 208 -1.177 -6.070 -5.310 1.00 62.33 H new ATOM 0 HG21 ILE A 208 2.163 -4.459 -4.750 1.00 5.31 H new ATOM 0 HG22 ILE A 208 2.752 -5.713 -3.632 1.00 5.31 H new ATOM 0 HG23 ILE A 208 2.568 -6.079 -5.364 1.00 5.31 H new ATOM 0 HD11 ILE A 208 -0.936 -4.064 -6.687 1.00 72.43 H new ATOM 0 HD12 ILE A 208 -0.721 -3.668 -4.965 1.00 72.43 H new ATOM 0 HD13 ILE A 208 0.697 -3.794 -6.033 1.00 72.43 H new ATOM 1024 N GLY A 209 2.703 -8.327 -2.901 1.00 71.22 N ATOM 1025 CA GLY A 209 3.609 -8.597 -1.791 1.00 52.20 C ATOM 1026 C GLY A 209 4.155 -7.326 -1.142 1.00 72.42 C ATOM 1027 O GLY A 209 4.588 -6.404 -1.836 1.00 53.05 O ATOM 0 H GLY A 209 3.062 -8.593 -3.818 1.00 71.22 H new ATOM 0 HA2 GLY A 209 3.086 -9.187 -1.038 1.00 52.20 H new ATOM 0 HA3 GLY A 209 4.442 -9.202 -2.148 1.00 52.20 H new ATOM 1031 N TRP A 210 4.161 -7.290 0.190 1.00 13.24 N ATOM 1032 CA TRP A 210 4.591 -6.104 0.943 1.00 13.53 C ATOM 1033 C TRP A 210 6.008 -5.638 0.560 1.00 42.44 C ATOM 1034 O TRP A 210 6.250 -4.444 0.383 1.00 52.14 O ATOM 1035 CB TRP A 210 4.521 -6.384 2.452 1.00 14.34 C ATOM 1036 CG TRP A 210 3.131 -6.313 3.014 1.00 24.13 C ATOM 1037 CD1 TRP A 210 2.236 -7.337 3.154 1.00 42.30 C ATOM 1038 CD2 TRP A 210 2.483 -5.143 3.519 1.00 22.35 C ATOM 1039 NE1 TRP A 210 1.070 -6.866 3.714 1.00 72.01 N ATOM 1040 CE2 TRP A 210 1.200 -5.523 3.947 1.00 61.32 C ATOM 1041 CE3 TRP A 210 2.871 -3.805 3.650 1.00 40.14 C ATOM 1042 CZ2 TRP A 210 0.300 -4.615 4.498 1.00 1.30 C ATOM 1043 CZ3 TRP A 210 1.979 -2.905 4.196 1.00 65.20 C ATOM 1044 CH2 TRP A 210 0.704 -3.312 4.614 1.00 74.43 C ATOM 0 H TRP A 210 3.871 -8.073 0.777 1.00 13.24 H new ATOM 0 HA TRP A 210 3.907 -5.296 0.683 1.00 13.53 H new ATOM 0 HB2 TRP A 210 4.933 -7.374 2.649 1.00 14.34 H new ATOM 0 HB3 TRP A 210 5.152 -5.666 2.976 1.00 14.34 H new ATOM 0 HD1 TRP A 210 2.417 -8.363 2.868 1.00 42.30 H new ATOM 0 HE1 TRP A 210 0.243 -7.426 3.922 1.00 72.01 H new ATOM 0 HE3 TRP A 210 3.851 -3.483 3.330 1.00 40.14 H new ATOM 0 HZ2 TRP A 210 -0.682 -4.927 4.822 1.00 1.30 H new ATOM 0 HZ3 TRP A 210 2.268 -1.870 4.303 1.00 65.20 H new ATOM 0 HH2 TRP A 210 0.027 -2.583 5.036 1.00 74.43 H new ATOM 1055 N ASP A 211 6.938 -6.577 0.419 1.00 55.32 N ATOM 1056 CA ASP A 211 8.341 -6.240 0.128 1.00 10.35 C ATOM 1057 C ASP A 211 8.603 -6.009 -1.378 1.00 1.03 C ATOM 1058 O ASP A 211 9.724 -6.187 -1.858 1.00 61.44 O ATOM 1059 CB ASP A 211 9.269 -7.325 0.691 1.00 34.31 C ATOM 1060 CG ASP A 211 8.878 -8.720 0.247 1.00 2.13 C ATOM 1061 OD1 ASP A 211 7.886 -9.253 0.780 1.00 32.31 O ATOM 1062 OD2 ASP A 211 9.556 -9.287 -0.633 1.00 2.13 O ATOM 0 H ASP A 211 6.754 -7.577 0.500 1.00 55.32 H new ATOM 0 HA ASP A 211 8.557 -5.292 0.622 1.00 10.35 H new ATOM 0 HB2 ASP A 211 10.292 -7.121 0.375 1.00 34.31 H new ATOM 0 HB3 ASP A 211 9.256 -7.278 1.780 1.00 34.31 H new ATOM 1067 N THR A 212 7.576 -5.573 -2.107 1.00 1.30 N ATOM 1068 CA THR A 212 7.727 -5.183 -3.522 1.00 41.35 C ATOM 1069 C THR A 212 8.008 -3.677 -3.641 1.00 33.42 C ATOM 1070 O THR A 212 7.385 -2.877 -2.946 1.00 43.44 O ATOM 1071 CB THR A 212 6.449 -5.509 -4.340 1.00 42.44 C ATOM 1072 OG1 THR A 212 6.110 -6.897 -4.197 1.00 12.21 O ATOM 1073 CG2 THR A 212 6.637 -5.182 -5.822 1.00 1.34 C ATOM 0 H THR A 212 6.626 -5.478 -1.747 1.00 1.30 H new ATOM 0 HA THR A 212 8.565 -5.754 -3.922 1.00 41.35 H new ATOM 0 HB THR A 212 5.640 -4.891 -3.950 1.00 42.44 H new ATOM 0 HG1 THR A 212 5.550 -7.017 -3.402 1.00 12.21 H new ATOM 0 HG21 THR A 212 5.724 -5.422 -6.366 1.00 1.34 H new ATOM 0 HG22 THR A 212 6.859 -4.121 -5.935 1.00 1.34 H new ATOM 0 HG23 THR A 212 7.463 -5.770 -6.222 1.00 1.34 H new ATOM 1081 N ASP A 213 8.941 -3.291 -4.516 1.00 52.23 N ATOM 1082 CA ASP A 213 9.261 -1.869 -4.728 1.00 74.32 C ATOM 1083 C ASP A 213 8.010 -1.050 -5.093 1.00 21.55 C ATOM 1084 O ASP A 213 7.323 -1.346 -6.071 1.00 3.21 O ATOM 1085 CB ASP A 213 10.311 -1.712 -5.830 1.00 30.45 C ATOM 1086 CG ASP A 213 11.641 -2.337 -5.466 1.00 31.23 C ATOM 1087 OD1 ASP A 213 11.798 -3.557 -5.660 1.00 62.13 O ATOM 1088 OD2 ASP A 213 12.539 -1.609 -4.995 1.00 4.10 O ATOM 0 H ASP A 213 9.487 -3.936 -5.088 1.00 52.23 H new ATOM 0 HA ASP A 213 9.658 -1.487 -3.788 1.00 74.32 H new ATOM 0 HB2 ASP A 213 9.939 -2.168 -6.747 1.00 30.45 H new ATOM 0 HB3 ASP A 213 10.457 -0.652 -6.038 1.00 30.45 H new ATOM 1093 N ILE A 214 7.745 -0.002 -4.313 1.00 42.33 N ATOM 1094 CA ILE A 214 6.574 0.862 -4.525 1.00 3.42 C ATOM 1095 C ILE A 214 6.589 1.510 -5.926 1.00 75.54 C ATOM 1096 O ILE A 214 5.544 1.868 -6.469 1.00 35.51 O ATOM 1097 CB ILE A 214 6.500 1.964 -3.431 1.00 23.42 C ATOM 1098 CG1 ILE A 214 5.192 2.770 -3.542 1.00 51.40 C ATOM 1099 CG2 ILE A 214 7.714 2.892 -3.510 1.00 14.04 C ATOM 1100 CD1 ILE A 214 3.940 1.942 -3.336 1.00 21.34 C ATOM 0 H ILE A 214 8.327 0.274 -3.522 1.00 42.33 H new ATOM 0 HA ILE A 214 5.689 0.230 -4.455 1.00 3.42 H new ATOM 0 HB ILE A 214 6.510 1.470 -2.459 1.00 23.42 H new ATOM 0 HG12 ILE A 214 5.209 3.574 -2.806 1.00 51.40 H new ATOM 0 HG13 ILE A 214 5.148 3.239 -4.525 1.00 51.40 H new ATOM 0 HG21 ILE A 214 7.640 3.655 -2.735 1.00 14.04 H new ATOM 0 HG22 ILE A 214 8.625 2.312 -3.363 1.00 14.04 H new ATOM 0 HG23 ILE A 214 7.743 3.371 -4.489 1.00 14.04 H new ATOM 0 HD11 ILE A 214 3.062 2.581 -3.430 1.00 21.34 H new ATOM 0 HD12 ILE A 214 3.897 1.154 -4.088 1.00 21.34 H new ATOM 0 HD13 ILE A 214 3.959 1.495 -2.342 1.00 21.34 H new ATOM 1112 N SER A 215 7.783 1.633 -6.508 1.00 74.12 N ATOM 1113 CA SER A 215 7.951 2.206 -7.856 1.00 73.14 C ATOM 1114 C SER A 215 7.120 1.456 -8.912 1.00 71.40 C ATOM 1115 O SER A 215 6.668 2.045 -9.895 1.00 23.20 O ATOM 1116 CB SER A 215 9.432 2.186 -8.262 1.00 2.42 C ATOM 1117 OG SER A 215 9.633 2.767 -9.544 1.00 62.31 O ATOM 0 H SER A 215 8.657 1.343 -6.068 1.00 74.12 H new ATOM 0 HA SER A 215 7.592 3.234 -7.814 1.00 73.14 H new ATOM 0 HB2 SER A 215 10.020 2.727 -7.521 1.00 2.42 H new ATOM 0 HB3 SER A 215 9.794 1.158 -8.267 1.00 2.42 H new ATOM 0 HG SER A 215 10.586 2.739 -9.770 1.00 62.31 H new ATOM 1123 N TRP A 216 6.910 0.156 -8.701 1.00 63.04 N ATOM 1124 CA TRP A 216 6.109 -0.662 -9.625 1.00 43.12 C ATOM 1125 C TRP A 216 4.629 -0.243 -9.628 1.00 35.42 C ATOM 1126 O TRP A 216 3.888 -0.550 -10.562 1.00 41.23 O ATOM 1127 CB TRP A 216 6.213 -2.149 -9.246 1.00 4.35 C ATOM 1128 CG TRP A 216 7.557 -2.764 -9.511 1.00 14.44 C ATOM 1129 CD1 TRP A 216 8.753 -2.401 -8.962 1.00 73.02 C ATOM 1130 CD2 TRP A 216 7.835 -3.868 -10.378 1.00 33.53 C ATOM 1131 NE1 TRP A 216 9.757 -3.206 -9.442 1.00 55.31 N ATOM 1132 CE2 TRP A 216 9.219 -4.114 -10.313 1.00 33.25 C ATOM 1133 CE3 TRP A 216 7.048 -4.671 -11.207 1.00 71.52 C ATOM 1134 CZ2 TRP A 216 9.831 -5.125 -11.044 1.00 3.53 C ATOM 1135 CZ3 TRP A 216 7.656 -5.679 -11.931 1.00 2.01 C ATOM 1136 CH2 TRP A 216 9.037 -5.898 -11.847 1.00 1.42 C ATOM 0 H TRP A 216 7.281 -0.356 -7.901 1.00 63.04 H new ATOM 0 HA TRP A 216 6.511 -0.503 -10.626 1.00 43.12 H new ATOM 0 HB2 TRP A 216 5.979 -2.259 -8.187 1.00 4.35 H new ATOM 0 HB3 TRP A 216 5.457 -2.706 -9.799 1.00 4.35 H new ATOM 0 HD1 TRP A 216 8.890 -1.598 -8.253 1.00 73.02 H new ATOM 0 HE1 TRP A 216 10.743 -3.138 -9.190 1.00 55.31 H new ATOM 0 HE3 TRP A 216 5.983 -4.507 -11.281 1.00 71.52 H new ATOM 0 HZ2 TRP A 216 10.896 -5.295 -10.981 1.00 3.53 H new ATOM 0 HZ3 TRP A 216 7.057 -6.308 -12.572 1.00 2.01 H new ATOM 0 HH2 TRP A 216 9.484 -6.692 -12.427 1.00 1.42 H new ATOM 1147 N LEU A 217 4.209 0.463 -8.582 1.00 12.34 N ATOM 1148 CA LEU A 217 2.793 0.804 -8.381 1.00 10.11 C ATOM 1149 C LEU A 217 2.558 2.325 -8.454 1.00 42.02 C ATOM 1150 O LEU A 217 1.537 2.836 -7.989 1.00 41.41 O ATOM 1151 CB LEU A 217 2.344 0.251 -7.021 1.00 72.23 C ATOM 1152 CG LEU A 217 2.653 -1.243 -6.806 1.00 60.40 C ATOM 1153 CD1 LEU A 217 2.318 -1.674 -5.383 1.00 12.24 C ATOM 1154 CD2 LEU A 217 1.901 -2.105 -7.821 1.00 12.50 C ATOM 0 H LEU A 217 4.829 0.815 -7.853 1.00 12.34 H new ATOM 0 HA LEU A 217 2.203 0.354 -9.180 1.00 10.11 H new ATOM 0 HB2 LEU A 217 2.827 0.826 -6.231 1.00 72.23 H new ATOM 0 HB3 LEU A 217 1.270 0.406 -6.917 1.00 72.23 H new ATOM 0 HG LEU A 217 3.722 -1.388 -6.959 1.00 60.40 H new ATOM 0 HD11 LEU A 217 2.546 -2.733 -5.260 1.00 12.24 H new ATOM 0 HD12 LEU A 217 2.910 -1.091 -4.677 1.00 12.24 H new ATOM 0 HD13 LEU A 217 1.258 -1.507 -5.192 1.00 12.24 H new ATOM 0 HD21 LEU A 217 2.135 -3.156 -7.650 1.00 12.50 H new ATOM 0 HD22 LEU A 217 0.828 -1.949 -7.707 1.00 12.50 H new ATOM 0 HD23 LEU A 217 2.203 -1.826 -8.830 1.00 12.50 H new ATOM 1166 N THR A 218 3.507 3.038 -9.054 1.00 73.01 N ATOM 1167 CA THR A 218 3.429 4.501 -9.181 1.00 72.43 C ATOM 1168 C THR A 218 2.204 4.959 -9.997 1.00 45.21 C ATOM 1169 O THR A 218 1.930 4.430 -11.079 1.00 4.43 O ATOM 1170 CB THR A 218 4.709 5.067 -9.846 1.00 3.52 C ATOM 1171 OG1 THR A 218 5.864 4.678 -9.091 1.00 63.11 O ATOM 1172 CG2 THR A 218 4.660 6.591 -9.945 1.00 65.12 C ATOM 0 H THR A 218 4.346 2.629 -9.464 1.00 73.01 H new ATOM 0 HA THR A 218 3.331 4.888 -8.167 1.00 72.43 H new ATOM 0 HB THR A 218 4.768 4.659 -10.855 1.00 3.52 H new ATOM 0 HG1 THR A 218 6.190 3.813 -9.415 1.00 63.11 H new ATOM 0 HG21 THR A 218 5.573 6.955 -10.416 1.00 65.12 H new ATOM 0 HG22 THR A 218 3.799 6.889 -10.544 1.00 65.12 H new ATOM 0 HG23 THR A 218 4.573 7.018 -8.946 1.00 65.12 H new ATOM 1180 N GLY A 219 1.467 5.937 -9.467 1.00 74.42 N ATOM 1181 CA GLY A 219 0.376 6.560 -10.218 1.00 32.41 C ATOM 1182 C GLY A 219 -1.001 5.941 -9.977 1.00 44.11 C ATOM 1183 O GLY A 219 -2.022 6.591 -10.205 1.00 65.15 O ATOM 0 H GLY A 219 1.604 6.312 -8.528 1.00 74.42 H new ATOM 0 HA2 GLY A 219 0.334 7.618 -9.960 1.00 32.41 H new ATOM 0 HA3 GLY A 219 0.605 6.500 -11.282 1.00 32.41 H new ATOM 1187 N GLU A 220 -1.046 4.692 -9.517 1.00 62.40 N ATOM 1188 CA GLU A 220 -2.324 3.986 -9.335 1.00 64.40 C ATOM 1189 C GLU A 220 -2.785 3.963 -7.868 1.00 32.14 C ATOM 1190 O GLU A 220 -2.065 4.395 -6.962 1.00 74.04 O ATOM 1191 CB GLU A 220 -2.237 2.559 -9.900 1.00 11.02 C ATOM 1192 CG GLU A 220 -1.072 1.739 -9.367 1.00 32.12 C ATOM 1193 CD GLU A 220 -0.971 0.379 -10.037 1.00 55.31 C ATOM 1194 OE1 GLU A 220 -0.717 0.333 -11.264 1.00 61.05 O ATOM 1195 OE2 GLU A 220 -1.168 -0.645 -9.356 1.00 62.10 O ATOM 0 H GLU A 220 -0.222 4.147 -9.264 1.00 62.40 H new ATOM 0 HA GLU A 220 -3.077 4.544 -9.892 1.00 64.40 H new ATOM 0 HB2 GLU A 220 -3.166 2.036 -9.675 1.00 11.02 H new ATOM 0 HB3 GLU A 220 -2.158 2.616 -10.986 1.00 11.02 H new ATOM 0 HG2 GLU A 220 -0.143 2.288 -9.522 1.00 32.12 H new ATOM 0 HG3 GLU A 220 -1.187 1.604 -8.292 1.00 32.12 H new ATOM 1202 N GLU A 221 -4.005 3.472 -7.652 1.00 31.24 N ATOM 1203 CA GLU A 221 -4.626 3.453 -6.324 1.00 34.14 C ATOM 1204 C GLU A 221 -4.646 2.037 -5.724 1.00 44.22 C ATOM 1205 O GLU A 221 -5.324 1.141 -6.234 1.00 23.33 O ATOM 1206 CB GLU A 221 -6.055 4.011 -6.421 1.00 54.50 C ATOM 1207 CG GLU A 221 -6.109 5.453 -6.918 1.00 63.20 C ATOM 1208 CD GLU A 221 -7.526 5.969 -7.108 1.00 72.54 C ATOM 1209 OE1 GLU A 221 -8.077 5.802 -8.218 1.00 32.20 O ATOM 1210 OE2 GLU A 221 -8.092 6.552 -6.159 1.00 11.43 O ATOM 0 H GLU A 221 -4.590 3.077 -8.388 1.00 31.24 H new ATOM 0 HA GLU A 221 -4.030 4.078 -5.659 1.00 34.14 H new ATOM 0 HB2 GLU A 221 -6.639 3.381 -7.092 1.00 54.50 H new ATOM 0 HB3 GLU A 221 -6.527 3.954 -5.440 1.00 54.50 H new ATOM 0 HG2 GLU A 221 -5.588 6.095 -6.208 1.00 63.20 H new ATOM 0 HG3 GLU A 221 -5.573 5.524 -7.865 1.00 63.20 H new ATOM 1217 N LEU A 222 -3.910 1.852 -4.630 1.00 32.43 N ATOM 1218 CA LEU A 222 -3.818 0.552 -3.951 1.00 63.53 C ATOM 1219 C LEU A 222 -4.842 0.444 -2.813 1.00 21.30 C ATOM 1220 O LEU A 222 -5.407 1.441 -2.370 1.00 72.24 O ATOM 1221 CB LEU A 222 -2.404 0.357 -3.381 1.00 65.44 C ATOM 1222 CG LEU A 222 -1.259 0.492 -4.394 1.00 75.54 C ATOM 1223 CD1 LEU A 222 0.092 0.373 -3.694 1.00 45.44 C ATOM 1224 CD2 LEU A 222 -1.391 -0.551 -5.504 1.00 21.30 C ATOM 0 H LEU A 222 -3.362 2.591 -4.188 1.00 32.43 H new ATOM 0 HA LEU A 222 -4.033 -0.224 -4.685 1.00 63.53 H new ATOM 0 HB2 LEU A 222 -2.249 1.085 -2.584 1.00 65.44 H new ATOM 0 HB3 LEU A 222 -2.348 -0.632 -2.925 1.00 65.44 H new ATOM 0 HG LEU A 222 -1.320 1.480 -4.851 1.00 75.54 H new ATOM 0 HD11 LEU A 222 0.892 0.471 -4.428 1.00 45.44 H new ATOM 0 HD12 LEU A 222 0.186 1.162 -2.947 1.00 45.44 H new ATOM 0 HD13 LEU A 222 0.165 -0.599 -3.206 1.00 45.44 H new ATOM 0 HD21 LEU A 222 -0.569 -0.437 -6.210 1.00 21.30 H new ATOM 0 HD22 LEU A 222 -1.360 -1.550 -5.070 1.00 21.30 H new ATOM 0 HD23 LEU A 222 -2.339 -0.411 -6.024 1.00 21.30 H new ATOM 1236 N HIS A 223 -5.081 -0.775 -2.339 1.00 42.32 N ATOM 1237 CA HIS A 223 -5.983 -1.004 -1.204 1.00 64.35 C ATOM 1238 C HIS A 223 -5.345 -1.924 -0.157 1.00 31.52 C ATOM 1239 O HIS A 223 -4.686 -2.907 -0.498 1.00 42.52 O ATOM 1240 CB HIS A 223 -7.314 -1.598 -1.682 1.00 41.11 C ATOM 1241 CG HIS A 223 -8.216 -0.608 -2.358 1.00 63.15 C ATOM 1242 ND1 HIS A 223 -9.264 0.009 -1.712 1.00 10.43 N ATOM 1243 CD2 HIS A 223 -8.236 -0.139 -3.630 1.00 14.23 C ATOM 1244 CE1 HIS A 223 -9.888 0.811 -2.550 1.00 1.21 C ATOM 1245 NE2 HIS A 223 -9.286 0.743 -3.719 1.00 12.00 N ATOM 0 H HIS A 223 -4.664 -1.624 -2.721 1.00 42.32 H new ATOM 0 HA HIS A 223 -6.173 -0.038 -0.737 1.00 64.35 H new ATOM 0 HB2 HIS A 223 -7.108 -2.416 -2.372 1.00 41.11 H new ATOM 0 HB3 HIS A 223 -7.837 -2.026 -0.827 1.00 41.11 H new ATOM 0 HD2 HIS A 223 -7.555 -0.408 -4.424 1.00 14.23 H new ATOM 0 HE1 HIS A 223 -10.748 1.421 -2.318 1.00 1.21 H new ATOM 0 HE2 HIS A 223 -9.555 1.261 -4.555 1.00 12.00 H new ATOM 1254 N VAL A 224 -5.545 -1.590 1.116 1.00 42.31 N ATOM 1255 CA VAL A 224 -5.014 -2.383 2.229 1.00 24.15 C ATOM 1256 C VAL A 224 -6.146 -2.831 3.167 1.00 63.05 C ATOM 1257 O VAL A 224 -6.932 -2.011 3.639 1.00 15.54 O ATOM 1258 CB VAL A 224 -3.970 -1.579 3.048 1.00 0.20 C ATOM 1259 CG1 VAL A 224 -3.360 -2.438 4.154 1.00 33.44 C ATOM 1260 CG2 VAL A 224 -2.884 -1.017 2.135 1.00 24.55 C ATOM 0 H VAL A 224 -6.075 -0.769 1.407 1.00 42.31 H new ATOM 0 HA VAL A 224 -4.529 -3.258 1.797 1.00 24.15 H new ATOM 0 HB VAL A 224 -4.485 -0.742 3.520 1.00 0.20 H new ATOM 0 HG11 VAL A 224 -2.632 -1.849 4.712 1.00 33.44 H new ATOM 0 HG12 VAL A 224 -4.147 -2.776 4.828 1.00 33.44 H new ATOM 0 HG13 VAL A 224 -2.865 -3.303 3.712 1.00 33.44 H new ATOM 0 HG21 VAL A 224 -2.163 -0.457 2.730 1.00 24.55 H new ATOM 0 HG22 VAL A 224 -2.376 -1.836 1.626 1.00 24.55 H new ATOM 0 HG23 VAL A 224 -3.336 -0.356 1.396 1.00 24.55 H new ATOM 1270 N GLU A 225 -6.229 -4.132 3.426 1.00 41.43 N ATOM 1271 CA GLU A 225 -7.249 -4.677 4.334 1.00 43.41 C ATOM 1272 C GLU A 225 -6.606 -5.395 5.526 1.00 63.22 C ATOM 1273 O GLU A 225 -5.547 -6.015 5.397 1.00 13.13 O ATOM 1274 CB GLU A 225 -8.164 -5.658 3.586 1.00 4.23 C ATOM 1275 CG GLU A 225 -8.960 -5.032 2.443 1.00 52.33 C ATOM 1276 CD GLU A 225 -9.959 -3.980 2.904 1.00 30.55 C ATOM 1277 OE1 GLU A 225 -10.786 -4.284 3.789 1.00 51.33 O ATOM 1278 OE2 GLU A 225 -9.949 -2.856 2.355 1.00 13.51 O ATOM 0 H GLU A 225 -5.606 -4.833 3.024 1.00 41.43 H new ATOM 0 HA GLU A 225 -7.838 -3.839 4.706 1.00 43.41 H new ATOM 0 HB2 GLU A 225 -7.556 -6.470 3.187 1.00 4.23 H new ATOM 0 HB3 GLU A 225 -8.861 -6.101 4.298 1.00 4.23 H new ATOM 0 HG2 GLU A 225 -8.267 -4.578 1.734 1.00 52.33 H new ATOM 0 HG3 GLU A 225 -9.493 -5.818 1.909 1.00 52.33 H new ATOM 1285 N VAL A 226 -7.250 -5.310 6.688 1.00 13.33 N ATOM 1286 CA VAL A 226 -6.805 -6.053 7.869 1.00 71.51 C ATOM 1287 C VAL A 226 -7.361 -7.484 7.832 1.00 51.23 C ATOM 1288 O VAL A 226 -8.542 -7.706 8.108 1.00 14.30 O ATOM 1289 CB VAL A 226 -7.251 -5.361 9.184 1.00 41.53 C ATOM 1290 CG1 VAL A 226 -6.776 -6.145 10.405 1.00 54.45 C ATOM 1291 CG2 VAL A 226 -6.740 -3.923 9.237 1.00 64.53 C ATOM 0 H VAL A 226 -8.080 -4.736 6.839 1.00 13.33 H new ATOM 0 HA VAL A 226 -5.715 -6.078 7.849 1.00 71.51 H new ATOM 0 HB VAL A 226 -8.341 -5.340 9.199 1.00 41.53 H new ATOM 0 HG11 VAL A 226 -7.102 -5.638 11.313 1.00 54.45 H new ATOM 0 HG12 VAL A 226 -7.198 -7.150 10.379 1.00 54.45 H new ATOM 0 HG13 VAL A 226 -5.688 -6.208 10.396 1.00 54.45 H new ATOM 0 HG21 VAL A 226 -7.064 -3.456 10.167 1.00 64.53 H new ATOM 0 HG22 VAL A 226 -5.651 -3.922 9.190 1.00 64.53 H new ATOM 0 HG23 VAL A 226 -7.140 -3.363 8.391 1.00 64.53 H new ATOM 1301 N LEU A 227 -6.506 -8.443 7.474 1.00 55.11 N ATOM 1302 CA LEU A 227 -6.918 -9.846 7.321 1.00 12.53 C ATOM 1303 C LEU A 227 -7.583 -10.385 8.597 1.00 25.54 C ATOM 1304 O LEU A 227 -8.673 -10.964 8.550 1.00 32.42 O ATOM 1305 CB LEU A 227 -5.704 -10.710 6.952 1.00 1.02 C ATOM 1306 CG LEU A 227 -5.009 -10.327 5.635 1.00 61.02 C ATOM 1307 CD1 LEU A 227 -3.787 -11.209 5.391 1.00 52.21 C ATOM 1308 CD2 LEU A 227 -5.989 -10.420 4.466 1.00 53.31 C ATOM 0 H LEU A 227 -5.518 -8.276 7.283 1.00 55.11 H new ATOM 0 HA LEU A 227 -7.655 -9.893 6.519 1.00 12.53 H new ATOM 0 HB2 LEU A 227 -4.975 -10.650 7.760 1.00 1.02 H new ATOM 0 HB3 LEU A 227 -6.024 -11.750 6.887 1.00 1.02 H new ATOM 0 HG LEU A 227 -4.668 -9.295 5.714 1.00 61.02 H new ATOM 0 HD11 LEU A 227 -3.311 -10.920 4.454 1.00 52.21 H new ATOM 0 HD12 LEU A 227 -3.079 -11.085 6.211 1.00 52.21 H new ATOM 0 HD13 LEU A 227 -4.097 -12.252 5.334 1.00 52.21 H new ATOM 0 HD21 LEU A 227 -5.480 -10.146 3.542 1.00 53.31 H new ATOM 0 HD22 LEU A 227 -6.363 -11.441 4.385 1.00 53.31 H new ATOM 0 HD23 LEU A 227 -6.824 -9.740 4.636 1.00 53.31 H new