USER MOD reduce.3.24.130724 H: found=0, std=0, add=637, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 637 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 Set 1.1: A 207 LYS NZ :NH3+ 149:sc= 0.89 (180deg=0) USER MOD Set 1.2: A 208 ASN : amide:sc= 0.886 K(o=1.8,f=-3.4) USER MOD Set 2.1: A 162 TYR OH : rot 5:sc= 1.02 USER MOD Set 2.2: A 193 TYR OH : rot 6:sc= 1.05 USER MOD Single : A 159 ASN : amide:sc= -0.0818 X(o=-0.082,f=-0.0044) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 82:sc= -1.78! USER MOD Single : A 172 SER OG : rot 70:sc= 1.22 USER MOD Single : A 173 SER OG : rot 74:sc= 1.19 USER MOD Single : A 176 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.049) USER MOD Single : A 179 THR OG1 : rot 180:sc= -3.06! USER MOD Single : A 181 SER OG : rot 180:sc= 0 USER MOD Single : A 182 GLN : amide:sc= -3.47! C(o=-3.5!,f=-9.3!) USER MOD Single : A 184 TYR OH : rot 180:sc= -0.736 USER MOD Single : A 187 MET CE :methyl -139:sc= -1.2 (180deg=-3.24!) USER MOD Single : A 190 CYS SG : rot -31:sc= 0.0187 USER MOD Single : A 195 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0445) USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 SER OG : rot 94:sc= 0.618 USER MOD Single : A 201 ASN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 202 SER OG : rot 180:sc= 0.0588 USER MOD Single : A 203 SER OG : rot -93:sc= 1.41 USER MOD Single : A 209 SER OG : rot 180:sc= 0.00186 USER MOD Single : A 212 HIS : no HD1:sc= -0.681 K(o=-0.68,f=-1.6!) USER MOD Single : A 213 ASN :FLIP amide:sc= -0.134 F(o=-1.7!,f=-0.13) USER MOD Single : A 215 SER OG : rot 81:sc= 1.04 USER MOD Single : A 217 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 218 SER OG : rot 180:sc= 0.0221 USER MOD Single : A 221 MET CE :methyl -161:sc= -0.132 (180deg=-0.603) USER MOD Single : A 224 GLN :FLIP amide:sc= 0 F(o=-0.69,f=0) USER MOD Single : A 232 SER OG : rot 29:sc= 0.0501 USER MOD Single : A 237 ASN : amide:sc= -0.527 K(o=-0.53,f=-4.5!) USER MOD Single : A 242 LYS NZ :NH3+ -156:sc= -0.144 (180deg=-0.55) USER MOD ----------------------------------------------------------------- ATOM 105 N ALA A 156 -4.276 17.652 -7.080 1.00 0.00 N ATOM 106 CA ALA A 156 -3.633 16.338 -7.099 1.00 0.00 C ATOM 107 C ALA A 156 -2.125 16.442 -7.283 1.00 0.00 C ATOM 108 O ALA A 156 -1.492 15.628 -7.948 1.00 0.00 O ATOM 109 CB ALA A 156 -4.244 15.484 -8.163 1.00 0.00 C ATOM 0 HA ALA A 156 -3.801 15.870 -6.129 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -3.759 14.508 -8.169 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -5.308 15.359 -7.963 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -4.111 15.962 -9.134 1.00 0.00 H new ATOM 115 N TRP A 157 -1.579 17.411 -6.644 1.00 0.00 N ATOM 116 CA TRP A 157 -0.191 17.662 -6.624 1.00 0.00 C ATOM 117 C TRP A 157 0.173 18.205 -5.250 1.00 0.00 C ATOM 118 O TRP A 157 1.012 17.667 -4.572 1.00 0.00 O ATOM 119 CB TRP A 157 0.232 18.620 -7.773 1.00 0.00 C ATOM 120 CG TRP A 157 -0.518 19.931 -7.829 1.00 0.00 C ATOM 121 CD1 TRP A 157 -1.706 20.170 -8.453 1.00 0.00 C ATOM 122 CD2 TRP A 157 -0.113 21.179 -7.249 1.00 0.00 C ATOM 123 NE1 TRP A 157 -2.077 21.476 -8.274 1.00 0.00 N ATOM 124 CE2 TRP A 157 -1.115 22.119 -7.539 1.00 0.00 C ATOM 125 CE3 TRP A 157 0.997 21.585 -6.500 1.00 0.00 C ATOM 126 CZ2 TRP A 157 -1.043 23.437 -7.112 1.00 0.00 C ATOM 127 CZ3 TRP A 157 1.066 22.892 -6.076 1.00 0.00 C ATOM 128 CH2 TRP A 157 0.054 23.802 -6.379 1.00 0.00 C ATOM 0 H TRP A 157 -2.117 18.081 -6.095 1.00 0.00 H new ATOM 0 HA TRP A 157 0.359 16.737 -6.798 1.00 0.00 H new ATOM 0 HB2 TRP A 157 1.296 18.833 -7.673 1.00 0.00 H new ATOM 0 HB3 TRP A 157 0.098 18.103 -8.723 1.00 0.00 H new ATOM 0 HD1 TRP A 157 -2.272 19.436 -9.008 1.00 0.00 H new ATOM 0 HE1 TRP A 157 -2.932 21.902 -8.631 1.00 0.00 H new ATOM 0 HE3 TRP A 157 1.784 20.886 -6.259 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 -1.822 24.147 -7.349 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 1.918 23.219 -5.499 1.00 0.00 H new ATOM 0 HH2 TRP A 157 0.138 24.820 -6.027 1.00 0.00 H new ATOM 139 N GLY A 158 -0.574 19.204 -4.801 1.00 0.00 N ATOM 140 CA GLY A 158 -0.246 19.868 -3.556 1.00 0.00 C ATOM 141 C GLY A 158 -1.332 19.775 -2.518 1.00 0.00 C ATOM 142 O GLY A 158 -1.402 20.596 -1.608 1.00 0.00 O ATOM 0 H GLY A 158 -1.401 19.566 -5.276 1.00 0.00 H new ATOM 0 HA2 GLY A 158 0.669 19.434 -3.152 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -0.038 20.919 -3.758 1.00 0.00 H new ATOM 146 N ASN A 159 -2.207 18.819 -2.672 1.00 0.00 N ATOM 147 CA ASN A 159 -3.255 18.573 -1.682 1.00 0.00 C ATOM 148 C ASN A 159 -3.357 17.076 -1.518 1.00 0.00 C ATOM 149 O ASN A 159 -4.397 16.515 -1.182 1.00 0.00 O ATOM 150 CB ASN A 159 -4.601 19.152 -2.142 1.00 0.00 C ATOM 151 CG ASN A 159 -5.602 19.379 -0.994 1.00 0.00 C ATOM 152 OD1 ASN A 159 -5.638 20.461 -0.413 1.00 0.00 O ATOM 153 ND2 ASN A 159 -6.384 18.384 -0.646 1.00 0.00 N ATOM 0 H ASN A 159 -2.226 18.187 -3.473 1.00 0.00 H new ATOM 0 HA ASN A 159 -3.008 19.059 -0.738 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -4.424 20.100 -2.651 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -5.046 18.477 -2.872 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -7.043 18.498 0.124 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -6.333 17.496 -1.146 1.00 0.00 H new ATOM 160 N LEU A 160 -2.262 16.434 -1.780 1.00 0.00 N ATOM 161 CA LEU A 160 -2.159 15.020 -1.640 1.00 0.00 C ATOM 162 C LEU A 160 -1.745 14.733 -0.228 1.00 0.00 C ATOM 163 O LEU A 160 -0.827 15.386 0.302 1.00 0.00 O ATOM 164 CB LEU A 160 -1.112 14.496 -2.602 1.00 0.00 C ATOM 165 CG LEU A 160 -1.371 14.746 -4.077 1.00 0.00 C ATOM 166 CD1 LEU A 160 -0.159 14.349 -4.884 1.00 0.00 C ATOM 167 CD2 LEU A 160 -2.591 13.974 -4.542 1.00 0.00 C ATOM 0 H LEU A 160 -1.405 16.885 -2.101 1.00 0.00 H new ATOM 0 HA LEU A 160 -3.110 14.536 -1.862 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -0.153 14.944 -2.342 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -1.014 13.421 -2.449 1.00 0.00 H new ATOM 0 HG LEU A 160 -1.563 15.809 -4.225 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -0.351 14.531 -5.942 1.00 0.00 H new ATOM 0 HD12 LEU A 160 0.700 14.939 -4.564 1.00 0.00 H new ATOM 0 HD13 LEU A 160 0.050 13.290 -4.730 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -2.761 14.166 -5.601 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -2.427 12.907 -4.388 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -3.463 14.293 -3.971 1.00 0.00 H new ATOM 179 N SER A 161 -2.410 13.813 0.387 1.00 0.00 N ATOM 180 CA SER A 161 -2.117 13.457 1.725 1.00 0.00 C ATOM 181 C SER A 161 -0.972 12.444 1.729 1.00 0.00 C ATOM 182 O SER A 161 -0.519 12.026 0.657 1.00 0.00 O ATOM 183 CB SER A 161 -3.375 12.920 2.370 1.00 0.00 C ATOM 184 OG SER A 161 -4.440 13.865 2.219 1.00 0.00 O ATOM 0 H SER A 161 -3.176 13.286 -0.032 1.00 0.00 H new ATOM 0 HA SER A 161 -1.791 14.319 2.306 1.00 0.00 H new ATOM 0 HB2 SER A 161 -3.652 11.970 1.913 1.00 0.00 H new ATOM 0 HB3 SER A 161 -3.197 12.725 3.428 1.00 0.00 H new ATOM 0 HG SER A 161 -5.253 13.511 2.637 1.00 0.00 H new ATOM 190 N TYR A 162 -0.517 12.046 2.907 1.00 0.00 N ATOM 191 CA TYR A 162 0.657 11.186 3.041 1.00 0.00 C ATOM 192 C TYR A 162 0.511 9.904 2.258 1.00 0.00 C ATOM 193 O TYR A 162 1.377 9.578 1.459 1.00 0.00 O ATOM 194 CB TYR A 162 0.979 10.940 4.519 1.00 0.00 C ATOM 195 CG TYR A 162 1.190 12.247 5.255 1.00 0.00 C ATOM 196 CD1 TYR A 162 2.377 12.956 5.122 1.00 0.00 C ATOM 197 CD2 TYR A 162 0.181 12.795 6.035 1.00 0.00 C ATOM 198 CE1 TYR A 162 2.547 14.177 5.740 1.00 0.00 C ATOM 199 CE2 TYR A 162 0.350 14.007 6.666 1.00 0.00 C ATOM 200 CZ TYR A 162 1.532 14.697 6.514 1.00 0.00 C ATOM 201 OH TYR A 162 1.687 15.937 7.113 1.00 0.00 O ATOM 0 H TYR A 162 -0.946 12.306 3.795 1.00 0.00 H new ATOM 0 HA TYR A 162 1.509 11.707 2.604 1.00 0.00 H new ATOM 0 HB2 TYR A 162 0.165 10.384 4.984 1.00 0.00 H new ATOM 0 HB3 TYR A 162 1.874 10.324 4.602 1.00 0.00 H new ATOM 0 HD1 TYR A 162 3.178 12.545 4.526 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -0.751 12.262 6.149 1.00 0.00 H new ATOM 0 HE1 TYR A 162 3.471 14.723 5.618 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -0.441 14.415 7.278 1.00 0.00 H new ATOM 0 HH TYR A 162 2.531 16.339 6.819 1.00 0.00 H new ATOM 211 N ALA A 163 -0.641 9.261 2.401 1.00 0.00 N ATOM 212 CA ALA A 163 -0.955 8.010 1.702 1.00 0.00 C ATOM 213 C ALA A 163 -0.890 8.195 0.180 1.00 0.00 C ATOM 214 O ALA A 163 -0.395 7.323 -0.576 1.00 0.00 O ATOM 215 CB ALA A 163 -2.346 7.550 2.107 1.00 0.00 C ATOM 0 H ALA A 163 -1.392 9.590 3.008 1.00 0.00 H new ATOM 0 HA ALA A 163 -0.217 7.258 1.981 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -2.586 6.620 1.591 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -2.376 7.385 3.184 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -3.075 8.314 1.837 1.00 0.00 H new ATOM 221 N ASP A 164 -1.327 9.352 -0.251 1.00 0.00 N ATOM 222 CA ASP A 164 -1.392 9.693 -1.653 1.00 0.00 C ATOM 223 C ASP A 164 -0.008 9.919 -2.197 1.00 0.00 C ATOM 224 O ASP A 164 0.285 9.557 -3.320 1.00 0.00 O ATOM 225 CB ASP A 164 -2.240 10.939 -1.873 1.00 0.00 C ATOM 226 CG ASP A 164 -3.648 10.785 -1.373 1.00 0.00 C ATOM 227 OD1 ASP A 164 -4.391 9.949 -1.903 1.00 0.00 O ATOM 228 OD2 ASP A 164 -4.035 11.492 -0.424 1.00 0.00 O ATOM 0 H ASP A 164 -1.652 10.094 0.369 1.00 0.00 H new ATOM 0 HA ASP A 164 -1.856 8.860 -2.181 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -1.772 11.784 -1.369 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -2.262 11.174 -2.937 1.00 0.00 H new ATOM 233 N LEU A 165 0.846 10.500 -1.383 1.00 0.00 N ATOM 234 CA LEU A 165 2.230 10.759 -1.768 1.00 0.00 C ATOM 235 C LEU A 165 2.973 9.446 -1.955 1.00 0.00 C ATOM 236 O LEU A 165 3.705 9.271 -2.967 1.00 0.00 O ATOM 237 CB LEU A 165 2.946 11.629 -0.724 1.00 0.00 C ATOM 238 CG LEU A 165 2.275 12.962 -0.372 1.00 0.00 C ATOM 239 CD1 LEU A 165 3.039 13.672 0.719 1.00 0.00 C ATOM 240 CD2 LEU A 165 2.151 13.855 -1.594 1.00 0.00 C ATOM 0 H LEU A 165 0.610 10.807 -0.440 1.00 0.00 H new ATOM 0 HA LEU A 165 2.222 11.305 -2.711 1.00 0.00 H new ATOM 0 HB2 LEU A 165 3.051 11.047 0.192 1.00 0.00 H new ATOM 0 HB3 LEU A 165 3.953 11.838 -1.086 1.00 0.00 H new ATOM 0 HG LEU A 165 1.271 12.742 -0.009 1.00 0.00 H new ATOM 0 HD11 LEU A 165 2.546 14.615 0.954 1.00 0.00 H new ATOM 0 HD12 LEU A 165 3.067 13.046 1.611 1.00 0.00 H new ATOM 0 HD13 LEU A 165 4.057 13.868 0.382 1.00 0.00 H new ATOM 0 HD21 LEU A 165 1.671 14.792 -1.312 1.00 0.00 H new ATOM 0 HD22 LEU A 165 3.143 14.061 -1.996 1.00 0.00 H new ATOM 0 HD23 LEU A 165 1.549 13.353 -2.352 1.00 0.00 H new ATOM 252 N ILE A 166 2.760 8.504 -1.003 1.00 0.00 N ATOM 253 CA ILE A 166 3.379 7.164 -1.086 1.00 0.00 C ATOM 254 C ILE A 166 2.981 6.582 -2.406 1.00 0.00 C ATOM 255 O ILE A 166 3.808 6.115 -3.181 1.00 0.00 O ATOM 256 CB ILE A 166 2.859 6.180 -0.001 1.00 0.00 C ATOM 257 CG1 ILE A 166 2.483 6.933 1.239 1.00 0.00 C ATOM 258 CG2 ILE A 166 3.926 5.154 0.322 1.00 0.00 C ATOM 259 CD1 ILE A 166 2.112 6.099 2.425 1.00 0.00 C ATOM 0 H ILE A 166 2.173 8.647 -0.181 1.00 0.00 H new ATOM 0 HA ILE A 166 4.454 7.286 -0.951 1.00 0.00 H new ATOM 0 HB ILE A 166 1.977 5.667 -0.384 1.00 0.00 H new ATOM 0 HG12 ILE A 166 3.319 7.575 1.518 1.00 0.00 H new ATOM 0 HG13 ILE A 166 1.644 7.587 1.003 1.00 0.00 H new ATOM 0 HG21 ILE A 166 3.553 4.469 1.083 1.00 0.00 H new ATOM 0 HG22 ILE A 166 4.177 4.594 -0.579 1.00 0.00 H new ATOM 0 HG23 ILE A 166 4.817 5.660 0.694 1.00 0.00 H new ATOM 0 HD11 ILE A 166 1.859 6.749 3.262 1.00 0.00 H new ATOM 0 HD12 ILE A 166 1.253 5.476 2.177 1.00 0.00 H new ATOM 0 HD13 ILE A 166 2.954 5.463 2.700 1.00 0.00 H new ATOM 271 N THR A 167 1.691 6.691 -2.667 1.00 0.00 N ATOM 272 CA THR A 167 1.092 6.264 -3.872 1.00 0.00 C ATOM 273 C THR A 167 1.780 6.884 -5.122 1.00 0.00 C ATOM 274 O THR A 167 2.124 6.161 -6.055 1.00 0.00 O ATOM 275 CB THR A 167 -0.381 6.642 -3.820 1.00 0.00 C ATOM 276 OG1 THR A 167 -1.130 5.853 -2.881 1.00 0.00 O ATOM 277 CG2 THR A 167 -1.020 6.741 -5.170 1.00 0.00 C ATOM 0 H THR A 167 1.027 7.097 -2.008 1.00 0.00 H new ATOM 0 HA THR A 167 1.207 5.184 -3.968 1.00 0.00 H new ATOM 0 HB THR A 167 -0.409 7.658 -3.427 1.00 0.00 H new ATOM 0 HG1 THR A 167 -1.016 6.222 -1.980 1.00 0.00 H new ATOM 0 HG21 THR A 167 -2.069 7.014 -5.057 1.00 0.00 H new ATOM 0 HG22 THR A 167 -0.509 7.502 -5.760 1.00 0.00 H new ATOM 0 HG23 THR A 167 -0.948 5.779 -5.678 1.00 0.00 H new ATOM 285 N ARG A 168 1.998 8.208 -5.103 1.00 0.00 N ATOM 286 CA ARG A 168 2.624 8.928 -6.221 1.00 0.00 C ATOM 287 C ARG A 168 3.959 8.293 -6.559 1.00 0.00 C ATOM 288 O ARG A 168 4.265 8.053 -7.732 1.00 0.00 O ATOM 289 CB ARG A 168 2.856 10.415 -5.887 1.00 0.00 C ATOM 290 CG ARG A 168 1.621 11.211 -5.492 1.00 0.00 C ATOM 291 CD ARG A 168 0.556 11.210 -6.572 1.00 0.00 C ATOM 292 NE ARG A 168 0.989 11.914 -7.797 1.00 0.00 N ATOM 293 CZ ARG A 168 0.309 11.926 -8.966 1.00 0.00 C ATOM 294 NH1 ARG A 168 -0.740 11.122 -9.147 1.00 0.00 N ATOM 295 NH2 ARG A 168 0.718 12.706 -9.966 1.00 0.00 N ATOM 0 H ARG A 168 1.747 8.806 -4.316 1.00 0.00 H new ATOM 0 HA ARG A 168 1.943 8.865 -7.070 1.00 0.00 H new ATOM 0 HB2 ARG A 168 3.578 10.476 -5.073 1.00 0.00 H new ATOM 0 HB3 ARG A 168 3.311 10.895 -6.754 1.00 0.00 H new ATOM 0 HG2 ARG A 168 1.203 10.795 -4.575 1.00 0.00 H new ATOM 0 HG3 ARG A 168 1.910 12.239 -5.273 1.00 0.00 H new ATOM 0 HD2 ARG A 168 0.297 10.181 -6.821 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -0.348 11.682 -6.186 1.00 0.00 H new ATOM 0 HE ARG A 168 1.868 12.430 -7.758 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -1.035 10.492 -8.401 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -1.248 11.137 -10.032 1.00 0.00 H new ATOM 0 HH21 ARG A 168 1.544 13.294 -9.850 1.00 0.00 H new ATOM 0 HH22 ARG A 168 0.206 12.715 -10.848 1.00 0.00 H new ATOM 309 N ALA A 169 4.732 8.003 -5.527 1.00 0.00 N ATOM 310 CA ALA A 169 6.038 7.368 -5.693 1.00 0.00 C ATOM 311 C ALA A 169 5.893 5.970 -6.243 1.00 0.00 C ATOM 312 O ALA A 169 6.467 5.643 -7.285 1.00 0.00 O ATOM 313 CB ALA A 169 6.757 7.317 -4.381 1.00 0.00 C ATOM 0 H ALA A 169 4.480 8.197 -4.558 1.00 0.00 H new ATOM 0 HA ALA A 169 6.614 7.963 -6.401 1.00 0.00 H new ATOM 0 HB1 ALA A 169 7.729 6.842 -4.517 1.00 0.00 H new ATOM 0 HB2 ALA A 169 6.898 8.330 -4.004 1.00 0.00 H new ATOM 0 HB3 ALA A 169 6.169 6.742 -3.666 1.00 0.00 H new ATOM 319 N ILE A 170 5.085 5.179 -5.571 1.00 0.00 N ATOM 320 CA ILE A 170 4.847 3.786 -5.908 1.00 0.00 C ATOM 321 C ILE A 170 4.367 3.632 -7.361 1.00 0.00 C ATOM 322 O ILE A 170 4.816 2.746 -8.095 1.00 0.00 O ATOM 323 CB ILE A 170 3.807 3.186 -4.939 1.00 0.00 C ATOM 324 CG1 ILE A 170 4.363 3.121 -3.508 1.00 0.00 C ATOM 325 CG2 ILE A 170 3.354 1.816 -5.396 1.00 0.00 C ATOM 326 CD1 ILE A 170 3.337 2.712 -2.466 1.00 0.00 C ATOM 0 H ILE A 170 4.561 5.492 -4.754 1.00 0.00 H new ATOM 0 HA ILE A 170 5.790 3.247 -5.811 1.00 0.00 H new ATOM 0 HB ILE A 170 2.938 3.845 -4.941 1.00 0.00 H new ATOM 0 HG12 ILE A 170 5.193 2.415 -3.483 1.00 0.00 H new ATOM 0 HG13 ILE A 170 4.767 4.097 -3.241 1.00 0.00 H new ATOM 0 HG21 ILE A 170 2.622 1.421 -4.692 1.00 0.00 H new ATOM 0 HG22 ILE A 170 2.902 1.893 -6.385 1.00 0.00 H new ATOM 0 HG23 ILE A 170 4.212 1.145 -5.441 1.00 0.00 H new ATOM 0 HD11 ILE A 170 3.806 2.689 -1.483 1.00 0.00 H new ATOM 0 HD12 ILE A 170 2.518 3.431 -2.461 1.00 0.00 H new ATOM 0 HD13 ILE A 170 2.950 1.722 -2.706 1.00 0.00 H new ATOM 338 N GLU A 171 3.511 4.527 -7.789 1.00 0.00 N ATOM 339 CA GLU A 171 2.974 4.468 -9.124 1.00 0.00 C ATOM 340 C GLU A 171 3.939 5.015 -10.169 1.00 0.00 C ATOM 341 O GLU A 171 3.675 4.943 -11.361 1.00 0.00 O ATOM 342 CB GLU A 171 1.619 5.141 -9.209 1.00 0.00 C ATOM 343 CG GLU A 171 0.588 4.497 -8.311 1.00 0.00 C ATOM 344 CD GLU A 171 -0.812 4.799 -8.734 1.00 0.00 C ATOM 345 OE1 GLU A 171 -1.373 4.023 -9.545 1.00 0.00 O ATOM 346 OE2 GLU A 171 -1.396 5.787 -8.273 1.00 0.00 O ATOM 0 H GLU A 171 3.171 5.308 -7.228 1.00 0.00 H new ATOM 0 HA GLU A 171 2.834 3.412 -9.356 1.00 0.00 H new ATOM 0 HB2 GLU A 171 1.723 6.192 -8.940 1.00 0.00 H new ATOM 0 HB3 GLU A 171 1.267 5.109 -10.240 1.00 0.00 H new ATOM 0 HG2 GLU A 171 0.738 3.417 -8.308 1.00 0.00 H new ATOM 0 HG3 GLU A 171 0.737 4.842 -7.288 1.00 0.00 H new ATOM 353 N SER A 172 5.047 5.560 -9.724 1.00 0.00 N ATOM 354 CA SER A 172 6.076 6.026 -10.626 1.00 0.00 C ATOM 355 C SER A 172 7.202 4.994 -10.680 1.00 0.00 C ATOM 356 O SER A 172 8.218 5.184 -11.343 1.00 0.00 O ATOM 357 CB SER A 172 6.614 7.362 -10.131 1.00 0.00 C ATOM 358 OG SER A 172 5.562 8.322 -10.032 1.00 0.00 O ATOM 0 H SER A 172 5.260 5.693 -8.735 1.00 0.00 H new ATOM 0 HA SER A 172 5.662 6.158 -11.626 1.00 0.00 H new ATOM 0 HB2 SER A 172 7.087 7.231 -9.158 1.00 0.00 H new ATOM 0 HB3 SER A 172 7.383 7.726 -10.813 1.00 0.00 H new ATOM 0 HG SER A 172 4.969 8.082 -9.290 1.00 0.00 H new ATOM 364 N SER A 173 6.980 3.889 -10.021 1.00 0.00 N ATOM 365 CA SER A 173 7.955 2.883 -9.865 1.00 0.00 C ATOM 366 C SER A 173 7.670 1.693 -10.832 1.00 0.00 C ATOM 367 O SER A 173 6.674 1.742 -11.574 1.00 0.00 O ATOM 368 CB SER A 173 7.872 2.499 -8.442 1.00 0.00 C ATOM 369 OG SER A 173 8.197 3.593 -7.602 1.00 0.00 O ATOM 0 H SER A 173 6.090 3.673 -9.573 1.00 0.00 H new ATOM 0 HA SER A 173 8.961 3.218 -10.117 1.00 0.00 H new ATOM 0 HB2 SER A 173 6.866 2.147 -8.214 1.00 0.00 H new ATOM 0 HB3 SER A 173 8.552 1.670 -8.245 1.00 0.00 H new ATOM 0 HG SER A 173 7.454 4.232 -7.594 1.00 0.00 H new ATOM 375 N PRO A 174 8.494 0.590 -10.830 1.00 0.00 N ATOM 376 CA PRO A 174 8.360 -0.470 -11.820 1.00 0.00 C ATOM 377 C PRO A 174 7.224 -1.454 -11.519 1.00 0.00 C ATOM 378 O PRO A 174 6.171 -1.424 -12.166 1.00 0.00 O ATOM 379 CB PRO A 174 9.727 -1.179 -11.801 1.00 0.00 C ATOM 380 CG PRO A 174 10.440 -0.713 -10.556 1.00 0.00 C ATOM 381 CD PRO A 174 9.567 0.283 -9.861 1.00 0.00 C ATOM 0 HA PRO A 174 8.098 -0.059 -12.795 1.00 0.00 H new ATOM 0 HB2 PRO A 174 9.601 -2.262 -11.793 1.00 0.00 H new ATOM 0 HB3 PRO A 174 10.303 -0.932 -12.692 1.00 0.00 H new ATOM 0 HG2 PRO A 174 10.650 -1.558 -9.900 1.00 0.00 H new ATOM 0 HG3 PRO A 174 11.399 -0.263 -10.813 1.00 0.00 H new ATOM 0 HD2 PRO A 174 9.159 -0.126 -8.937 1.00 0.00 H new ATOM 0 HD3 PRO A 174 10.126 1.180 -9.593 1.00 0.00 H new ATOM 389 N ASP A 175 7.409 -2.283 -10.504 1.00 0.00 N ATOM 390 CA ASP A 175 6.416 -3.306 -10.165 1.00 0.00 C ATOM 391 C ASP A 175 5.409 -2.812 -9.180 1.00 0.00 C ATOM 392 O ASP A 175 4.656 -3.608 -8.658 1.00 0.00 O ATOM 393 CB ASP A 175 7.041 -4.591 -9.583 1.00 0.00 C ATOM 394 CG ASP A 175 7.705 -5.521 -10.565 1.00 0.00 C ATOM 395 OD1 ASP A 175 7.036 -5.948 -11.528 1.00 0.00 O ATOM 396 OD2 ASP A 175 8.861 -5.935 -10.310 1.00 0.00 O ATOM 0 H ASP A 175 8.231 -2.273 -9.900 1.00 0.00 H new ATOM 0 HA ASP A 175 5.935 -3.537 -11.115 1.00 0.00 H new ATOM 0 HB2 ASP A 175 7.779 -4.302 -8.834 1.00 0.00 H new ATOM 0 HB3 ASP A 175 6.259 -5.145 -9.063 1.00 0.00 H new ATOM 401 N LYS A 176 5.392 -1.500 -8.912 1.00 0.00 N ATOM 402 CA LYS A 176 4.450 -0.892 -7.947 1.00 0.00 C ATOM 403 C LYS A 176 4.669 -1.405 -6.520 1.00 0.00 C ATOM 404 O LYS A 176 3.849 -1.193 -5.663 1.00 0.00 O ATOM 405 CB LYS A 176 2.979 -1.098 -8.369 1.00 0.00 C ATOM 406 CG LYS A 176 2.707 -0.738 -9.821 1.00 0.00 C ATOM 407 CD LYS A 176 3.092 0.694 -10.119 1.00 0.00 C ATOM 408 CE LYS A 176 2.893 1.021 -11.574 1.00 0.00 C ATOM 409 NZ LYS A 176 1.458 1.038 -11.956 1.00 0.00 N ATOM 0 H LYS A 176 6.023 -0.830 -9.351 1.00 0.00 H new ATOM 0 HA LYS A 176 4.660 0.177 -7.954 1.00 0.00 H new ATOM 0 HB2 LYS A 176 2.705 -2.140 -8.204 1.00 0.00 H new ATOM 0 HB3 LYS A 176 2.337 -0.494 -7.727 1.00 0.00 H new ATOM 0 HG2 LYS A 176 3.265 -1.409 -10.474 1.00 0.00 H new ATOM 0 HG3 LYS A 176 1.650 -0.885 -10.041 1.00 0.00 H new ATOM 0 HD2 LYS A 176 2.493 1.369 -9.507 1.00 0.00 H new ATOM 0 HD3 LYS A 176 4.135 0.857 -9.847 1.00 0.00 H new ATOM 0 HE2 LYS A 176 3.336 1.993 -11.790 1.00 0.00 H new ATOM 0 HE3 LYS A 176 3.421 0.288 -12.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 1.361 1.398 -12.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 1.074 0.073 -11.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 0.932 1.655 -11.304 1.00 0.00 H new ATOM 423 N ARG A 177 5.767 -2.082 -6.280 1.00 0.00 N ATOM 424 CA ARG A 177 6.107 -2.473 -4.932 1.00 0.00 C ATOM 425 C ARG A 177 7.487 -1.950 -4.670 1.00 0.00 C ATOM 426 O ARG A 177 8.417 -2.259 -5.411 1.00 0.00 O ATOM 427 CB ARG A 177 6.074 -4.022 -4.822 1.00 0.00 C ATOM 428 CG ARG A 177 6.795 -4.694 -5.960 1.00 0.00 C ATOM 429 CD ARG A 177 7.010 -6.175 -5.803 1.00 0.00 C ATOM 430 NE ARG A 177 7.679 -6.676 -7.007 1.00 0.00 N ATOM 431 CZ ARG A 177 8.241 -7.868 -7.180 1.00 0.00 C ATOM 432 NH1 ARG A 177 8.268 -8.759 -6.192 1.00 0.00 N ATOM 433 NH2 ARG A 177 8.796 -8.157 -8.359 1.00 0.00 N ATOM 0 H ARG A 177 6.436 -2.372 -6.994 1.00 0.00 H new ATOM 0 HA ARG A 177 5.403 -2.073 -4.203 1.00 0.00 H new ATOM 0 HB2 ARG A 177 6.527 -4.326 -3.878 1.00 0.00 H new ATOM 0 HB3 ARG A 177 5.038 -4.360 -4.802 1.00 0.00 H new ATOM 0 HG2 ARG A 177 6.232 -4.521 -6.877 1.00 0.00 H new ATOM 0 HG3 ARG A 177 7.766 -4.214 -6.087 1.00 0.00 H new ATOM 0 HD2 ARG A 177 7.616 -6.379 -4.920 1.00 0.00 H new ATOM 0 HD3 ARG A 177 6.057 -6.683 -5.660 1.00 0.00 H new ATOM 0 HE ARG A 177 7.718 -6.038 -7.802 1.00 0.00 H new ATOM 0 HH11 ARG A 177 7.854 -8.531 -5.288 1.00 0.00 H new ATOM 0 HH12 ARG A 177 8.703 -9.670 -6.339 1.00 0.00 H new ATOM 0 HH21 ARG A 177 8.785 -7.468 -9.111 1.00 0.00 H new ATOM 0 HH22 ARG A 177 9.231 -9.067 -8.508 1.00 0.00 H new ATOM 447 N LEU A 178 7.635 -1.215 -3.597 1.00 0.00 N ATOM 448 CA LEU A 178 8.907 -0.557 -3.269 1.00 0.00 C ATOM 449 C LEU A 178 9.096 -0.561 -1.782 1.00 0.00 C ATOM 450 O LEU A 178 8.128 -0.587 -1.055 1.00 0.00 O ATOM 451 CB LEU A 178 8.909 0.947 -3.754 1.00 0.00 C ATOM 452 CG LEU A 178 8.662 1.242 -5.233 1.00 0.00 C ATOM 453 CD1 LEU A 178 9.537 0.369 -6.079 1.00 0.00 C ATOM 454 CD2 LEU A 178 7.186 1.107 -5.558 1.00 0.00 C ATOM 0 H LEU A 178 6.891 -1.047 -2.920 1.00 0.00 H new ATOM 0 HA LEU A 178 9.708 -1.101 -3.770 1.00 0.00 H new ATOM 0 HB2 LEU A 178 8.151 1.480 -3.180 1.00 0.00 H new ATOM 0 HB3 LEU A 178 9.874 1.379 -3.488 1.00 0.00 H new ATOM 0 HG LEU A 178 8.933 2.274 -5.458 1.00 0.00 H new ATOM 0 HD11 LEU A 178 9.356 0.584 -7.132 1.00 0.00 H new ATOM 0 HD12 LEU A 178 10.583 0.565 -5.843 1.00 0.00 H new ATOM 0 HD13 LEU A 178 9.309 -0.678 -5.878 1.00 0.00 H new ATOM 0 HD21 LEU A 178 7.025 1.320 -6.615 1.00 0.00 H new ATOM 0 HD22 LEU A 178 6.856 0.092 -5.338 1.00 0.00 H new ATOM 0 HD23 LEU A 178 6.615 1.812 -4.955 1.00 0.00 H new ATOM 466 N THR A 179 10.325 -0.561 -1.337 1.00 0.00 N ATOM 467 CA THR A 179 10.618 -0.462 0.082 1.00 0.00 C ATOM 468 C THR A 179 10.390 0.983 0.513 1.00 0.00 C ATOM 469 O THR A 179 10.360 1.868 -0.338 1.00 0.00 O ATOM 470 CB THR A 179 12.085 -0.841 0.373 1.00 0.00 C ATOM 471 OG1 THR A 179 12.979 0.176 -0.161 1.00 0.00 O ATOM 472 CG2 THR A 179 12.400 -2.194 -0.263 1.00 0.00 C ATOM 0 H THR A 179 11.149 -0.629 -1.935 1.00 0.00 H new ATOM 0 HA THR A 179 9.970 -1.147 0.629 1.00 0.00 H new ATOM 0 HB THR A 179 12.230 -0.906 1.451 1.00 0.00 H new ATOM 0 HG1 THR A 179 13.908 -0.072 0.030 1.00 0.00 H new ATOM 0 HG21 THR A 179 13.437 -2.461 -0.057 1.00 0.00 H new ATOM 0 HG22 THR A 179 11.740 -2.955 0.154 1.00 0.00 H new ATOM 0 HG23 THR A 179 12.249 -2.134 -1.341 1.00 0.00 H new ATOM 480 N LEU A 180 10.286 1.240 1.813 1.00 0.00 N ATOM 481 CA LEU A 180 10.037 2.600 2.307 1.00 0.00 C ATOM 482 C LEU A 180 11.193 3.505 1.926 1.00 0.00 C ATOM 483 O LEU A 180 11.015 4.687 1.708 1.00 0.00 O ATOM 484 CB LEU A 180 9.852 2.620 3.833 1.00 0.00 C ATOM 485 CG LEU A 180 8.498 3.151 4.354 1.00 0.00 C ATOM 486 CD1 LEU A 180 8.136 4.480 3.712 1.00 0.00 C ATOM 487 CD2 LEU A 180 7.384 2.143 4.153 1.00 0.00 C ATOM 0 H LEU A 180 10.369 0.533 2.544 1.00 0.00 H new ATOM 0 HA LEU A 180 9.116 2.959 1.847 1.00 0.00 H new ATOM 0 HB2 LEU A 180 9.988 1.605 4.207 1.00 0.00 H new ATOM 0 HB3 LEU A 180 10.647 3.228 4.266 1.00 0.00 H new ATOM 0 HG LEU A 180 8.614 3.312 5.426 1.00 0.00 H new ATOM 0 HD11 LEU A 180 7.178 4.823 4.102 1.00 0.00 H new ATOM 0 HD12 LEU A 180 8.906 5.217 3.941 1.00 0.00 H new ATOM 0 HD13 LEU A 180 8.064 4.355 2.632 1.00 0.00 H new ATOM 0 HD21 LEU A 180 6.448 2.554 4.532 1.00 0.00 H new ATOM 0 HD22 LEU A 180 7.279 1.923 3.091 1.00 0.00 H new ATOM 0 HD23 LEU A 180 7.622 1.226 4.691 1.00 0.00 H new ATOM 499 N SER A 181 12.361 2.920 1.807 1.00 0.00 N ATOM 500 CA SER A 181 13.541 3.636 1.441 1.00 0.00 C ATOM 501 C SER A 181 13.461 4.076 -0.029 1.00 0.00 C ATOM 502 O SER A 181 13.615 5.302 -0.359 1.00 0.00 O ATOM 503 CB SER A 181 14.745 2.746 1.708 1.00 0.00 C ATOM 504 OG SER A 181 14.689 2.257 3.052 1.00 0.00 O ATOM 0 H SER A 181 12.511 1.924 1.965 1.00 0.00 H new ATOM 0 HA SER A 181 13.639 4.544 2.036 1.00 0.00 H new ATOM 0 HB2 SER A 181 14.757 1.912 1.007 1.00 0.00 H new ATOM 0 HB3 SER A 181 15.667 3.307 1.552 1.00 0.00 H new ATOM 0 HG SER A 181 15.464 1.682 3.223 1.00 0.00 H new ATOM 510 N GLN A 182 13.156 3.132 -0.924 1.00 0.00 N ATOM 511 CA GLN A 182 13.048 3.516 -2.311 1.00 0.00 C ATOM 512 C GLN A 182 11.807 4.362 -2.563 1.00 0.00 C ATOM 513 O GLN A 182 11.825 5.223 -3.425 1.00 0.00 O ATOM 514 CB GLN A 182 13.193 2.358 -3.284 1.00 0.00 C ATOM 515 CG GLN A 182 12.409 1.171 -2.910 1.00 0.00 C ATOM 516 CD GLN A 182 12.456 0.052 -3.897 1.00 0.00 C ATOM 517 OE1 GLN A 182 12.325 -1.096 -3.511 1.00 0.00 O ATOM 518 NE2 GLN A 182 12.648 0.348 -5.153 1.00 0.00 N ATOM 0 H GLN A 182 12.989 2.147 -0.718 1.00 0.00 H new ATOM 0 HA GLN A 182 13.911 4.149 -2.519 1.00 0.00 H new ATOM 0 HB2 GLN A 182 12.886 2.688 -4.276 1.00 0.00 H new ATOM 0 HB3 GLN A 182 14.245 2.081 -3.352 1.00 0.00 H new ATOM 0 HG2 GLN A 182 12.768 0.804 -1.949 1.00 0.00 H new ATOM 0 HG3 GLN A 182 11.370 1.469 -2.769 1.00 0.00 H new ATOM 0 HE21 GLN A 182 12.753 1.322 -5.437 1.00 0.00 H new ATOM 0 HE22 GLN A 182 12.693 -0.395 -5.851 1.00 0.00 H new ATOM 527 N ILE A 183 10.750 4.152 -1.768 1.00 0.00 N ATOM 528 CA ILE A 183 9.567 5.011 -1.848 1.00 0.00 C ATOM 529 C ILE A 183 9.968 6.409 -1.477 1.00 0.00 C ATOM 530 O ILE A 183 9.650 7.333 -2.183 1.00 0.00 O ATOM 531 CB ILE A 183 8.395 4.570 -0.913 1.00 0.00 C ATOM 532 CG1 ILE A 183 7.835 3.219 -1.348 1.00 0.00 C ATOM 533 CG2 ILE A 183 7.278 5.633 -0.907 1.00 0.00 C ATOM 534 CD1 ILE A 183 6.771 2.655 -0.430 1.00 0.00 C ATOM 0 H ILE A 183 10.691 3.407 -1.074 1.00 0.00 H new ATOM 0 HA ILE A 183 9.197 4.940 -2.871 1.00 0.00 H new ATOM 0 HB ILE A 183 8.788 4.471 0.099 1.00 0.00 H new ATOM 0 HG12 ILE A 183 7.417 3.319 -2.350 1.00 0.00 H new ATOM 0 HG13 ILE A 183 8.655 2.504 -1.415 1.00 0.00 H new ATOM 0 HG21 ILE A 183 6.471 5.309 -0.251 1.00 0.00 H new ATOM 0 HG22 ILE A 183 7.679 6.581 -0.548 1.00 0.00 H new ATOM 0 HG23 ILE A 183 6.893 5.762 -1.919 1.00 0.00 H new ATOM 0 HD11 ILE A 183 6.430 1.694 -0.815 1.00 0.00 H new ATOM 0 HD12 ILE A 183 7.187 2.519 0.568 1.00 0.00 H new ATOM 0 HD13 ILE A 183 5.929 3.346 -0.381 1.00 0.00 H new ATOM 546 N TYR A 184 10.725 6.538 -0.381 1.00 0.00 N ATOM 547 CA TYR A 184 11.184 7.829 0.102 1.00 0.00 C ATOM 548 C TYR A 184 11.893 8.595 -0.991 1.00 0.00 C ATOM 549 O TYR A 184 11.545 9.739 -1.259 1.00 0.00 O ATOM 550 CB TYR A 184 12.100 7.656 1.336 1.00 0.00 C ATOM 551 CG TYR A 184 12.900 8.892 1.719 1.00 0.00 C ATOM 552 CD1 TYR A 184 12.303 9.986 2.335 1.00 0.00 C ATOM 553 CD2 TYR A 184 14.263 8.956 1.454 1.00 0.00 C ATOM 554 CE1 TYR A 184 13.046 11.104 2.670 1.00 0.00 C ATOM 555 CE2 TYR A 184 15.008 10.060 1.785 1.00 0.00 C ATOM 556 CZ TYR A 184 14.402 11.131 2.390 1.00 0.00 C ATOM 557 OH TYR A 184 15.154 12.238 2.718 1.00 0.00 O ATOM 0 H TYR A 184 11.031 5.749 0.188 1.00 0.00 H new ATOM 0 HA TYR A 184 10.311 8.407 0.404 1.00 0.00 H new ATOM 0 HB2 TYR A 184 11.486 7.360 2.187 1.00 0.00 H new ATOM 0 HB3 TYR A 184 12.794 6.838 1.143 1.00 0.00 H new ATOM 0 HD1 TYR A 184 11.246 9.963 2.555 1.00 0.00 H new ATOM 0 HD2 TYR A 184 14.747 8.117 0.976 1.00 0.00 H new ATOM 0 HE1 TYR A 184 12.572 11.949 3.146 1.00 0.00 H new ATOM 0 HE2 TYR A 184 16.066 10.085 1.570 1.00 0.00 H new ATOM 0 HH TYR A 184 16.086 12.091 2.453 1.00 0.00 H new ATOM 567 N GLU A 185 12.816 7.952 -1.676 1.00 0.00 N ATOM 568 CA GLU A 185 13.527 8.653 -2.739 1.00 0.00 C ATOM 569 C GLU A 185 12.640 8.914 -3.975 1.00 0.00 C ATOM 570 O GLU A 185 12.608 10.043 -4.489 1.00 0.00 O ATOM 571 CB GLU A 185 14.842 7.977 -3.087 1.00 0.00 C ATOM 572 CG GLU A 185 14.711 6.515 -3.372 1.00 0.00 C ATOM 573 CD GLU A 185 16.028 5.873 -3.658 1.00 0.00 C ATOM 574 OE1 GLU A 185 16.805 5.643 -2.714 1.00 0.00 O ATOM 575 OE2 GLU A 185 16.313 5.579 -4.831 1.00 0.00 O ATOM 0 H GLU A 185 13.089 6.980 -1.529 1.00 0.00 H new ATOM 0 HA GLU A 185 13.783 9.638 -2.347 1.00 0.00 H new ATOM 0 HB2 GLU A 185 15.274 8.470 -3.958 1.00 0.00 H new ATOM 0 HB3 GLU A 185 15.541 8.116 -2.262 1.00 0.00 H new ATOM 0 HG2 GLU A 185 14.246 6.021 -2.519 1.00 0.00 H new ATOM 0 HG3 GLU A 185 14.047 6.371 -4.224 1.00 0.00 H new ATOM 582 N TRP A 186 11.879 7.894 -4.415 1.00 0.00 N ATOM 583 CA TRP A 186 10.955 8.039 -5.549 1.00 0.00 C ATOM 584 C TRP A 186 9.936 9.129 -5.292 1.00 0.00 C ATOM 585 O TRP A 186 9.507 9.837 -6.209 1.00 0.00 O ATOM 586 CB TRP A 186 10.244 6.725 -5.879 1.00 0.00 C ATOM 587 CG TRP A 186 11.026 5.814 -6.761 1.00 0.00 C ATOM 588 CD1 TRP A 186 11.705 4.696 -6.400 1.00 0.00 C ATOM 589 CD2 TRP A 186 11.199 5.952 -8.177 1.00 0.00 C ATOM 590 NE1 TRP A 186 12.288 4.129 -7.497 1.00 0.00 N ATOM 591 CE2 TRP A 186 11.994 4.878 -8.601 1.00 0.00 C ATOM 592 CE3 TRP A 186 10.754 6.881 -9.125 1.00 0.00 C ATOM 593 CZ2 TRP A 186 12.358 4.699 -9.933 1.00 0.00 C ATOM 594 CZ3 TRP A 186 11.117 6.706 -10.444 1.00 0.00 C ATOM 595 CH2 TRP A 186 11.912 5.622 -10.838 1.00 0.00 C ATOM 0 H TRP A 186 11.888 6.962 -4.001 1.00 0.00 H new ATOM 0 HA TRP A 186 11.560 8.321 -6.411 1.00 0.00 H new ATOM 0 HB2 TRP A 186 10.015 6.205 -4.949 1.00 0.00 H new ATOM 0 HB3 TRP A 186 9.292 6.950 -6.360 1.00 0.00 H new ATOM 0 HD1 TRP A 186 11.774 4.311 -5.393 1.00 0.00 H new ATOM 0 HE1 TRP A 186 12.854 3.280 -7.493 1.00 0.00 H new ATOM 0 HE3 TRP A 186 10.139 7.718 -8.829 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 12.969 3.863 -10.240 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 10.783 7.417 -11.185 1.00 0.00 H new ATOM 0 HH2 TRP A 186 12.178 5.513 -11.879 1.00 0.00 H new ATOM 606 N MET A 187 9.552 9.256 -4.052 1.00 0.00 N ATOM 607 CA MET A 187 8.664 10.258 -3.628 1.00 0.00 C ATOM 608 C MET A 187 9.310 11.592 -3.760 1.00 0.00 C ATOM 609 O MET A 187 8.784 12.421 -4.466 1.00 0.00 O ATOM 610 CB MET A 187 8.214 9.977 -2.218 1.00 0.00 C ATOM 611 CG MET A 187 6.751 10.097 -2.041 1.00 0.00 C ATOM 612 SD MET A 187 6.125 9.080 -0.709 1.00 0.00 S ATOM 613 CE MET A 187 7.080 9.644 0.661 1.00 0.00 C ATOM 0 H MET A 187 9.867 8.640 -3.302 1.00 0.00 H new ATOM 0 HA MET A 187 7.775 10.262 -4.259 1.00 0.00 H new ATOM 0 HB2 MET A 187 8.527 8.971 -1.937 1.00 0.00 H new ATOM 0 HB3 MET A 187 8.714 10.668 -1.539 1.00 0.00 H new ATOM 0 HG2 MET A 187 6.498 11.139 -1.845 1.00 0.00 H new ATOM 0 HG3 MET A 187 6.254 9.817 -2.970 1.00 0.00 H new ATOM 0 HE1 MET A 187 7.379 8.792 1.271 1.00 0.00 H new ATOM 0 HE2 MET A 187 7.969 10.160 0.297 1.00 0.00 H new ATOM 0 HE3 MET A 187 6.483 10.329 1.263 1.00 0.00 H new ATOM 623 N VAL A 188 10.504 11.776 -3.155 1.00 0.00 N ATOM 624 CA VAL A 188 11.255 13.053 -3.238 1.00 0.00 C ATOM 625 C VAL A 188 11.445 13.480 -4.716 1.00 0.00 C ATOM 626 O VAL A 188 11.556 14.658 -5.026 1.00 0.00 O ATOM 627 CB VAL A 188 12.645 12.967 -2.496 1.00 0.00 C ATOM 628 CG1 VAL A 188 13.410 14.280 -2.573 1.00 0.00 C ATOM 629 CG2 VAL A 188 12.450 12.608 -1.041 1.00 0.00 C ATOM 0 H VAL A 188 10.971 11.057 -2.603 1.00 0.00 H new ATOM 0 HA VAL A 188 10.663 13.814 -2.730 1.00 0.00 H new ATOM 0 HB VAL A 188 13.223 12.192 -3.000 1.00 0.00 H new ATOM 0 HG11 VAL A 188 14.361 14.178 -2.050 1.00 0.00 H new ATOM 0 HG12 VAL A 188 13.595 14.532 -3.617 1.00 0.00 H new ATOM 0 HG13 VAL A 188 12.823 15.071 -2.107 1.00 0.00 H new ATOM 0 HG21 VAL A 188 13.420 12.554 -0.547 1.00 0.00 H new ATOM 0 HG22 VAL A 188 11.838 13.369 -0.557 1.00 0.00 H new ATOM 0 HG23 VAL A 188 11.951 11.642 -0.968 1.00 0.00 H new ATOM 639 N ARG A 189 11.438 12.507 -5.614 1.00 0.00 N ATOM 640 CA ARG A 189 11.513 12.785 -7.046 1.00 0.00 C ATOM 641 C ARG A 189 10.266 13.548 -7.587 1.00 0.00 C ATOM 642 O ARG A 189 10.402 14.471 -8.400 1.00 0.00 O ATOM 643 CB ARG A 189 11.636 11.493 -7.867 1.00 0.00 C ATOM 644 CG ARG A 189 12.768 10.548 -7.484 1.00 0.00 C ATOM 645 CD ARG A 189 14.085 11.256 -7.241 1.00 0.00 C ATOM 646 NE ARG A 189 14.454 12.163 -8.326 1.00 0.00 N ATOM 647 CZ ARG A 189 15.395 13.102 -8.220 1.00 0.00 C ATOM 648 NH1 ARG A 189 16.216 13.108 -7.175 1.00 0.00 N ATOM 649 NH2 ARG A 189 15.543 14.000 -9.177 1.00 0.00 N ATOM 0 H ARG A 189 11.381 11.516 -5.379 1.00 0.00 H new ATOM 0 HA ARG A 189 12.400 13.408 -7.160 1.00 0.00 H new ATOM 0 HB2 ARG A 189 10.695 10.948 -7.788 1.00 0.00 H new ATOM 0 HB3 ARG A 189 11.759 11.766 -8.915 1.00 0.00 H new ATOM 0 HG2 ARG A 189 12.486 10.001 -6.584 1.00 0.00 H new ATOM 0 HG3 ARG A 189 12.901 9.811 -8.276 1.00 0.00 H new ATOM 0 HD2 ARG A 189 14.022 11.819 -6.310 1.00 0.00 H new ATOM 0 HD3 ARG A 189 14.872 10.513 -7.112 1.00 0.00 H new ATOM 0 HE ARG A 189 13.963 12.073 -9.216 1.00 0.00 H new ATOM 0 HH11 ARG A 189 16.127 12.394 -6.452 1.00 0.00 H new ATOM 0 HH12 ARG A 189 16.935 13.827 -7.096 1.00 0.00 H new ATOM 0 HH21 ARG A 189 14.937 13.975 -9.997 1.00 0.00 H new ATOM 0 HH22 ARG A 189 16.263 14.718 -9.096 1.00 0.00 H new ATOM 663 N CYS A 190 9.075 13.175 -7.136 1.00 0.00 N ATOM 664 CA CYS A 190 7.830 13.666 -7.768 1.00 0.00 C ATOM 665 C CYS A 190 6.897 14.426 -6.784 1.00 0.00 C ATOM 666 O CYS A 190 5.908 15.056 -7.184 1.00 0.00 O ATOM 667 CB CYS A 190 7.112 12.446 -8.381 1.00 0.00 C ATOM 668 SG CYS A 190 5.678 12.796 -9.425 1.00 0.00 S ATOM 0 H CYS A 190 8.932 12.544 -6.348 1.00 0.00 H new ATOM 0 HA CYS A 190 8.089 14.398 -8.533 1.00 0.00 H new ATOM 0 HB2 CYS A 190 7.836 11.885 -8.972 1.00 0.00 H new ATOM 0 HB3 CYS A 190 6.792 11.794 -7.568 1.00 0.00 H new ATOM 0 HG CYS A 190 5.091 13.879 -9.008 1.00 0.00 H new ATOM 674 N VAL A 191 7.203 14.339 -5.531 1.00 0.00 N ATOM 675 CA VAL A 191 6.446 14.943 -4.465 1.00 0.00 C ATOM 676 C VAL A 191 6.785 16.451 -4.349 1.00 0.00 C ATOM 677 O VAL A 191 7.847 16.887 -4.766 1.00 0.00 O ATOM 678 CB VAL A 191 6.863 14.243 -3.136 1.00 0.00 C ATOM 679 CG1 VAL A 191 8.216 14.737 -2.644 1.00 0.00 C ATOM 680 CG2 VAL A 191 5.805 14.311 -2.062 1.00 0.00 C ATOM 0 H VAL A 191 8.020 13.825 -5.200 1.00 0.00 H new ATOM 0 HA VAL A 191 5.380 14.833 -4.662 1.00 0.00 H new ATOM 0 HB VAL A 191 6.966 13.184 -3.372 1.00 0.00 H new ATOM 0 HG11 VAL A 191 8.474 14.227 -1.716 1.00 0.00 H new ATOM 0 HG12 VAL A 191 8.976 14.527 -3.397 1.00 0.00 H new ATOM 0 HG13 VAL A 191 8.169 15.811 -2.467 1.00 0.00 H new ATOM 0 HG21 VAL A 191 6.163 13.804 -1.166 1.00 0.00 H new ATOM 0 HG22 VAL A 191 5.591 15.354 -1.828 1.00 0.00 H new ATOM 0 HG23 VAL A 191 4.896 13.824 -2.415 1.00 0.00 H new ATOM 690 N PRO A 192 5.857 17.258 -3.894 1.00 0.00 N ATOM 691 CA PRO A 192 6.161 18.629 -3.485 1.00 0.00 C ATOM 692 C PRO A 192 6.602 18.684 -1.993 1.00 0.00 C ATOM 693 O PRO A 192 7.694 19.135 -1.661 1.00 0.00 O ATOM 694 CB PRO A 192 4.826 19.350 -3.667 1.00 0.00 C ATOM 695 CG PRO A 192 3.775 18.290 -3.546 1.00 0.00 C ATOM 696 CD PRO A 192 4.420 16.970 -3.900 1.00 0.00 C ATOM 0 HA PRO A 192 6.978 19.069 -4.058 1.00 0.00 H new ATOM 0 HB2 PRO A 192 4.692 20.123 -2.910 1.00 0.00 H new ATOM 0 HB3 PRO A 192 4.776 19.842 -4.638 1.00 0.00 H new ATOM 0 HG2 PRO A 192 3.374 18.261 -2.533 1.00 0.00 H new ATOM 0 HG3 PRO A 192 2.940 18.500 -4.214 1.00 0.00 H new ATOM 0 HD2 PRO A 192 4.166 16.196 -3.176 1.00 0.00 H new ATOM 0 HD3 PRO A 192 4.089 16.614 -4.876 1.00 0.00 H new ATOM 704 N TYR A 193 5.747 18.147 -1.136 1.00 0.00 N ATOM 705 CA TYR A 193 5.875 18.159 0.319 1.00 0.00 C ATOM 706 C TYR A 193 7.218 17.578 0.800 1.00 0.00 C ATOM 707 O TYR A 193 7.992 18.247 1.481 1.00 0.00 O ATOM 708 CB TYR A 193 4.698 17.345 0.882 1.00 0.00 C ATOM 709 CG TYR A 193 4.530 17.360 2.398 1.00 0.00 C ATOM 710 CD1 TYR A 193 5.276 16.516 3.216 1.00 0.00 C ATOM 711 CD2 TYR A 193 3.610 18.208 3.003 1.00 0.00 C ATOM 712 CE1 TYR A 193 5.114 16.519 4.585 1.00 0.00 C ATOM 713 CE2 TYR A 193 3.441 18.213 4.376 1.00 0.00 C ATOM 714 CZ TYR A 193 4.195 17.368 5.159 1.00 0.00 C ATOM 715 OH TYR A 193 4.036 17.375 6.525 1.00 0.00 O ATOM 0 H TYR A 193 4.903 17.667 -1.448 1.00 0.00 H new ATOM 0 HA TYR A 193 5.854 19.188 0.677 1.00 0.00 H new ATOM 0 HB2 TYR A 193 3.778 17.718 0.432 1.00 0.00 H new ATOM 0 HB3 TYR A 193 4.813 16.310 0.561 1.00 0.00 H new ATOM 0 HD1 TYR A 193 5.996 15.846 2.769 1.00 0.00 H new ATOM 0 HD2 TYR A 193 3.018 18.873 2.392 1.00 0.00 H new ATOM 0 HE1 TYR A 193 5.705 15.859 5.203 1.00 0.00 H new ATOM 0 HE2 TYR A 193 2.721 18.877 4.832 1.00 0.00 H new ATOM 0 HH TYR A 193 4.713 16.798 6.936 1.00 0.00 H new ATOM 725 N PHE A 194 7.507 16.348 0.411 1.00 0.00 N ATOM 726 CA PHE A 194 8.721 15.667 0.871 1.00 0.00 C ATOM 727 C PHE A 194 10.024 16.218 0.300 1.00 0.00 C ATOM 728 O PHE A 194 11.079 15.693 0.598 1.00 0.00 O ATOM 729 CB PHE A 194 8.651 14.151 0.710 1.00 0.00 C ATOM 730 CG PHE A 194 7.943 13.427 1.812 1.00 0.00 C ATOM 731 CD1 PHE A 194 6.567 13.330 1.828 1.00 0.00 C ATOM 732 CD2 PHE A 194 8.666 12.829 2.834 1.00 0.00 C ATOM 733 CE1 PHE A 194 5.918 12.654 2.839 1.00 0.00 C ATOM 734 CE2 PHE A 194 8.025 12.150 3.846 1.00 0.00 C ATOM 735 CZ PHE A 194 6.647 12.063 3.848 1.00 0.00 C ATOM 0 H PHE A 194 6.925 15.796 -0.219 1.00 0.00 H new ATOM 0 HA PHE A 194 8.748 15.892 1.937 1.00 0.00 H new ATOM 0 HB2 PHE A 194 8.152 13.924 -0.232 1.00 0.00 H new ATOM 0 HB3 PHE A 194 9.666 13.762 0.635 1.00 0.00 H new ATOM 0 HD1 PHE A 194 5.991 13.789 1.038 1.00 0.00 H new ATOM 0 HD2 PHE A 194 9.744 12.897 2.836 1.00 0.00 H new ATOM 0 HE1 PHE A 194 4.840 12.588 2.840 1.00 0.00 H new ATOM 0 HE2 PHE A 194 8.598 11.687 4.636 1.00 0.00 H new ATOM 0 HZ PHE A 194 6.141 11.532 4.640 1.00 0.00 H new ATOM 745 N LYS A 195 9.955 17.265 -0.511 1.00 0.00 N ATOM 746 CA LYS A 195 11.169 17.938 -0.969 1.00 0.00 C ATOM 747 C LYS A 195 11.909 18.497 0.235 1.00 0.00 C ATOM 748 O LYS A 195 13.053 18.139 0.493 1.00 0.00 O ATOM 749 CB LYS A 195 10.800 19.105 -1.893 1.00 0.00 C ATOM 750 CG LYS A 195 11.163 18.933 -3.355 1.00 0.00 C ATOM 751 CD LYS A 195 10.653 17.639 -3.921 1.00 0.00 C ATOM 752 CE LYS A 195 10.886 17.553 -5.418 1.00 0.00 C ATOM 753 NZ LYS A 195 12.324 17.600 -5.783 1.00 0.00 N ATOM 0 H LYS A 195 9.085 17.665 -0.863 1.00 0.00 H new ATOM 0 HA LYS A 195 11.793 17.224 -1.506 1.00 0.00 H new ATOM 0 HB2 LYS A 195 9.725 19.273 -1.823 1.00 0.00 H new ATOM 0 HB3 LYS A 195 11.288 20.006 -1.521 1.00 0.00 H new ATOM 0 HG2 LYS A 195 10.753 19.764 -3.929 1.00 0.00 H new ATOM 0 HG3 LYS A 195 12.247 18.973 -3.465 1.00 0.00 H new ATOM 0 HD2 LYS A 195 11.150 16.804 -3.426 1.00 0.00 H new ATOM 0 HD3 LYS A 195 9.587 17.545 -3.712 1.00 0.00 H new ATOM 0 HE2 LYS A 195 10.451 16.628 -5.796 1.00 0.00 H new ATOM 0 HE3 LYS A 195 10.365 18.374 -5.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 12.428 17.436 -6.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 12.713 18.533 -5.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 12.839 16.864 -5.260 1.00 0.00 H new ATOM 767 N ASP A 196 11.190 19.237 1.065 1.00 0.00 N ATOM 768 CA ASP A 196 11.797 19.884 2.228 1.00 0.00 C ATOM 769 C ASP A 196 12.181 18.848 3.232 1.00 0.00 C ATOM 770 O ASP A 196 13.236 18.918 3.875 1.00 0.00 O ATOM 771 CB ASP A 196 10.843 20.884 2.889 1.00 0.00 C ATOM 772 CG ASP A 196 10.449 22.023 2.001 1.00 0.00 C ATOM 773 OD1 ASP A 196 11.316 22.864 1.658 1.00 0.00 O ATOM 774 OD2 ASP A 196 9.263 22.109 1.621 1.00 0.00 O ATOM 0 H ASP A 196 10.190 19.407 0.960 1.00 0.00 H new ATOM 0 HA ASP A 196 12.675 20.428 1.880 1.00 0.00 H new ATOM 0 HB2 ASP A 196 9.944 20.357 3.208 1.00 0.00 H new ATOM 0 HB3 ASP A 196 11.315 21.282 3.787 1.00 0.00 H new ATOM 779 N LYS A 197 11.357 17.833 3.294 1.00 0.00 N ATOM 780 CA LYS A 197 11.507 16.756 4.242 1.00 0.00 C ATOM 781 C LYS A 197 12.674 15.877 3.822 1.00 0.00 C ATOM 782 O LYS A 197 13.226 15.146 4.628 1.00 0.00 O ATOM 783 CB LYS A 197 10.193 15.952 4.331 1.00 0.00 C ATOM 784 CG LYS A 197 8.930 16.838 4.319 1.00 0.00 C ATOM 785 CD LYS A 197 8.960 17.943 5.376 1.00 0.00 C ATOM 786 CE LYS A 197 7.911 18.997 5.082 1.00 0.00 C ATOM 787 NZ LYS A 197 7.989 20.148 6.006 1.00 0.00 N ATOM 0 H LYS A 197 10.550 17.729 2.678 1.00 0.00 H new ATOM 0 HA LYS A 197 11.720 17.155 5.234 1.00 0.00 H new ATOM 0 HB2 LYS A 197 10.146 15.254 3.495 1.00 0.00 H new ATOM 0 HB3 LYS A 197 10.201 15.357 5.244 1.00 0.00 H new ATOM 0 HG2 LYS A 197 8.820 17.290 3.333 1.00 0.00 H new ATOM 0 HG3 LYS A 197 8.053 16.212 4.482 1.00 0.00 H new ATOM 0 HD2 LYS A 197 8.784 17.514 6.362 1.00 0.00 H new ATOM 0 HD3 LYS A 197 9.948 18.403 5.400 1.00 0.00 H new ATOM 0 HE2 LYS A 197 8.032 19.349 4.058 1.00 0.00 H new ATOM 0 HE3 LYS A 197 6.920 18.548 5.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 7.251 20.839 5.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 7.847 19.820 6.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 8.924 20.596 5.924 1.00 0.00 H new ATOM 801 N GLY A 198 13.088 16.025 2.560 1.00 0.00 N ATOM 802 CA GLY A 198 14.201 15.287 2.038 1.00 0.00 C ATOM 803 C GLY A 198 15.503 15.878 2.523 1.00 0.00 C ATOM 804 O GLY A 198 16.543 15.214 2.542 1.00 0.00 O ATOM 0 H GLY A 198 12.653 16.659 1.890 1.00 0.00 H new ATOM 0 HA2 GLY A 198 14.131 14.244 2.348 1.00 0.00 H new ATOM 0 HA3 GLY A 198 14.173 15.298 0.948 1.00 0.00 H new ATOM 808 N ASP A 199 15.438 17.116 2.969 1.00 0.00 N ATOM 809 CA ASP A 199 16.616 17.829 3.437 1.00 0.00 C ATOM 810 C ASP A 199 16.489 18.135 4.892 1.00 0.00 C ATOM 811 O ASP A 199 17.224 18.965 5.437 1.00 0.00 O ATOM 812 CB ASP A 199 16.791 19.135 2.680 1.00 0.00 C ATOM 813 CG ASP A 199 17.235 18.944 1.251 1.00 0.00 C ATOM 814 OD1 ASP A 199 18.416 18.605 1.025 1.00 0.00 O ATOM 815 OD2 ASP A 199 16.420 19.116 0.323 1.00 0.00 O ATOM 0 H ASP A 199 14.574 17.656 3.018 1.00 0.00 H new ATOM 0 HA ASP A 199 17.483 17.191 3.265 1.00 0.00 H new ATOM 0 HB2 ASP A 199 15.848 19.681 2.690 1.00 0.00 H new ATOM 0 HB3 ASP A 199 17.523 19.753 3.201 1.00 0.00 H new ATOM 820 N SER A 200 15.596 17.453 5.535 1.00 0.00 N ATOM 821 CA SER A 200 15.302 17.710 6.904 1.00 0.00 C ATOM 822 C SER A 200 15.149 16.415 7.688 1.00 0.00 C ATOM 823 O SER A 200 15.189 15.320 7.113 1.00 0.00 O ATOM 824 CB SER A 200 14.031 18.546 6.983 1.00 0.00 C ATOM 825 OG SER A 200 14.218 19.829 6.415 1.00 0.00 O ATOM 0 H SER A 200 15.049 16.699 5.121 1.00 0.00 H new ATOM 0 HA SER A 200 16.130 18.259 7.352 1.00 0.00 H new ATOM 0 HB2 SER A 200 13.223 18.031 6.464 1.00 0.00 H new ATOM 0 HB3 SER A 200 13.726 18.649 8.024 1.00 0.00 H new ATOM 0 HG SER A 200 13.944 19.813 5.474 1.00 0.00 H new ATOM 831 N ASN A 201 14.942 16.545 8.997 1.00 0.00 N ATOM 832 CA ASN A 201 14.766 15.396 9.892 1.00 0.00 C ATOM 833 C ASN A 201 13.400 14.777 9.680 1.00 0.00 C ATOM 834 O ASN A 201 13.147 13.645 10.085 1.00 0.00 O ATOM 835 CB ASN A 201 14.922 15.780 11.380 1.00 0.00 C ATOM 836 CG ASN A 201 16.342 16.135 11.831 1.00 0.00 C ATOM 837 OD1 ASN A 201 17.122 16.781 11.001 1.00 0.00 O flip ATOM 838 ND2 ASN A 201 16.709 15.856 12.968 1.00 0.00 N flip ATOM 0 H ASN A 201 14.891 17.447 9.470 1.00 0.00 H new ATOM 0 HA ASN A 201 15.549 14.679 9.647 1.00 0.00 H new ATOM 0 HB2 ASN A 201 14.272 16.630 11.586 1.00 0.00 H new ATOM 0 HB3 ASN A 201 14.564 14.950 11.989 1.00 0.00 H new ATOM 0 HD21 ASN A 201 16.083 15.352 13.597 1.00 0.00 H new ATOM 0 HD22 ASN A 201 17.640 16.128 13.285 1.00 0.00 H new ATOM 845 N SER A 202 12.529 15.553 9.060 1.00 0.00 N ATOM 846 CA SER A 202 11.195 15.184 8.669 1.00 0.00 C ATOM 847 C SER A 202 11.164 13.950 7.747 1.00 0.00 C ATOM 848 O SER A 202 10.101 13.376 7.530 1.00 0.00 O ATOM 849 CB SER A 202 10.586 16.357 7.956 1.00 0.00 C ATOM 850 OG SER A 202 10.837 17.555 8.660 1.00 0.00 O ATOM 0 H SER A 202 12.755 16.514 8.804 1.00 0.00 H new ATOM 0 HA SER A 202 10.634 14.919 9.565 1.00 0.00 H new ATOM 0 HB2 SER A 202 10.996 16.429 6.948 1.00 0.00 H new ATOM 0 HB3 SER A 202 9.511 16.208 7.853 1.00 0.00 H new ATOM 0 HG SER A 202 10.434 18.308 8.179 1.00 0.00 H new ATOM 856 N SER A 203 12.309 13.581 7.180 1.00 0.00 N ATOM 857 CA SER A 203 12.432 12.361 6.415 1.00 0.00 C ATOM 858 C SER A 203 12.058 11.192 7.329 1.00 0.00 C ATOM 859 O SER A 203 10.981 10.584 7.198 1.00 0.00 O ATOM 860 CB SER A 203 13.871 12.253 5.913 1.00 0.00 C ATOM 861 OG SER A 203 14.796 12.593 6.952 1.00 0.00 O ATOM 0 H SER A 203 13.171 14.123 7.242 1.00 0.00 H new ATOM 0 HA SER A 203 11.768 12.351 5.550 1.00 0.00 H new ATOM 0 HB2 SER A 203 14.065 11.239 5.564 1.00 0.00 H new ATOM 0 HB3 SER A 203 14.015 12.916 5.060 1.00 0.00 H new ATOM 0 HG SER A 203 15.024 13.544 6.889 1.00 0.00 H new ATOM 867 N ALA A 204 12.880 10.988 8.347 1.00 0.00 N ATOM 868 CA ALA A 204 12.633 10.021 9.408 1.00 0.00 C ATOM 869 C ALA A 204 11.710 10.689 10.420 1.00 0.00 C ATOM 870 O ALA A 204 11.929 10.662 11.639 1.00 0.00 O ATOM 871 CB ALA A 204 13.952 9.619 10.054 1.00 0.00 C ATOM 0 H ALA A 204 13.755 11.500 8.462 1.00 0.00 H new ATOM 0 HA ALA A 204 12.168 9.115 9.019 1.00 0.00 H new ATOM 0 HB1 ALA A 204 13.763 8.896 10.847 1.00 0.00 H new ATOM 0 HB2 ALA A 204 14.604 9.172 9.303 1.00 0.00 H new ATOM 0 HB3 ALA A 204 14.435 10.501 10.475 1.00 0.00 H new ATOM 877 N GLY A 205 10.647 11.203 9.884 1.00 0.00 N ATOM 878 CA GLY A 205 9.685 11.974 10.580 1.00 0.00 C ATOM 879 C GLY A 205 8.339 11.644 10.030 1.00 0.00 C ATOM 880 O GLY A 205 7.546 10.920 10.636 1.00 0.00 O ATOM 0 H GLY A 205 10.422 11.085 8.896 1.00 0.00 H new ATOM 0 HA2 GLY A 205 9.723 11.757 11.647 1.00 0.00 H new ATOM 0 HA3 GLY A 205 9.893 13.038 10.463 1.00 0.00 H new ATOM 884 N TRP A 206 8.130 12.083 8.823 1.00 0.00 N ATOM 885 CA TRP A 206 6.912 11.833 8.131 1.00 0.00 C ATOM 886 C TRP A 206 6.914 10.463 7.491 1.00 0.00 C ATOM 887 O TRP A 206 5.872 9.940 7.198 1.00 0.00 O ATOM 888 CB TRP A 206 6.567 12.954 7.155 1.00 0.00 C ATOM 889 CG TRP A 206 6.263 14.233 7.858 1.00 0.00 C ATOM 890 CD1 TRP A 206 7.001 15.369 7.842 1.00 0.00 C ATOM 891 CD2 TRP A 206 5.147 14.489 8.718 1.00 0.00 C ATOM 892 NE1 TRP A 206 6.420 16.320 8.641 1.00 0.00 N ATOM 893 CE2 TRP A 206 5.276 15.802 9.187 1.00 0.00 C ATOM 894 CE3 TRP A 206 4.050 13.731 9.134 1.00 0.00 C ATOM 895 CZ2 TRP A 206 4.351 16.378 10.051 1.00 0.00 C ATOM 896 CZ3 TRP A 206 3.133 14.302 9.989 1.00 0.00 C ATOM 897 CH2 TRP A 206 3.289 15.613 10.440 1.00 0.00 C ATOM 0 H TRP A 206 8.809 12.628 8.292 1.00 0.00 H new ATOM 0 HA TRP A 206 6.107 11.827 8.866 1.00 0.00 H new ATOM 0 HB2 TRP A 206 7.400 13.107 6.469 1.00 0.00 H new ATOM 0 HB3 TRP A 206 5.708 12.658 6.552 1.00 0.00 H new ATOM 0 HD1 TRP A 206 7.914 15.506 7.282 1.00 0.00 H new ATOM 0 HE1 TRP A 206 6.781 17.260 8.802 1.00 0.00 H new ATOM 0 HE3 TRP A 206 3.923 12.715 8.791 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 4.468 17.393 10.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 2.280 13.726 10.315 1.00 0.00 H new ATOM 0 HH2 TRP A 206 2.554 16.032 11.111 1.00 0.00 H new ATOM 908 N LYS A 207 8.101 9.862 7.296 1.00 0.00 N ATOM 909 CA LYS A 207 8.162 8.457 6.867 1.00 0.00 C ATOM 910 C LYS A 207 7.585 7.589 7.941 1.00 0.00 C ATOM 911 O LYS A 207 6.886 6.616 7.663 1.00 0.00 O ATOM 912 CB LYS A 207 9.614 8.040 6.541 1.00 0.00 C ATOM 913 CG LYS A 207 9.903 6.529 6.348 1.00 0.00 C ATOM 914 CD LYS A 207 10.068 5.759 7.675 1.00 0.00 C ATOM 915 CE LYS A 207 11.341 6.136 8.407 1.00 0.00 C ATOM 916 NZ LYS A 207 11.471 5.401 9.684 1.00 0.00 N ATOM 0 H LYS A 207 9.007 10.313 7.425 1.00 0.00 H new ATOM 0 HA LYS A 207 7.577 8.336 5.955 1.00 0.00 H new ATOM 0 HB2 LYS A 207 9.916 8.558 5.631 1.00 0.00 H new ATOM 0 HB3 LYS A 207 10.256 8.405 7.343 1.00 0.00 H new ATOM 0 HG2 LYS A 207 9.090 6.082 5.776 1.00 0.00 H new ATOM 0 HG3 LYS A 207 10.810 6.414 5.755 1.00 0.00 H new ATOM 0 HD2 LYS A 207 9.210 5.959 8.317 1.00 0.00 H new ATOM 0 HD3 LYS A 207 10.072 4.688 7.472 1.00 0.00 H new ATOM 0 HE2 LYS A 207 12.202 5.923 7.774 1.00 0.00 H new ATOM 0 HE3 LYS A 207 11.346 7.209 8.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 12.478 5.247 9.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 11.037 5.956 10.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 10.990 4.482 9.606 1.00 0.00 H new ATOM 930 N ASN A 208 7.863 7.963 9.178 1.00 0.00 N ATOM 931 CA ASN A 208 7.419 7.185 10.321 1.00 0.00 C ATOM 932 C ASN A 208 5.921 7.200 10.324 1.00 0.00 C ATOM 933 O ASN A 208 5.248 6.184 10.460 1.00 0.00 O ATOM 934 CB ASN A 208 7.853 7.832 11.606 1.00 0.00 C ATOM 935 CG ASN A 208 9.298 8.147 11.715 1.00 0.00 C ATOM 936 OD1 ASN A 208 10.178 7.427 11.243 1.00 0.00 O ATOM 937 ND2 ASN A 208 9.527 9.292 12.224 1.00 0.00 N ATOM 0 H ASN A 208 8.394 8.801 9.416 1.00 0.00 H new ATOM 0 HA ASN A 208 7.836 6.181 10.249 1.00 0.00 H new ATOM 0 HB2 ASN A 208 7.289 8.756 11.734 1.00 0.00 H new ATOM 0 HB3 ASN A 208 7.581 7.175 12.432 1.00 0.00 H new ATOM 0 HD21 ASN A 208 10.480 9.655 12.255 1.00 0.00 H new ATOM 0 HD22 ASN A 208 8.758 9.846 12.601 1.00 0.00 H new ATOM 944 N SER A 209 5.426 8.382 10.111 1.00 0.00 N ATOM 945 CA SER A 209 4.046 8.681 10.088 1.00 0.00 C ATOM 946 C SER A 209 3.392 7.999 8.853 1.00 0.00 C ATOM 947 O SER A 209 2.307 7.434 8.942 1.00 0.00 O ATOM 948 CB SER A 209 3.944 10.203 10.058 1.00 0.00 C ATOM 949 OG SER A 209 2.643 10.667 10.360 1.00 0.00 O ATOM 0 H SER A 209 6.013 9.198 9.941 1.00 0.00 H new ATOM 0 HA SER A 209 3.511 8.302 10.959 1.00 0.00 H new ATOM 0 HB2 SER A 209 4.651 10.625 10.772 1.00 0.00 H new ATOM 0 HB3 SER A 209 4.234 10.563 9.071 1.00 0.00 H new ATOM 0 HG SER A 209 2.630 11.646 10.329 1.00 0.00 H new ATOM 955 N ILE A 210 4.107 8.007 7.723 1.00 0.00 N ATOM 956 CA ILE A 210 3.687 7.352 6.487 1.00 0.00 C ATOM 957 C ILE A 210 3.390 5.879 6.699 1.00 0.00 C ATOM 958 O ILE A 210 2.432 5.362 6.159 1.00 0.00 O ATOM 959 CB ILE A 210 4.736 7.548 5.336 1.00 0.00 C ATOM 960 CG1 ILE A 210 4.198 8.510 4.290 1.00 0.00 C ATOM 961 CG2 ILE A 210 5.191 6.228 4.687 1.00 0.00 C ATOM 962 CD1 ILE A 210 5.134 8.714 3.139 1.00 0.00 C ATOM 0 H ILE A 210 5.008 8.478 7.644 1.00 0.00 H new ATOM 0 HA ILE A 210 2.760 7.836 6.179 1.00 0.00 H new ATOM 0 HB ILE A 210 5.626 7.976 5.797 1.00 0.00 H new ATOM 0 HG12 ILE A 210 3.247 8.133 3.914 1.00 0.00 H new ATOM 0 HG13 ILE A 210 3.996 9.472 4.760 1.00 0.00 H new ATOM 0 HG21 ILE A 210 5.915 6.440 3.900 1.00 0.00 H new ATOM 0 HG22 ILE A 210 5.651 5.591 5.442 1.00 0.00 H new ATOM 0 HG23 ILE A 210 4.329 5.717 4.258 1.00 0.00 H new ATOM 0 HD11 ILE A 210 4.690 9.411 2.428 1.00 0.00 H new ATOM 0 HD12 ILE A 210 6.077 9.120 3.505 1.00 0.00 H new ATOM 0 HD13 ILE A 210 5.317 7.760 2.645 1.00 0.00 H new ATOM 974 N ARG A 211 4.174 5.239 7.539 1.00 0.00 N ATOM 975 CA ARG A 211 4.029 3.816 7.801 1.00 0.00 C ATOM 976 C ARG A 211 2.674 3.501 8.418 1.00 0.00 C ATOM 977 O ARG A 211 2.113 2.420 8.209 1.00 0.00 O ATOM 978 CB ARG A 211 5.204 3.231 8.603 1.00 0.00 C ATOM 979 CG ARG A 211 6.536 3.249 7.839 1.00 0.00 C ATOM 980 CD ARG A 211 7.637 2.462 8.563 1.00 0.00 C ATOM 981 NE ARG A 211 7.308 1.019 8.704 1.00 0.00 N ATOM 982 CZ ARG A 211 8.195 -0.008 8.622 1.00 0.00 C ATOM 983 NH1 ARG A 211 9.472 0.221 8.358 1.00 0.00 N ATOM 984 NH2 ARG A 211 7.787 -1.259 8.809 1.00 0.00 N ATOM 0 H ARG A 211 4.929 5.685 8.060 1.00 0.00 H new ATOM 0 HA ARG A 211 4.064 3.310 6.836 1.00 0.00 H new ATOM 0 HB2 ARG A 211 5.318 3.794 9.529 1.00 0.00 H new ATOM 0 HB3 ARG A 211 4.968 2.204 8.882 1.00 0.00 H new ATOM 0 HG2 ARG A 211 6.387 2.829 6.844 1.00 0.00 H new ATOM 0 HG3 ARG A 211 6.860 4.281 7.704 1.00 0.00 H new ATOM 0 HD2 ARG A 211 8.573 2.566 8.015 1.00 0.00 H new ATOM 0 HD3 ARG A 211 7.797 2.893 9.551 1.00 0.00 H new ATOM 0 HE ARG A 211 6.332 0.779 8.877 1.00 0.00 H new ATOM 0 HH11 ARG A 211 9.800 1.176 8.214 1.00 0.00 H new ATOM 0 HH12 ARG A 211 10.128 -0.558 8.299 1.00 0.00 H new ATOM 0 HH21 ARG A 211 6.806 -1.450 9.015 1.00 0.00 H new ATOM 0 HH22 ARG A 211 8.454 -2.028 8.747 1.00 0.00 H new ATOM 998 N HIS A 212 2.139 4.468 9.133 1.00 0.00 N ATOM 999 CA HIS A 212 0.828 4.360 9.736 1.00 0.00 C ATOM 1000 C HIS A 212 -0.235 4.405 8.641 1.00 0.00 C ATOM 1001 O HIS A 212 -1.228 3.700 8.702 1.00 0.00 O ATOM 1002 CB HIS A 212 0.634 5.504 10.748 1.00 0.00 C ATOM 1003 CG HIS A 212 -0.688 5.534 11.447 1.00 0.00 C ATOM 1004 ND1 HIS A 212 -1.013 4.722 12.501 1.00 0.00 N ATOM 1005 CD2 HIS A 212 -1.764 6.331 11.241 1.00 0.00 C ATOM 1006 CE1 HIS A 212 -2.248 5.041 12.903 1.00 0.00 C ATOM 1007 NE2 HIS A 212 -2.748 6.020 12.165 1.00 0.00 N ATOM 0 H HIS A 212 2.605 5.357 9.313 1.00 0.00 H new ATOM 0 HA HIS A 212 0.734 3.414 10.268 1.00 0.00 H new ATOM 0 HB2 HIS A 212 1.420 5.437 11.500 1.00 0.00 H new ATOM 0 HB3 HIS A 212 0.771 6.452 10.228 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -1.842 7.090 10.476 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -2.768 4.564 13.720 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -3.666 6.455 12.258 1.00 0.00 H new ATOM 1015 N ASN A 213 0.043 5.180 7.608 1.00 0.00 N ATOM 1016 CA ASN A 213 -0.860 5.362 6.466 1.00 0.00 C ATOM 1017 C ASN A 213 -1.008 4.067 5.686 1.00 0.00 C ATOM 1018 O ASN A 213 -2.080 3.767 5.180 1.00 0.00 O ATOM 1019 CB ASN A 213 -0.389 6.516 5.545 1.00 0.00 C ATOM 1020 CG ASN A 213 -0.522 7.880 6.196 1.00 0.00 C ATOM 1021 OD1 ASN A 213 0.473 8.273 6.950 1.00 0.00 O flip ATOM 1022 ND2 ASN A 213 -1.532 8.563 6.034 1.00 0.00 N flip ATOM 0 H ASN A 213 0.911 5.711 7.530 1.00 0.00 H new ATOM 0 HA ASN A 213 -1.839 5.638 6.858 1.00 0.00 H new ATOM 0 HB2 ASN A 213 0.652 6.351 5.267 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -0.971 6.500 4.624 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -2.287 8.223 5.439 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -1.614 9.469 6.495 1.00 0.00 H new ATOM 1029 N LEU A 214 0.063 3.267 5.637 1.00 0.00 N ATOM 1030 CA LEU A 214 0.004 1.961 4.971 1.00 0.00 C ATOM 1031 C LEU A 214 -0.809 0.952 5.786 1.00 0.00 C ATOM 1032 O LEU A 214 -1.154 -0.128 5.298 1.00 0.00 O ATOM 1033 CB LEU A 214 1.393 1.349 4.693 1.00 0.00 C ATOM 1034 CG LEU A 214 2.241 1.954 3.577 1.00 0.00 C ATOM 1035 CD1 LEU A 214 2.932 3.204 4.019 1.00 0.00 C ATOM 1036 CD2 LEU A 214 3.240 0.954 3.075 1.00 0.00 C ATOM 0 H LEU A 214 0.969 3.496 6.045 1.00 0.00 H new ATOM 0 HA LEU A 214 -0.481 2.157 4.015 1.00 0.00 H new ATOM 0 HB2 LEU A 214 1.971 1.403 5.616 1.00 0.00 H new ATOM 0 HB3 LEU A 214 1.251 0.292 4.467 1.00 0.00 H new ATOM 0 HG LEU A 214 1.567 2.221 2.763 1.00 0.00 H new ATOM 0 HD11 LEU A 214 3.525 3.603 3.196 1.00 0.00 H new ATOM 0 HD12 LEU A 214 2.190 3.942 4.322 1.00 0.00 H new ATOM 0 HD13 LEU A 214 3.586 2.980 4.862 1.00 0.00 H new ATOM 0 HD21 LEU A 214 3.836 1.402 2.280 1.00 0.00 H new ATOM 0 HD22 LEU A 214 3.895 0.652 3.892 1.00 0.00 H new ATOM 0 HD23 LEU A 214 2.717 0.080 2.687 1.00 0.00 H new ATOM 1048 N SER A 215 -1.084 1.293 7.023 1.00 0.00 N ATOM 1049 CA SER A 215 -1.813 0.426 7.910 1.00 0.00 C ATOM 1050 C SER A 215 -3.263 0.904 8.063 1.00 0.00 C ATOM 1051 O SER A 215 -4.055 0.311 8.816 1.00 0.00 O ATOM 1052 CB SER A 215 -1.104 0.387 9.266 1.00 0.00 C ATOM 1053 OG SER A 215 0.268 0.006 9.107 1.00 0.00 O ATOM 0 H SER A 215 -0.807 2.181 7.441 1.00 0.00 H new ATOM 0 HA SER A 215 -1.841 -0.580 7.492 1.00 0.00 H new ATOM 0 HB2 SER A 215 -1.162 1.366 9.741 1.00 0.00 H new ATOM 0 HB3 SER A 215 -1.609 -0.318 9.926 1.00 0.00 H new ATOM 0 HG SER A 215 0.794 0.785 8.828 1.00 0.00 H new ATOM 1059 N LEU A 216 -3.616 1.943 7.329 1.00 0.00 N ATOM 1060 CA LEU A 216 -4.950 2.504 7.385 1.00 0.00 C ATOM 1061 C LEU A 216 -5.763 1.996 6.228 1.00 0.00 C ATOM 1062 O LEU A 216 -5.313 2.062 5.069 1.00 0.00 O ATOM 1063 CB LEU A 216 -4.907 4.033 7.345 1.00 0.00 C ATOM 1064 CG LEU A 216 -4.176 4.723 8.492 1.00 0.00 C ATOM 1065 CD1 LEU A 216 -4.204 6.226 8.305 1.00 0.00 C ATOM 1066 CD2 LEU A 216 -4.791 4.339 9.830 1.00 0.00 C ATOM 0 H LEU A 216 -2.988 2.419 6.681 1.00 0.00 H new ATOM 0 HA LEU A 216 -5.409 2.196 8.324 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -4.438 4.337 6.409 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -5.932 4.403 7.322 1.00 0.00 H new ATOM 0 HG LEU A 216 -3.137 4.392 8.488 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -3.679 6.705 9.131 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -3.716 6.485 7.365 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -5.238 6.571 8.284 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -4.255 4.842 10.635 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -5.839 4.640 9.849 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -4.721 3.260 9.966 1.00 0.00 H new ATOM 1078 N HIS A 217 -6.955 1.480 6.535 1.00 0.00 N ATOM 1079 CA HIS A 217 -7.867 0.924 5.537 1.00 0.00 C ATOM 1080 C HIS A 217 -7.236 -0.288 4.847 1.00 0.00 C ATOM 1081 O HIS A 217 -6.221 -0.819 5.291 1.00 0.00 O ATOM 1082 CB HIS A 217 -8.287 1.996 4.485 1.00 0.00 C ATOM 1083 CG HIS A 217 -9.213 3.069 4.994 1.00 0.00 C ATOM 1084 ND1 HIS A 217 -10.559 3.130 4.687 1.00 0.00 N ATOM 1085 CD2 HIS A 217 -8.961 4.158 5.769 1.00 0.00 C ATOM 1086 CE1 HIS A 217 -11.069 4.219 5.263 1.00 0.00 C ATOM 1087 NE2 HIS A 217 -10.142 4.886 5.938 1.00 0.00 N ATOM 0 H HIS A 217 -7.315 1.437 7.488 1.00 0.00 H new ATOM 0 HA HIS A 217 -8.768 0.600 6.057 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -7.387 2.471 4.095 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -8.769 1.491 3.648 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -8.000 4.419 6.188 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -12.104 4.519 5.189 1.00 0.00 H new ATOM 0 HE2 HIS A 217 -10.265 5.748 6.469 1.00 0.00 H new ATOM 1095 N SER A 218 -7.843 -0.736 3.801 1.00 0.00 N ATOM 1096 CA SER A 218 -7.301 -1.809 3.013 1.00 0.00 C ATOM 1097 C SER A 218 -6.784 -1.221 1.713 1.00 0.00 C ATOM 1098 O SER A 218 -6.751 -1.875 0.674 1.00 0.00 O ATOM 1099 CB SER A 218 -8.408 -2.818 2.769 1.00 0.00 C ATOM 1100 OG SER A 218 -9.589 -2.160 2.341 1.00 0.00 O ATOM 0 H SER A 218 -8.733 -0.372 3.461 1.00 0.00 H new ATOM 0 HA SER A 218 -6.477 -2.314 3.518 1.00 0.00 H new ATOM 0 HB2 SER A 218 -8.092 -3.539 2.015 1.00 0.00 H new ATOM 0 HB3 SER A 218 -8.607 -3.378 3.683 1.00 0.00 H new ATOM 0 HG SER A 218 -10.294 -2.822 2.186 1.00 0.00 H new ATOM 1106 N ARG A 219 -6.328 0.018 1.800 1.00 0.00 N ATOM 1107 CA ARG A 219 -5.913 0.773 0.636 1.00 0.00 C ATOM 1108 C ARG A 219 -4.471 0.449 0.248 1.00 0.00 C ATOM 1109 O ARG A 219 -4.002 0.881 -0.759 1.00 0.00 O ATOM 1110 CB ARG A 219 -6.063 2.283 0.892 1.00 0.00 C ATOM 1111 CG ARG A 219 -5.940 3.139 -0.366 1.00 0.00 C ATOM 1112 CD ARG A 219 -5.770 4.610 -0.048 1.00 0.00 C ATOM 1113 NE ARG A 219 -6.863 5.145 0.760 1.00 0.00 N ATOM 1114 CZ ARG A 219 -6.906 6.385 1.252 1.00 0.00 C ATOM 1115 NH1 ARG A 219 -5.975 7.275 0.911 1.00 0.00 N ATOM 1116 NH2 ARG A 219 -7.907 6.737 2.049 1.00 0.00 N ATOM 0 H ARG A 219 -6.236 0.525 2.680 1.00 0.00 H new ATOM 0 HA ARG A 219 -6.560 0.486 -0.193 1.00 0.00 H new ATOM 0 HB2 ARG A 219 -7.033 2.469 1.353 1.00 0.00 H new ATOM 0 HB3 ARG A 219 -5.304 2.597 1.609 1.00 0.00 H new ATOM 0 HG2 ARG A 219 -5.088 2.796 -0.954 1.00 0.00 H new ATOM 0 HG3 ARG A 219 -6.828 3.004 -0.983 1.00 0.00 H new ATOM 0 HD2 ARG A 219 -4.828 4.756 0.481 1.00 0.00 H new ATOM 0 HD3 ARG A 219 -5.703 5.173 -0.979 1.00 0.00 H new ATOM 0 HE ARG A 219 -7.649 4.527 0.963 1.00 0.00 H new ATOM 0 HH11 ARG A 219 -5.226 7.010 0.272 1.00 0.00 H new ATOM 0 HH12 ARG A 219 -6.012 8.222 1.289 1.00 0.00 H new ATOM 0 HH21 ARG A 219 -8.636 6.062 2.281 1.00 0.00 H new ATOM 0 HH22 ARG A 219 -7.948 7.683 2.429 1.00 0.00 H new ATOM 1130 N PHE A 220 -3.794 -0.316 1.036 1.00 0.00 N ATOM 1131 CA PHE A 220 -2.414 -0.686 0.754 1.00 0.00 C ATOM 1132 C PHE A 220 -2.261 -2.145 1.063 1.00 0.00 C ATOM 1133 O PHE A 220 -3.042 -2.709 1.838 1.00 0.00 O ATOM 1134 CB PHE A 220 -1.426 0.109 1.641 1.00 0.00 C ATOM 1135 CG PHE A 220 -1.343 1.587 1.363 1.00 0.00 C ATOM 1136 CD1 PHE A 220 -2.228 2.473 1.950 1.00 0.00 C ATOM 1137 CD2 PHE A 220 -0.365 2.086 0.519 1.00 0.00 C ATOM 1138 CE1 PHE A 220 -2.141 3.825 1.699 1.00 0.00 C ATOM 1139 CE2 PHE A 220 -0.274 3.437 0.263 1.00 0.00 C ATOM 1140 CZ PHE A 220 -1.162 4.307 0.851 1.00 0.00 C ATOM 0 H PHE A 220 -4.166 -0.712 1.899 1.00 0.00 H new ATOM 0 HA PHE A 220 -2.192 -0.466 -0.290 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -1.710 -0.030 2.684 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -0.432 -0.321 1.521 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -2.996 2.101 2.612 1.00 0.00 H new ATOM 0 HD2 PHE A 220 0.336 1.407 0.055 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -2.837 4.507 2.164 1.00 0.00 H new ATOM 0 HE2 PHE A 220 0.493 3.812 -0.398 1.00 0.00 H new ATOM 0 HZ PHE A 220 -1.094 5.366 0.650 1.00 0.00 H new ATOM 1150 N MET A 221 -1.302 -2.759 0.455 1.00 0.00 N ATOM 1151 CA MET A 221 -0.991 -4.118 0.739 1.00 0.00 C ATOM 1152 C MET A 221 0.493 -4.254 0.708 1.00 0.00 C ATOM 1153 O MET A 221 1.188 -3.546 -0.033 1.00 0.00 O ATOM 1154 CB MET A 221 -1.714 -5.140 -0.169 1.00 0.00 C ATOM 1155 CG MET A 221 -1.444 -4.966 -1.631 1.00 0.00 C ATOM 1156 SD MET A 221 -2.247 -6.178 -2.693 1.00 0.00 S ATOM 1157 CE MET A 221 -1.433 -7.665 -2.132 1.00 0.00 C ATOM 0 H MET A 221 -0.710 -2.330 -0.256 1.00 0.00 H new ATOM 0 HA MET A 221 -1.371 -4.367 1.730 1.00 0.00 H new ATOM 0 HB2 MET A 221 -1.415 -6.146 0.126 1.00 0.00 H new ATOM 0 HB3 MET A 221 -2.788 -5.064 0.002 1.00 0.00 H new ATOM 0 HG2 MET A 221 -1.768 -3.969 -1.930 1.00 0.00 H new ATOM 0 HG3 MET A 221 -0.368 -5.014 -1.796 1.00 0.00 H new ATOM 0 HE1 MET A 221 -1.546 -8.447 -2.883 1.00 0.00 H new ATOM 0 HE2 MET A 221 -0.374 -7.463 -1.975 1.00 0.00 H new ATOM 0 HE3 MET A 221 -1.882 -7.994 -1.195 1.00 0.00 H new ATOM 1167 N ARG A 222 0.985 -5.096 1.533 1.00 0.00 N ATOM 1168 CA ARG A 222 2.388 -5.176 1.753 1.00 0.00 C ATOM 1169 C ARG A 222 2.888 -6.503 1.393 1.00 0.00 C ATOM 1170 O ARG A 222 2.367 -7.537 1.824 1.00 0.00 O ATOM 1171 CB ARG A 222 2.684 -4.751 3.180 1.00 0.00 C ATOM 1172 CG ARG A 222 2.204 -3.319 3.440 1.00 0.00 C ATOM 1173 CD ARG A 222 2.374 -2.862 4.876 1.00 0.00 C ATOM 1174 NE ARG A 222 1.521 -3.609 5.798 1.00 0.00 N ATOM 1175 CZ ARG A 222 0.906 -3.087 6.869 1.00 0.00 C ATOM 1176 NH1 ARG A 222 1.162 -1.841 7.253 1.00 0.00 N ATOM 1177 NH2 ARG A 222 0.073 -3.834 7.567 1.00 0.00 N ATOM 0 H ARG A 222 0.430 -5.754 2.080 1.00 0.00 H new ATOM 0 HA ARG A 222 2.930 -4.488 1.103 1.00 0.00 H new ATOM 0 HB2 ARG A 222 2.195 -5.434 3.875 1.00 0.00 H new ATOM 0 HB3 ARG A 222 3.756 -4.818 3.368 1.00 0.00 H new ATOM 0 HG2 ARG A 222 2.751 -2.639 2.786 1.00 0.00 H new ATOM 0 HG3 ARG A 222 1.151 -3.245 3.168 1.00 0.00 H new ATOM 0 HD2 ARG A 222 3.416 -2.980 5.172 1.00 0.00 H new ATOM 0 HD3 ARG A 222 2.140 -1.800 4.947 1.00 0.00 H new ATOM 0 HE ARG A 222 1.383 -4.603 5.613 1.00 0.00 H new ATOM 0 HH11 ARG A 222 1.831 -1.274 6.732 1.00 0.00 H new ATOM 0 HH12 ARG A 222 0.690 -1.452 8.069 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -0.099 -4.801 7.291 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -0.399 -3.445 8.383 1.00 0.00 H new ATOM 1191 N VAL A 223 3.888 -6.455 0.599 1.00 0.00 N ATOM 1192 CA VAL A 223 4.424 -7.573 -0.039 1.00 0.00 C ATOM 1193 C VAL A 223 5.718 -7.988 0.657 1.00 0.00 C ATOM 1194 O VAL A 223 6.488 -7.144 1.144 1.00 0.00 O ATOM 1195 CB VAL A 223 4.675 -7.219 -1.525 1.00 0.00 C ATOM 1196 CG1 VAL A 223 5.189 -8.381 -2.254 1.00 0.00 C ATOM 1197 CG2 VAL A 223 3.395 -6.749 -2.170 1.00 0.00 C ATOM 0 H VAL A 223 4.373 -5.587 0.371 1.00 0.00 H new ATOM 0 HA VAL A 223 3.732 -8.413 0.012 1.00 0.00 H new ATOM 0 HB VAL A 223 5.416 -6.421 -1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 223 5.359 -8.111 -3.296 1.00 0.00 H new ATOM 0 HG12 VAL A 223 6.128 -8.705 -1.806 1.00 0.00 H new ATOM 0 HG13 VAL A 223 4.463 -9.193 -2.203 1.00 0.00 H new ATOM 0 HG21 VAL A 223 3.583 -6.503 -3.215 1.00 0.00 H new ATOM 0 HG22 VAL A 223 2.647 -7.540 -2.113 1.00 0.00 H new ATOM 0 HG23 VAL A 223 3.029 -5.864 -1.649 1.00 0.00 H new ATOM 1207 N GLN A 224 5.943 -9.253 0.711 1.00 0.00 N ATOM 1208 CA GLN A 224 7.086 -9.787 1.387 1.00 0.00 C ATOM 1209 C GLN A 224 8.228 -10.017 0.425 1.00 0.00 C ATOM 1210 O GLN A 224 8.124 -9.732 -0.774 1.00 0.00 O ATOM 1211 CB GLN A 224 6.731 -11.091 2.105 1.00 0.00 C ATOM 1212 CG GLN A 224 5.789 -10.913 3.280 1.00 0.00 C ATOM 1213 CD GLN A 224 5.420 -12.223 3.976 1.00 0.00 C ATOM 1214 OE1 GLN A 224 6.323 -13.178 3.992 1.00 0.00 O flip ATOM 1215 NE2 GLN A 224 4.316 -12.362 4.518 1.00 0.00 N flip ATOM 0 H GLN A 224 5.339 -9.957 0.286 1.00 0.00 H new ATOM 0 HA GLN A 224 7.405 -9.055 2.129 1.00 0.00 H new ATOM 0 HB2 GLN A 224 6.276 -11.776 1.389 1.00 0.00 H new ATOM 0 HB3 GLN A 224 7.649 -11.561 2.457 1.00 0.00 H new ATOM 0 HG2 GLN A 224 6.250 -10.244 4.006 1.00 0.00 H new ATOM 0 HG3 GLN A 224 4.877 -10.427 2.933 1.00 0.00 H new ATOM 0 HE21 GLN A 224 3.635 -11.603 4.490 1.00 0.00 H new ATOM 0 HE22 GLN A 224 4.087 -13.235 4.993 1.00 0.00 H new ATOM 1314 N SER A 232 11.050 -5.926 2.568 1.00 0.00 N ATOM 1315 CA SER A 232 9.635 -5.902 2.234 1.00 0.00 C ATOM 1316 C SER A 232 9.295 -4.802 1.228 1.00 0.00 C ATOM 1317 O SER A 232 9.876 -3.712 1.237 1.00 0.00 O ATOM 1318 CB SER A 232 8.759 -5.821 3.486 1.00 0.00 C ATOM 1319 OG SER A 232 8.991 -6.947 4.333 1.00 0.00 O ATOM 0 HA SER A 232 9.411 -6.850 1.745 1.00 0.00 H new ATOM 0 HB2 SER A 232 8.974 -4.900 4.028 1.00 0.00 H new ATOM 0 HB3 SER A 232 7.708 -5.784 3.200 1.00 0.00 H new ATOM 0 HG SER A 232 9.911 -7.262 4.214 1.00 0.00 H new ATOM 1325 N TRP A 233 8.391 -5.098 0.337 1.00 0.00 N ATOM 1326 CA TRP A 233 7.984 -4.114 -0.609 1.00 0.00 C ATOM 1327 C TRP A 233 6.619 -3.658 -0.189 1.00 0.00 C ATOM 1328 O TRP A 233 5.834 -4.443 0.363 1.00 0.00 O ATOM 1329 CB TRP A 233 7.859 -4.643 -2.019 1.00 0.00 C ATOM 1330 CG TRP A 233 8.916 -5.567 -2.526 1.00 0.00 C ATOM 1331 CD1 TRP A 233 8.899 -6.920 -2.457 1.00 0.00 C ATOM 1332 CD2 TRP A 233 10.104 -5.218 -3.243 1.00 0.00 C ATOM 1333 NE1 TRP A 233 10.002 -7.437 -3.072 1.00 0.00 N ATOM 1334 CE2 TRP A 233 10.764 -6.418 -3.557 1.00 0.00 C ATOM 1335 CE3 TRP A 233 10.678 -4.016 -3.642 1.00 0.00 C ATOM 1336 CZ2 TRP A 233 11.964 -6.450 -4.254 1.00 0.00 C ATOM 1337 CZ3 TRP A 233 11.871 -4.049 -4.334 1.00 0.00 C ATOM 1338 CH2 TRP A 233 12.501 -5.257 -4.633 1.00 0.00 C ATOM 0 H TRP A 233 7.930 -6.004 0.251 1.00 0.00 H new ATOM 0 HA TRP A 233 8.739 -3.328 -0.621 1.00 0.00 H new ATOM 0 HB2 TRP A 233 6.902 -5.159 -2.097 1.00 0.00 H new ATOM 0 HB3 TRP A 233 7.815 -3.787 -2.692 1.00 0.00 H new ATOM 0 HD1 TRP A 233 8.124 -7.505 -1.984 1.00 0.00 H new ATOM 0 HE1 TRP A 233 10.221 -8.430 -3.155 1.00 0.00 H new ATOM 0 HE3 TRP A 233 10.199 -3.075 -3.415 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 12.453 -7.384 -4.487 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 12.326 -3.122 -4.650 1.00 0.00 H new ATOM 0 HH2 TRP A 233 13.434 -5.246 -5.176 1.00 0.00 H new ATOM 1349 N TRP A 234 6.313 -2.454 -0.442 1.00 0.00 N ATOM 1350 CA TRP A 234 5.056 -1.925 -0.027 1.00 0.00 C ATOM 1351 C TRP A 234 4.342 -1.393 -1.270 1.00 0.00 C ATOM 1352 O TRP A 234 5.013 -0.838 -2.166 1.00 0.00 O ATOM 1353 CB TRP A 234 5.292 -0.801 0.992 1.00 0.00 C ATOM 1354 CG TRP A 234 6.412 -1.071 2.004 1.00 0.00 C ATOM 1355 CD1 TRP A 234 7.634 -0.506 1.993 1.00 0.00 C ATOM 1356 CD2 TRP A 234 6.422 -1.974 3.136 1.00 0.00 C ATOM 1357 NE1 TRP A 234 8.388 -0.969 3.041 1.00 0.00 N ATOM 1358 CE2 TRP A 234 7.677 -1.860 3.747 1.00 0.00 C ATOM 1359 CE3 TRP A 234 5.514 -2.839 3.686 1.00 0.00 C ATOM 1360 CZ2 TRP A 234 8.032 -2.582 4.879 1.00 0.00 C ATOM 1361 CZ3 TRP A 234 5.860 -3.565 4.813 1.00 0.00 C ATOM 1362 CH2 TRP A 234 7.111 -3.429 5.398 1.00 0.00 C ATOM 0 H TRP A 234 6.914 -1.797 -0.940 1.00 0.00 H new ATOM 0 HA TRP A 234 4.442 -2.690 0.448 1.00 0.00 H new ATOM 0 HB2 TRP A 234 5.524 0.117 0.451 1.00 0.00 H new ATOM 0 HB3 TRP A 234 4.365 -0.624 1.537 1.00 0.00 H new ATOM 0 HD1 TRP A 234 7.973 0.212 1.261 1.00 0.00 H new ATOM 0 HE1 TRP A 234 9.343 -0.680 3.251 1.00 0.00 H new ATOM 0 HE3 TRP A 234 4.535 -2.954 3.244 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 9.007 -2.472 5.329 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 5.144 -4.249 5.244 1.00 0.00 H new ATOM 0 HH2 TRP A 234 7.353 -4.006 6.278 1.00 0.00 H new ATOM 1373 N ILE A 235 3.019 -1.635 -1.380 1.00 0.00 N ATOM 1374 CA ILE A 235 2.238 -1.177 -2.544 1.00 0.00 C ATOM 1375 C ILE A 235 0.898 -0.594 -2.071 1.00 0.00 C ATOM 1376 O ILE A 235 0.473 -0.840 -0.924 1.00 0.00 O ATOM 1377 CB ILE A 235 1.908 -2.351 -3.550 1.00 0.00 C ATOM 1378 CG1 ILE A 235 0.614 -2.998 -3.225 1.00 0.00 C ATOM 1379 CG2 ILE A 235 2.969 -3.427 -3.511 1.00 0.00 C ATOM 1380 CD1 ILE A 235 0.019 -3.666 -4.388 1.00 0.00 C ATOM 0 H ILE A 235 2.474 -2.141 -0.682 1.00 0.00 H new ATOM 0 HA ILE A 235 2.848 -0.432 -3.054 1.00 0.00 H new ATOM 0 HB ILE A 235 1.865 -1.896 -4.539 1.00 0.00 H new ATOM 0 HG12 ILE A 235 0.764 -3.726 -2.428 1.00 0.00 H new ATOM 0 HG13 ILE A 235 -0.080 -2.248 -2.845 1.00 0.00 H new ATOM 0 HG21 ILE A 235 2.711 -4.218 -4.214 1.00 0.00 H new ATOM 0 HG22 ILE A 235 3.933 -2.998 -3.785 1.00 0.00 H new ATOM 0 HG23 ILE A 235 3.030 -3.842 -2.505 1.00 0.00 H new ATOM 0 HD11 ILE A 235 -0.927 -4.125 -4.100 1.00 0.00 H new ATOM 0 HD12 ILE A 235 -0.158 -2.935 -5.177 1.00 0.00 H new ATOM 0 HD13 ILE A 235 0.699 -4.436 -4.753 1.00 0.00 H new ATOM 1392 N ILE A 236 0.223 0.143 -2.941 1.00 0.00 N ATOM 1393 CA ILE A 236 -1.129 0.586 -2.658 1.00 0.00 C ATOM 1394 C ILE A 236 -2.032 -0.527 -3.198 1.00 0.00 C ATOM 1395 O ILE A 236 -1.807 -1.001 -4.311 1.00 0.00 O ATOM 1396 CB ILE A 236 -1.499 1.903 -3.394 1.00 0.00 C ATOM 1397 CG1 ILE A 236 -0.390 2.919 -3.348 1.00 0.00 C ATOM 1398 CG2 ILE A 236 -2.789 2.518 -2.896 1.00 0.00 C ATOM 1399 CD1 ILE A 236 0.253 3.057 -4.670 1.00 0.00 C ATOM 0 H ILE A 236 0.590 0.444 -3.844 1.00 0.00 H new ATOM 0 HA ILE A 236 -1.238 0.779 -1.591 1.00 0.00 H new ATOM 0 HB ILE A 236 -1.652 1.612 -4.433 1.00 0.00 H new ATOM 0 HG12 ILE A 236 -0.787 3.883 -3.030 1.00 0.00 H new ATOM 0 HG13 ILE A 236 0.352 2.620 -2.608 1.00 0.00 H new ATOM 0 HG21 ILE A 236 -2.992 3.435 -3.449 1.00 0.00 H new ATOM 0 HG22 ILE A 236 -3.609 1.815 -3.045 1.00 0.00 H new ATOM 0 HG23 ILE A 236 -2.697 2.748 -1.835 1.00 0.00 H new ATOM 0 HD11 ILE A 236 1.051 3.797 -4.611 1.00 0.00 H new ATOM 0 HD12 ILE A 236 0.670 2.097 -4.974 1.00 0.00 H new ATOM 0 HD13 ILE A 236 -0.487 3.379 -5.403 1.00 0.00 H new ATOM 1411 N ASN A 237 -3.019 -0.926 -2.445 1.00 0.00 N ATOM 1412 CA ASN A 237 -3.883 -2.065 -2.774 1.00 0.00 C ATOM 1413 C ASN A 237 -5.014 -1.575 -3.652 1.00 0.00 C ATOM 1414 O ASN A 237 -5.869 -0.818 -3.197 1.00 0.00 O ATOM 1415 CB ASN A 237 -4.492 -2.631 -1.483 1.00 0.00 C ATOM 1416 CG ASN A 237 -5.164 -3.994 -1.624 1.00 0.00 C ATOM 1417 OD1 ASN A 237 -5.665 -4.364 -2.681 1.00 0.00 O ATOM 1418 ND2 ASN A 237 -5.203 -4.729 -0.535 1.00 0.00 N ATOM 0 H ASN A 237 -3.264 -0.471 -1.565 1.00 0.00 H new ATOM 0 HA ASN A 237 -3.300 -2.833 -3.283 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -3.705 -2.708 -0.732 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -5.226 -1.920 -1.104 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -5.661 -5.640 -0.551 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -4.775 -4.388 0.326 1.00 0.00 H new ATOM 1425 N PRO A 238 -5.011 -1.940 -4.918 1.00 0.00 N ATOM 1426 CA PRO A 238 -6.081 -1.566 -5.825 1.00 0.00 C ATOM 1427 C PRO A 238 -7.261 -2.550 -5.728 1.00 0.00 C ATOM 1428 O PRO A 238 -8.423 -2.187 -5.944 1.00 0.00 O ATOM 1429 CB PRO A 238 -5.402 -1.663 -7.194 1.00 0.00 C ATOM 1430 CG PRO A 238 -4.339 -2.707 -7.027 1.00 0.00 C ATOM 1431 CD PRO A 238 -3.945 -2.708 -5.585 1.00 0.00 C ATOM 0 HA PRO A 238 -6.504 -0.584 -5.614 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -6.115 -1.946 -7.969 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -4.972 -0.706 -7.490 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -4.712 -3.687 -7.325 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -3.480 -2.487 -7.661 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -3.879 -3.722 -5.191 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -2.969 -2.245 -5.439 1.00 0.00 H new ATOM 1439 N ASP A 239 -6.930 -3.765 -5.319 1.00 0.00 N ATOM 1440 CA ASP A 239 -7.832 -4.905 -5.250 1.00 0.00 C ATOM 1441 C ASP A 239 -7.032 -6.107 -4.789 1.00 0.00 C ATOM 1442 O ASP A 239 -7.413 -6.826 -3.858 1.00 0.00 O ATOM 1443 CB ASP A 239 -8.443 -5.209 -6.624 1.00 0.00 C ATOM 1444 CG ASP A 239 -9.238 -6.484 -6.623 1.00 0.00 C ATOM 1445 OD1 ASP A 239 -10.356 -6.498 -6.072 1.00 0.00 O ATOM 1446 OD2 ASP A 239 -8.755 -7.488 -7.180 1.00 0.00 O ATOM 0 H ASP A 239 -5.984 -3.994 -5.013 1.00 0.00 H new ATOM 0 HA ASP A 239 -8.644 -4.680 -4.558 1.00 0.00 H new ATOM 0 HB2 ASP A 239 -9.086 -4.382 -6.924 1.00 0.00 H new ATOM 0 HB3 ASP A 239 -7.647 -5.280 -7.366 1.00 0.00 H new ATOM 1451 N GLY A 240 -5.917 -6.284 -5.441 1.00 0.00 N ATOM 1452 CA GLY A 240 -4.987 -7.336 -5.151 1.00 0.00 C ATOM 1453 C GLY A 240 -3.933 -7.307 -6.205 1.00 0.00 C ATOM 1454 O GLY A 240 -3.965 -8.100 -7.141 1.00 0.00 O ATOM 0 H GLY A 240 -5.623 -5.682 -6.211 1.00 0.00 H new ATOM 0 HA2 GLY A 240 -4.546 -7.196 -4.164 1.00 0.00 H new ATOM 0 HA3 GLY A 240 -5.492 -8.302 -5.141 1.00 0.00 H new ATOM 1458 N GLY A 241 -3.028 -6.363 -6.070 1.00 0.00 N ATOM 1459 CA GLY A 241 -2.061 -6.094 -7.107 1.00 0.00 C ATOM 1460 C GLY A 241 -0.993 -7.146 -7.236 1.00 0.00 C ATOM 1461 O GLY A 241 -1.082 -8.031 -8.079 1.00 0.00 O ATOM 0 H GLY A 241 -2.943 -5.767 -5.247 1.00 0.00 H new ATOM 0 HA2 GLY A 241 -2.582 -6.001 -8.060 1.00 0.00 H new ATOM 0 HA3 GLY A 241 -1.587 -5.133 -6.907 1.00 0.00 H new ATOM 1465 N LYS A 242 0.014 -7.046 -6.409 1.00 0.00 N ATOM 1466 CA LYS A 242 1.155 -7.943 -6.473 1.00 0.00 C ATOM 1467 C LYS A 242 0.925 -9.165 -5.613 1.00 0.00 C ATOM 1468 O LYS A 242 0.001 -9.190 -4.796 1.00 0.00 O ATOM 1469 CB LYS A 242 2.452 -7.237 -6.022 1.00 0.00 C ATOM 1470 CG LYS A 242 3.155 -6.280 -7.023 1.00 0.00 C ATOM 1471 CD LYS A 242 2.325 -5.070 -7.480 1.00 0.00 C ATOM 1472 CE LYS A 242 1.439 -5.368 -8.693 1.00 0.00 C ATOM 1473 NZ LYS A 242 2.209 -5.815 -9.876 1.00 0.00 N ATOM 0 H LYS A 242 0.074 -6.345 -5.671 1.00 0.00 H new ATOM 0 HA LYS A 242 1.267 -8.249 -7.513 1.00 0.00 H new ATOM 0 HB2 LYS A 242 2.224 -6.667 -5.121 1.00 0.00 H new ATOM 0 HB3 LYS A 242 3.169 -8.008 -5.739 1.00 0.00 H new ATOM 0 HG2 LYS A 242 4.074 -5.915 -6.565 1.00 0.00 H new ATOM 0 HG3 LYS A 242 3.444 -6.853 -7.904 1.00 0.00 H new ATOM 0 HD2 LYS A 242 1.698 -4.735 -6.654 1.00 0.00 H new ATOM 0 HD3 LYS A 242 2.998 -4.247 -7.723 1.00 0.00 H new ATOM 0 HE2 LYS A 242 0.714 -6.137 -8.426 1.00 0.00 H new ATOM 0 HE3 LYS A 242 0.873 -4.473 -8.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 1.665 -5.616 -10.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 3.116 -5.307 -9.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 2.388 -6.837 -9.808 1.00 0.00 H new