USER MOD reduce.3.24.130724 H: found=0, std=0, add=620, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 621 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 179 THR OG1 : rot -160:sc= 0 USER MOD Single : A 180 TYR OH : rot 30:sc= -0.151 USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 MET CE :methyl 178:sc= -2.87! (180deg=-3.01!) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 SER OG : rot 70:sc= 1 USER MOD Single : A 188 MET CE :methyl 138:sc= -0.876 (180deg=-2.63!) USER MOD Single : A 190 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 192 ASN : amide:sc= -2.23! C(o=-2.2!,f=-1.3!) USER MOD Single : A 195 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0235) USER MOD Single : A 197 SER OG : rot -112:sc= -2.69! USER MOD Single : A 198 SER OG : rot -160:sc=0.000889 USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 204 LYS NZ :NH3+ -169:sc=-0.00473 (180deg=-0.146) USER MOD Single : A 205 TYR OH : rot 180:sc= 0 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 209 THR OG1 : rot 134:sc= 0.333 USER MOD Single : A 211 SER OG : rot -102:sc= 0.00143 USER MOD Single : A 212 SER OG : rot 180:sc= 0.0437 USER MOD Single : A 213 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 215 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 216 THR OG1 : rot 118:sc= -1.21 USER MOD Single : A 217 SER OG : rot -11:sc= 0.987 USER MOD Single : A 218 SER OG : rot 180:sc= 0 USER MOD Single : A 219 ASN : amide:sc= 0.454 K(o=0.45,f=-0.43) USER MOD Single : A 222 TYR OH : rot 180:sc= 0 USER MOD Single : A 225 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 226 SER OG : rot 77:sc= 1.04 USER MOD Single : A 229 LYS NZ :NH3+ 150:sc= -0.812 (180deg=-2.25!) USER MOD Single : A 230 LYS NZ :NH3+ -154:sc= 1.25 (180deg=-0.313) USER MOD Single : A 231 CYS SG : rot 61:sc= 0.583 USER MOD Single : A 234 ASN : amide:sc= -2.71! K(o=-2.7!,f=-0.86) USER MOD Single : A 239 GLN : amide:sc= -0.94 K(o=-0.94,f=-2.9!) USER MOD Single : A 241 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0799) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : A 248 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 250 ASN : amide:sc= -0.249 X(o=-0.25,f=-0.69) USER MOD Single : A 251 LYS NZ :NH3+ -172:sc= -0.0107 (180deg=-0.11) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 178 -10.564 0.551 10.219 1.00 0.00 N ATOM 94 CA LEU A 178 -9.156 0.234 10.056 1.00 0.00 C ATOM 95 C LEU A 178 -8.573 1.155 9.001 1.00 0.00 C ATOM 96 O LEU A 178 -9.094 1.240 7.886 1.00 0.00 O ATOM 97 CB LEU A 178 -8.952 -1.231 9.641 1.00 0.00 C ATOM 98 CG LEU A 178 -9.285 -2.284 10.705 1.00 0.00 C ATOM 99 CD1 LEU A 178 -10.789 -2.457 10.851 1.00 0.00 C ATOM 100 CD2 LEU A 178 -8.634 -3.611 10.354 1.00 0.00 C ATOM 0 HA LEU A 178 -8.650 0.377 11.011 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -9.564 -1.427 8.760 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -7.912 -1.362 9.342 1.00 0.00 H new ATOM 0 HG LEU A 178 -8.890 -1.938 11.660 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -10.997 -3.209 11.612 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -11.237 -1.509 11.147 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -11.213 -2.777 9.899 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -8.878 -4.349 11.118 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -9.003 -3.953 9.387 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -7.553 -3.484 10.305 1.00 0.00 H new ATOM 112 N THR A 179 -7.591 1.939 9.403 1.00 0.00 N ATOM 113 CA THR A 179 -7.016 2.950 8.537 1.00 0.00 C ATOM 114 C THR A 179 -6.244 2.334 7.377 1.00 0.00 C ATOM 115 O THR A 179 -5.826 1.171 7.437 1.00 0.00 O ATOM 116 CB THR A 179 -6.096 3.896 9.331 1.00 0.00 C ATOM 117 OG1 THR A 179 -5.196 3.140 10.151 1.00 0.00 O ATOM 118 CG2 THR A 179 -6.917 4.834 10.199 1.00 0.00 C ATOM 0 H THR A 179 -7.172 1.894 10.332 1.00 0.00 H new ATOM 0 HA THR A 179 -7.847 3.522 8.124 1.00 0.00 H new ATOM 0 HB THR A 179 -5.519 4.489 8.621 1.00 0.00 H new ATOM 0 HG1 THR A 179 -4.848 3.711 10.867 1.00 0.00 H new ATOM 0 HG21 THR A 179 -6.250 5.495 10.753 1.00 0.00 H new ATOM 0 HG22 THR A 179 -7.577 5.430 9.568 1.00 0.00 H new ATOM 0 HG23 THR A 179 -7.514 4.251 10.900 1.00 0.00 H new ATOM 126 N TYR A 180 -6.065 3.120 6.323 1.00 0.00 N ATOM 127 CA TYR A 180 -5.338 2.675 5.144 1.00 0.00 C ATOM 128 C TYR A 180 -3.929 2.229 5.517 1.00 0.00 C ATOM 129 O TYR A 180 -3.480 1.173 5.089 1.00 0.00 O ATOM 130 CB TYR A 180 -5.281 3.786 4.090 1.00 0.00 C ATOM 131 CG TYR A 180 -6.571 3.980 3.317 1.00 0.00 C ATOM 132 CD1 TYR A 180 -7.793 4.107 3.966 1.00 0.00 C ATOM 133 CD2 TYR A 180 -6.558 4.037 1.931 1.00 0.00 C ATOM 134 CE1 TYR A 180 -8.967 4.280 3.252 1.00 0.00 C ATOM 135 CE2 TYR A 180 -7.724 4.211 1.212 1.00 0.00 C ATOM 136 CZ TYR A 180 -8.926 4.333 1.875 1.00 0.00 C ATOM 137 OH TYR A 180 -10.089 4.500 1.154 1.00 0.00 O ATOM 0 H TYR A 180 -6.417 4.076 6.262 1.00 0.00 H new ATOM 0 HA TYR A 180 -5.871 1.824 4.720 1.00 0.00 H new ATOM 0 HB2 TYR A 180 -5.021 4.724 4.581 1.00 0.00 H new ATOM 0 HB3 TYR A 180 -4.480 3.562 3.386 1.00 0.00 H new ATOM 0 HD1 TYR A 180 -7.828 4.070 5.045 1.00 0.00 H new ATOM 0 HD2 TYR A 180 -5.619 3.944 1.405 1.00 0.00 H new ATOM 0 HE1 TYR A 180 -9.910 4.373 3.771 1.00 0.00 H new ATOM 0 HE2 TYR A 180 -7.694 4.251 0.133 1.00 0.00 H new ATOM 0 HH TYR A 180 -10.731 5.018 1.684 1.00 0.00 H new ATOM 147 N LYS A 181 -3.265 3.018 6.359 1.00 0.00 N ATOM 148 CA LYS A 181 -1.912 2.705 6.815 1.00 0.00 C ATOM 149 C LYS A 181 -1.846 1.335 7.495 1.00 0.00 C ATOM 150 O LYS A 181 -0.898 0.577 7.291 1.00 0.00 O ATOM 151 CB LYS A 181 -1.402 3.804 7.757 1.00 0.00 C ATOM 152 CG LYS A 181 -2.331 4.102 8.926 1.00 0.00 C ATOM 153 CD LYS A 181 -1.893 5.334 9.697 1.00 0.00 C ATOM 154 CE LYS A 181 -2.899 5.696 10.778 1.00 0.00 C ATOM 155 NZ LYS A 181 -2.529 6.944 11.496 1.00 0.00 N ATOM 0 H LYS A 181 -3.645 3.884 6.741 1.00 0.00 H new ATOM 0 HA LYS A 181 -1.265 2.663 5.938 1.00 0.00 H new ATOM 0 HB2 LYS A 181 -0.428 3.510 8.147 1.00 0.00 H new ATOM 0 HB3 LYS A 181 -1.253 4.719 7.183 1.00 0.00 H new ATOM 0 HG2 LYS A 181 -3.346 4.247 8.555 1.00 0.00 H new ATOM 0 HG3 LYS A 181 -2.357 3.244 9.597 1.00 0.00 H new ATOM 0 HD2 LYS A 181 -0.918 5.154 10.150 1.00 0.00 H new ATOM 0 HD3 LYS A 181 -1.776 6.173 9.011 1.00 0.00 H new ATOM 0 HE2 LYS A 181 -3.885 5.816 10.329 1.00 0.00 H new ATOM 0 HE3 LYS A 181 -2.972 4.876 11.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 -3.243 7.151 12.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 -1.600 6.822 11.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 -2.484 7.733 10.820 1.00 0.00 H new ATOM 169 N GLU A 182 -2.887 0.995 8.244 1.00 0.00 N ATOM 170 CA GLU A 182 -2.974 -0.312 8.882 1.00 0.00 C ATOM 171 C GLU A 182 -3.185 -1.409 7.847 1.00 0.00 C ATOM 172 O GLU A 182 -2.525 -2.449 7.882 1.00 0.00 O ATOM 173 CB GLU A 182 -4.112 -0.334 9.903 1.00 0.00 C ATOM 174 CG GLU A 182 -3.752 0.307 11.231 1.00 0.00 C ATOM 175 CD GLU A 182 -2.682 -0.467 11.973 1.00 0.00 C ATOM 176 OE1 GLU A 182 -1.518 -0.467 11.516 1.00 0.00 O ATOM 177 OE2 GLU A 182 -2.984 -1.047 13.037 1.00 0.00 O ATOM 0 H GLU A 182 -3.683 1.606 8.425 1.00 0.00 H new ATOM 0 HA GLU A 182 -2.032 -0.498 9.397 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -4.975 0.182 9.483 1.00 0.00 H new ATOM 0 HB3 GLU A 182 -4.412 -1.367 10.078 1.00 0.00 H new ATOM 0 HG2 GLU A 182 -3.406 1.326 11.058 1.00 0.00 H new ATOM 0 HG3 GLU A 182 -4.645 0.375 11.853 1.00 0.00 H new ATOM 184 N MET A 183 -4.107 -1.164 6.923 1.00 0.00 N ATOM 185 CA MET A 183 -4.423 -2.131 5.880 1.00 0.00 C ATOM 186 C MET A 183 -3.212 -2.390 4.993 1.00 0.00 C ATOM 187 O MET A 183 -3.013 -3.509 4.520 1.00 0.00 O ATOM 188 CB MET A 183 -5.609 -1.651 5.037 1.00 0.00 C ATOM 189 CG MET A 183 -6.903 -1.530 5.830 1.00 0.00 C ATOM 190 SD MET A 183 -8.322 -1.130 4.793 1.00 0.00 S ATOM 191 CE MET A 183 -7.798 0.430 4.091 1.00 0.00 C ATOM 0 H MET A 183 -4.650 -0.302 6.876 1.00 0.00 H new ATOM 0 HA MET A 183 -4.699 -3.068 6.364 1.00 0.00 H new ATOM 0 HB2 MET A 183 -5.367 -0.682 4.601 1.00 0.00 H new ATOM 0 HB3 MET A 183 -5.762 -2.344 4.210 1.00 0.00 H new ATOM 0 HG2 MET A 183 -7.093 -2.468 6.352 1.00 0.00 H new ATOM 0 HG3 MET A 183 -6.786 -0.759 6.592 1.00 0.00 H new ATOM 0 HE1 MET A 183 -8.557 0.790 3.397 1.00 0.00 H new ATOM 0 HE2 MET A 183 -7.661 1.160 4.889 1.00 0.00 H new ATOM 0 HE3 MET A 183 -6.856 0.292 3.559 1.00 0.00 H new ATOM 201 N ILE A 184 -2.386 -1.365 4.811 1.00 0.00 N ATOM 202 CA ILE A 184 -1.167 -1.473 4.015 1.00 0.00 C ATOM 203 C ILE A 184 -0.241 -2.558 4.564 1.00 0.00 C ATOM 204 O ILE A 184 0.362 -3.301 3.794 1.00 0.00 O ATOM 205 CB ILE A 184 -0.415 -0.123 3.945 1.00 0.00 C ATOM 206 CG1 ILE A 184 -1.246 0.895 3.161 1.00 0.00 C ATOM 207 CG2 ILE A 184 0.957 -0.293 3.302 1.00 0.00 C ATOM 208 CD1 ILE A 184 -0.686 2.298 3.194 1.00 0.00 C ATOM 0 H ILE A 184 -2.541 -0.439 5.209 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.469 -1.751 3.005 1.00 0.00 H new ATOM 0 HB ILE A 184 -0.267 0.242 4.961 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -1.319 0.568 2.124 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.259 0.909 3.563 1.00 0.00 H new ATOM 0 HG21 ILE A 184 1.464 0.671 3.266 1.00 0.00 H new ATOM 0 HG22 ILE A 184 1.550 -0.993 3.890 1.00 0.00 H new ATOM 0 HG23 ILE A 184 0.839 -0.679 2.290 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -1.330 2.961 2.616 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -0.639 2.647 4.226 1.00 0.00 H new ATOM 0 HD13 ILE A 184 0.316 2.300 2.764 1.00 0.00 H new ATOM 220 N LEU A 185 -0.183 -2.700 5.886 1.00 0.00 N ATOM 221 CA LEU A 185 0.625 -3.752 6.507 1.00 0.00 C ATOM 222 C LEU A 185 0.148 -5.134 6.080 1.00 0.00 C ATOM 223 O LEU A 185 0.946 -6.014 5.764 1.00 0.00 O ATOM 224 CB LEU A 185 0.593 -3.654 8.028 1.00 0.00 C ATOM 225 CG LEU A 185 1.751 -2.887 8.655 1.00 0.00 C ATOM 226 CD1 LEU A 185 1.603 -1.393 8.422 1.00 0.00 C ATOM 227 CD2 LEU A 185 1.829 -3.203 10.133 1.00 0.00 C ATOM 0 H LEU A 185 -0.682 -2.104 6.547 1.00 0.00 H new ATOM 0 HA LEU A 185 1.651 -3.607 6.167 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -0.341 -3.177 8.325 1.00 0.00 H new ATOM 0 HB3 LEU A 185 0.581 -4.663 8.441 1.00 0.00 H new ATOM 0 HG LEU A 185 2.681 -3.200 8.180 1.00 0.00 H new ATOM 0 HD11 LEU A 185 2.442 -0.869 8.879 1.00 0.00 H new ATOM 0 HD12 LEU A 185 1.589 -1.191 7.351 1.00 0.00 H new ATOM 0 HD13 LEU A 185 0.671 -1.046 8.868 1.00 0.00 H new ATOM 0 HD21 LEU A 185 2.658 -2.653 10.579 1.00 0.00 H new ATOM 0 HD22 LEU A 185 0.897 -2.911 10.617 1.00 0.00 H new ATOM 0 HD23 LEU A 185 1.988 -4.273 10.268 1.00 0.00 H new ATOM 239 N LYS A 186 -1.156 -5.313 6.044 1.00 0.00 N ATOM 240 CA LYS A 186 -1.727 -6.567 5.579 1.00 0.00 C ATOM 241 C LYS A 186 -1.532 -6.708 4.071 1.00 0.00 C ATOM 242 O LYS A 186 -1.456 -7.816 3.545 1.00 0.00 O ATOM 243 CB LYS A 186 -3.218 -6.659 5.926 1.00 0.00 C ATOM 244 CG LYS A 186 -3.499 -6.894 7.407 1.00 0.00 C ATOM 245 CD LYS A 186 -3.300 -5.634 8.237 1.00 0.00 C ATOM 246 CE LYS A 186 -3.529 -5.898 9.715 1.00 0.00 C ATOM 247 NZ LYS A 186 -3.483 -4.644 10.513 1.00 0.00 N ATOM 0 H LYS A 186 -1.840 -4.612 6.329 1.00 0.00 H new ATOM 0 HA LYS A 186 -1.209 -7.381 6.085 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -3.710 -5.737 5.616 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -3.665 -7.469 5.349 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -4.522 -7.249 7.529 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -2.842 -7.680 7.779 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -2.289 -5.254 8.087 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -3.986 -4.859 7.894 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -4.496 -6.381 9.852 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -2.772 -6.591 10.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -3.644 -4.865 11.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -2.551 -4.196 10.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -4.222 -3.993 10.179 1.00 0.00 H new ATOM 261 N SER A 187 -1.550 -5.580 3.377 1.00 0.00 N ATOM 262 CA SER A 187 -1.495 -5.569 1.923 1.00 0.00 C ATOM 263 C SER A 187 -0.082 -5.799 1.374 1.00 0.00 C ATOM 264 O SER A 187 0.086 -6.555 0.424 1.00 0.00 O ATOM 265 CB SER A 187 -2.044 -4.244 1.393 1.00 0.00 C ATOM 266 OG SER A 187 -3.362 -4.019 1.862 1.00 0.00 O ATOM 0 H SER A 187 -1.603 -4.654 3.801 1.00 0.00 H new ATOM 0 HA SER A 187 -2.110 -6.400 1.578 1.00 0.00 H new ATOM 0 HB2 SER A 187 -1.397 -3.426 1.708 1.00 0.00 H new ATOM 0 HB3 SER A 187 -2.038 -4.253 0.303 1.00 0.00 H new ATOM 0 HG SER A 187 -3.339 -3.826 2.823 1.00 0.00 H new ATOM 272 N MET A 188 0.905 -5.056 1.874 1.00 0.00 N ATOM 273 CA MET A 188 2.251 -5.100 1.300 1.00 0.00 C ATOM 274 C MET A 188 3.163 -6.089 2.038 1.00 0.00 C ATOM 275 O MET A 188 3.580 -7.093 1.459 1.00 0.00 O ATOM 276 CB MET A 188 2.860 -3.688 1.255 1.00 0.00 C ATOM 277 CG MET A 188 4.342 -3.672 0.929 1.00 0.00 C ATOM 278 SD MET A 188 4.722 -4.458 -0.643 1.00 0.00 S ATOM 279 CE MET A 188 6.503 -4.520 -0.527 1.00 0.00 C ATOM 0 H MET A 188 0.801 -4.423 2.667 1.00 0.00 H new ATOM 0 HA MET A 188 2.165 -5.468 0.277 1.00 0.00 H new ATOM 0 HB2 MET A 188 2.327 -3.096 0.511 1.00 0.00 H new ATOM 0 HB3 MET A 188 2.704 -3.204 2.219 1.00 0.00 H new ATOM 0 HG2 MET A 188 4.693 -2.640 0.908 1.00 0.00 H new ATOM 0 HG3 MET A 188 4.889 -4.178 1.724 1.00 0.00 H new ATOM 0 HE1 MET A 188 6.858 -5.484 -0.890 1.00 0.00 H new ATOM 0 HE2 MET A 188 6.935 -3.723 -1.132 1.00 0.00 H new ATOM 0 HE3 MET A 188 6.805 -4.390 0.512 1.00 0.00 H new ATOM 289 N PRO A 189 3.472 -5.853 3.329 1.00 0.00 N ATOM 290 CA PRO A 189 4.319 -6.764 4.109 1.00 0.00 C ATOM 291 C PRO A 189 3.756 -8.182 4.123 1.00 0.00 C ATOM 292 O PRO A 189 4.485 -9.159 3.928 1.00 0.00 O ATOM 293 CB PRO A 189 4.300 -6.169 5.520 1.00 0.00 C ATOM 294 CG PRO A 189 3.901 -4.745 5.335 1.00 0.00 C ATOM 295 CD PRO A 189 3.020 -4.710 4.130 1.00 0.00 C ATOM 0 HA PRO A 189 5.322 -6.847 3.691 1.00 0.00 H new ATOM 0 HB2 PRO A 189 3.593 -6.696 6.161 1.00 0.00 H new ATOM 0 HB3 PRO A 189 5.279 -6.246 5.994 1.00 0.00 H new ATOM 0 HG2 PRO A 189 3.374 -4.372 6.213 1.00 0.00 H new ATOM 0 HG3 PRO A 189 4.776 -4.111 5.195 1.00 0.00 H new ATOM 0 HD2 PRO A 189 1.968 -4.803 4.401 1.00 0.00 H new ATOM 0 HD3 PRO A 189 3.127 -3.773 3.584 1.00 0.00 H new ATOM 303 N GLN A 190 2.450 -8.283 4.334 1.00 0.00 N ATOM 304 CA GLN A 190 1.787 -9.576 4.374 1.00 0.00 C ATOM 305 C GLN A 190 1.136 -9.927 3.032 1.00 0.00 C ATOM 306 O GLN A 190 0.189 -10.713 2.991 1.00 0.00 O ATOM 307 CB GLN A 190 0.734 -9.594 5.485 1.00 0.00 C ATOM 308 CG GLN A 190 1.316 -9.388 6.873 1.00 0.00 C ATOM 309 CD GLN A 190 0.263 -9.443 7.965 1.00 0.00 C ATOM 310 OE1 GLN A 190 -0.443 -10.441 8.113 1.00 0.00 O ATOM 311 NE2 GLN A 190 0.155 -8.377 8.740 1.00 0.00 N ATOM 0 H GLN A 190 1.831 -7.485 4.480 1.00 0.00 H new ATOM 0 HA GLN A 190 2.548 -10.328 4.580 1.00 0.00 H new ATOM 0 HB2 GLN A 190 -0.003 -8.815 5.289 1.00 0.00 H new ATOM 0 HB3 GLN A 190 0.205 -10.547 5.459 1.00 0.00 H new ATOM 0 HG2 GLN A 190 2.070 -10.151 7.063 1.00 0.00 H new ATOM 0 HG3 GLN A 190 1.822 -8.423 6.911 1.00 0.00 H new ATOM 0 HE21 GLN A 190 0.759 -7.570 8.584 1.00 0.00 H new ATOM 0 HE22 GLN A 190 -0.532 -8.362 9.493 1.00 0.00 H new ATOM 320 N LEU A 191 1.681 -9.402 1.935 1.00 0.00 N ATOM 321 CA LEU A 191 1.165 -9.731 0.603 1.00 0.00 C ATOM 322 C LEU A 191 1.453 -11.191 0.277 1.00 0.00 C ATOM 323 O LEU A 191 0.543 -11.958 -0.047 1.00 0.00 O ATOM 324 CB LEU A 191 1.780 -8.818 -0.472 1.00 0.00 C ATOM 325 CG LEU A 191 1.273 -9.047 -1.904 1.00 0.00 C ATOM 326 CD1 LEU A 191 -0.246 -8.998 -1.953 1.00 0.00 C ATOM 327 CD2 LEU A 191 1.858 -8.007 -2.849 1.00 0.00 C ATOM 0 H LEU A 191 2.470 -8.755 1.939 1.00 0.00 H new ATOM 0 HA LEU A 191 0.087 -9.570 0.608 1.00 0.00 H new ATOM 0 HB2 LEU A 191 1.585 -7.781 -0.198 1.00 0.00 H new ATOM 0 HB3 LEU A 191 2.862 -8.952 -0.462 1.00 0.00 H new ATOM 0 HG LEU A 191 1.599 -10.037 -2.224 1.00 0.00 H new ATOM 0 HD11 LEU A 191 -0.583 -9.163 -2.977 1.00 0.00 H new ATOM 0 HD12 LEU A 191 -0.656 -9.774 -1.307 1.00 0.00 H new ATOM 0 HD13 LEU A 191 -0.590 -8.022 -1.611 1.00 0.00 H new ATOM 0 HD21 LEU A 191 1.488 -8.184 -3.859 1.00 0.00 H new ATOM 0 HD22 LEU A 191 1.560 -7.011 -2.523 1.00 0.00 H new ATOM 0 HD23 LEU A 191 2.946 -8.080 -2.843 1.00 0.00 H new ATOM 339 N ASN A 192 2.706 -11.579 0.461 1.00 0.00 N ATOM 340 CA ASN A 192 3.145 -12.956 0.266 1.00 0.00 C ATOM 341 C ASN A 192 4.642 -13.032 0.564 1.00 0.00 C ATOM 342 O ASN A 192 5.111 -12.392 1.506 1.00 0.00 O ATOM 343 CB ASN A 192 2.836 -13.436 -1.165 1.00 0.00 C ATOM 344 CG ASN A 192 2.961 -14.942 -1.324 1.00 0.00 C ATOM 345 OD1 ASN A 192 2.322 -15.712 -0.608 1.00 0.00 O ATOM 346 ND2 ASN A 192 3.780 -15.366 -2.273 1.00 0.00 N ATOM 0 H ASN A 192 3.451 -10.946 0.751 1.00 0.00 H new ATOM 0 HA ASN A 192 2.604 -13.615 0.945 1.00 0.00 H new ATOM 0 HB2 ASN A 192 1.825 -13.130 -1.435 1.00 0.00 H new ATOM 0 HB3 ASN A 192 3.515 -12.945 -1.862 1.00 0.00 H new ATOM 0 HD21 ASN A 192 3.900 -16.366 -2.433 1.00 0.00 H new ATOM 0 HD22 ASN A 192 4.291 -14.693 -2.844 1.00 0.00 H new ATOM 353 N ASP A 193 5.407 -13.674 -0.308 1.00 0.00 N ATOM 354 CA ASP A 193 6.860 -13.694 -0.181 1.00 0.00 C ATOM 355 C ASP A 193 7.461 -12.581 -1.039 1.00 0.00 C ATOM 356 O ASP A 193 8.504 -12.749 -1.678 1.00 0.00 O ATOM 357 CB ASP A 193 7.416 -15.052 -0.617 1.00 0.00 C ATOM 358 CG ASP A 193 8.860 -15.255 -0.206 1.00 0.00 C ATOM 359 OD1 ASP A 193 9.345 -14.533 0.691 1.00 0.00 O ATOM 360 OD2 ASP A 193 9.512 -16.167 -0.754 1.00 0.00 O ATOM 0 H ASP A 193 5.047 -14.188 -1.112 1.00 0.00 H new ATOM 0 HA ASP A 193 7.128 -13.532 0.863 1.00 0.00 H new ATOM 0 HB2 ASP A 193 6.805 -15.845 -0.185 1.00 0.00 H new ATOM 0 HB3 ASP A 193 7.335 -15.142 -1.700 1.00 0.00 H new ATOM 365 N GLY A 194 6.745 -11.471 -1.121 1.00 0.00 N ATOM 366 CA GLY A 194 7.165 -10.375 -1.964 1.00 0.00 C ATOM 367 C GLY A 194 8.189 -9.483 -1.296 1.00 0.00 C ATOM 368 O GLY A 194 7.957 -8.971 -0.199 1.00 0.00 O ATOM 0 H GLY A 194 5.874 -11.310 -0.614 1.00 0.00 H new ATOM 0 HA2 GLY A 194 7.584 -10.773 -2.888 1.00 0.00 H new ATOM 0 HA3 GLY A 194 6.295 -9.779 -2.239 1.00 0.00 H new ATOM 372 N LYS A 195 9.282 -9.223 -1.999 1.00 0.00 N ATOM 373 CA LYS A 195 10.286 -8.289 -1.516 1.00 0.00 C ATOM 374 C LYS A 195 9.849 -6.863 -1.816 1.00 0.00 C ATOM 375 O LYS A 195 10.094 -5.945 -1.034 1.00 0.00 O ATOM 376 CB LYS A 195 11.664 -8.563 -2.142 1.00 0.00 C ATOM 377 CG LYS A 195 11.709 -8.449 -3.663 1.00 0.00 C ATOM 378 CD LYS A 195 11.620 -9.812 -4.331 1.00 0.00 C ATOM 379 CE LYS A 195 11.774 -9.711 -5.840 1.00 0.00 C ATOM 380 NZ LYS A 195 10.635 -8.998 -6.474 1.00 0.00 N ATOM 0 H LYS A 195 9.495 -9.645 -2.903 1.00 0.00 H new ATOM 0 HA LYS A 195 10.380 -8.423 -0.438 1.00 0.00 H new ATOM 0 HB2 LYS A 195 12.386 -7.865 -1.718 1.00 0.00 H new ATOM 0 HB3 LYS A 195 11.984 -9.565 -1.857 1.00 0.00 H new ATOM 0 HG2 LYS A 195 10.886 -7.821 -4.006 1.00 0.00 H new ATOM 0 HG3 LYS A 195 12.633 -7.956 -3.964 1.00 0.00 H new ATOM 0 HD2 LYS A 195 12.395 -10.465 -3.929 1.00 0.00 H new ATOM 0 HD3 LYS A 195 10.661 -10.272 -4.093 1.00 0.00 H new ATOM 0 HE2 LYS A 195 12.702 -9.190 -6.075 1.00 0.00 H new ATOM 0 HE3 LYS A 195 11.854 -10.712 -6.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 10.749 -9.012 -7.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 9.744 -9.469 -6.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 10.614 -8.013 -6.142 1.00 0.00 H new ATOM 394 N GLY A 196 9.145 -6.707 -2.926 1.00 0.00 N ATOM 395 CA GLY A 196 8.661 -5.408 -3.324 1.00 0.00 C ATOM 396 C GLY A 196 7.397 -5.505 -4.148 1.00 0.00 C ATOM 397 O GLY A 196 7.249 -6.415 -4.965 1.00 0.00 O ATOM 0 H GLY A 196 8.900 -7.466 -3.562 1.00 0.00 H new ATOM 0 HA2 GLY A 196 8.470 -4.804 -2.437 1.00 0.00 H new ATOM 0 HA3 GLY A 196 9.431 -4.894 -3.900 1.00 0.00 H new ATOM 401 N SER A 197 6.497 -4.565 -3.937 1.00 0.00 N ATOM 402 CA SER A 197 5.233 -4.523 -4.641 1.00 0.00 C ATOM 403 C SER A 197 4.739 -3.083 -4.710 1.00 0.00 C ATOM 404 O SER A 197 4.511 -2.445 -3.683 1.00 0.00 O ATOM 405 CB SER A 197 4.209 -5.405 -3.918 1.00 0.00 C ATOM 406 OG SER A 197 2.997 -5.496 -4.642 1.00 0.00 O ATOM 0 H SER A 197 6.624 -3.805 -3.268 1.00 0.00 H new ATOM 0 HA SER A 197 5.365 -4.901 -5.655 1.00 0.00 H new ATOM 0 HB2 SER A 197 4.624 -6.403 -3.775 1.00 0.00 H new ATOM 0 HB3 SER A 197 4.012 -4.997 -2.927 1.00 0.00 H new ATOM 0 HG SER A 197 2.286 -5.037 -4.148 1.00 0.00 H new ATOM 412 N SER A 198 4.655 -2.544 -5.917 1.00 0.00 N ATOM 413 CA SER A 198 4.245 -1.163 -6.104 1.00 0.00 C ATOM 414 C SER A 198 2.740 -0.999 -5.893 1.00 0.00 C ATOM 415 O SER A 198 2.027 -1.977 -5.641 1.00 0.00 O ATOM 416 CB SER A 198 4.640 -0.685 -7.502 1.00 0.00 C ATOM 417 OG SER A 198 4.129 -1.553 -8.502 1.00 0.00 O ATOM 0 H SER A 198 4.866 -3.043 -6.781 1.00 0.00 H new ATOM 0 HA SER A 198 4.756 -0.552 -5.359 1.00 0.00 H new ATOM 0 HB2 SER A 198 4.262 0.324 -7.665 1.00 0.00 H new ATOM 0 HB3 SER A 198 5.726 -0.635 -7.579 1.00 0.00 H new ATOM 0 HG SER A 198 4.635 -1.429 -9.332 1.00 0.00 H new ATOM 423 N ARG A 199 2.253 0.226 -6.089 1.00 0.00 N ATOM 424 CA ARG A 199 0.824 0.518 -5.999 1.00 0.00 C ATOM 425 C ARG A 199 0.039 -0.354 -6.972 1.00 0.00 C ATOM 426 O ARG A 199 -1.122 -0.673 -6.731 1.00 0.00 O ATOM 427 CB ARG A 199 0.539 1.992 -6.322 1.00 0.00 C ATOM 428 CG ARG A 199 0.971 2.997 -5.260 1.00 0.00 C ATOM 429 CD ARG A 199 2.475 3.216 -5.262 1.00 0.00 C ATOM 430 NE ARG A 199 3.015 3.327 -6.613 1.00 0.00 N ATOM 431 CZ ARG A 199 4.315 3.364 -6.895 1.00 0.00 C ATOM 432 NH1 ARG A 199 5.210 3.461 -5.915 1.00 0.00 N ATOM 433 NH2 ARG A 199 4.714 3.349 -8.155 1.00 0.00 N ATOM 0 H ARG A 199 2.832 1.036 -6.312 1.00 0.00 H new ATOM 0 HA ARG A 199 0.512 0.307 -4.976 1.00 0.00 H new ATOM 0 HB2 ARG A 199 1.038 2.243 -7.258 1.00 0.00 H new ATOM 0 HB3 ARG A 199 -0.532 2.107 -6.491 1.00 0.00 H new ATOM 0 HG2 ARG A 199 0.466 3.947 -5.433 1.00 0.00 H new ATOM 0 HG3 ARG A 199 0.657 2.644 -4.278 1.00 0.00 H new ATOM 0 HD2 ARG A 199 2.709 4.122 -4.704 1.00 0.00 H new ATOM 0 HD3 ARG A 199 2.961 2.389 -4.745 1.00 0.00 H new ATOM 0 HE ARG A 199 2.355 3.379 -7.389 1.00 0.00 H new ATOM 0 HH11 ARG A 199 4.900 3.507 -4.944 1.00 0.00 H new ATOM 0 HH12 ARG A 199 6.206 3.489 -6.135 1.00 0.00 H new ATOM 0 HH21 ARG A 199 4.026 3.309 -8.907 1.00 0.00 H new ATOM 0 HH22 ARG A 199 5.710 3.377 -8.375 1.00 0.00 H new ATOM 447 N ILE A 200 0.683 -0.712 -8.077 1.00 0.00 N ATOM 448 CA ILE A 200 0.055 -1.513 -9.126 1.00 0.00 C ATOM 449 C ILE A 200 -0.505 -2.823 -8.572 1.00 0.00 C ATOM 450 O ILE A 200 -1.665 -3.163 -8.811 1.00 0.00 O ATOM 451 CB ILE A 200 1.048 -1.815 -10.281 1.00 0.00 C ATOM 452 CG1 ILE A 200 1.294 -0.563 -11.137 1.00 0.00 C ATOM 453 CG2 ILE A 200 0.542 -2.950 -11.165 1.00 0.00 C ATOM 454 CD1 ILE A 200 2.171 0.479 -10.480 1.00 0.00 C ATOM 0 H ILE A 200 1.651 -0.457 -8.272 1.00 0.00 H new ATOM 0 HA ILE A 200 -0.771 -0.921 -9.521 1.00 0.00 H new ATOM 0 HB ILE A 200 1.989 -2.123 -9.825 1.00 0.00 H new ATOM 0 HG12 ILE A 200 1.753 -0.865 -12.078 1.00 0.00 H new ATOM 0 HG13 ILE A 200 0.333 -0.110 -11.382 1.00 0.00 H new ATOM 0 HG21 ILE A 200 1.260 -3.137 -11.964 1.00 0.00 H new ATOM 0 HG22 ILE A 200 0.423 -3.853 -10.566 1.00 0.00 H new ATOM 0 HG23 ILE A 200 -0.419 -2.673 -11.598 1.00 0.00 H new ATOM 0 HD11 ILE A 200 2.293 1.328 -11.152 1.00 0.00 H new ATOM 0 HD12 ILE A 200 1.706 0.814 -9.553 1.00 0.00 H new ATOM 0 HD13 ILE A 200 3.147 0.047 -10.261 1.00 0.00 H new ATOM 466 N VAL A 201 0.312 -3.552 -7.823 1.00 0.00 N ATOM 467 CA VAL A 201 -0.125 -4.817 -7.243 1.00 0.00 C ATOM 468 C VAL A 201 -0.955 -4.569 -5.987 1.00 0.00 C ATOM 469 O VAL A 201 -1.939 -5.264 -5.728 1.00 0.00 O ATOM 470 CB VAL A 201 1.070 -5.727 -6.883 1.00 0.00 C ATOM 471 CG1 VAL A 201 0.596 -7.118 -6.488 1.00 0.00 C ATOM 472 CG2 VAL A 201 2.065 -5.805 -8.029 1.00 0.00 C ATOM 0 H VAL A 201 1.274 -3.293 -7.603 1.00 0.00 H new ATOM 0 HA VAL A 201 -0.730 -5.321 -7.996 1.00 0.00 H new ATOM 0 HB VAL A 201 1.577 -5.284 -6.026 1.00 0.00 H new ATOM 0 HG11 VAL A 201 1.457 -7.739 -6.239 1.00 0.00 H new ATOM 0 HG12 VAL A 201 -0.062 -7.046 -5.622 1.00 0.00 H new ATOM 0 HG13 VAL A 201 0.053 -7.567 -7.320 1.00 0.00 H new ATOM 0 HG21 VAL A 201 2.895 -6.452 -7.747 1.00 0.00 H new ATOM 0 HG22 VAL A 201 1.572 -6.212 -8.912 1.00 0.00 H new ATOM 0 HG23 VAL A 201 2.443 -4.807 -8.252 1.00 0.00 H new ATOM 482 N LEU A 202 -0.497 -3.619 -5.179 1.00 0.00 N ATOM 483 CA LEU A 202 -1.117 -3.328 -3.893 1.00 0.00 C ATOM 484 C LEU A 202 -2.566 -2.870 -4.026 1.00 0.00 C ATOM 485 O LEU A 202 -3.435 -3.362 -3.313 1.00 0.00 O ATOM 486 CB LEU A 202 -0.312 -2.258 -3.156 1.00 0.00 C ATOM 487 CG LEU A 202 0.935 -2.769 -2.444 1.00 0.00 C ATOM 488 CD1 LEU A 202 1.669 -1.623 -1.768 1.00 0.00 C ATOM 489 CD2 LEU A 202 0.550 -3.826 -1.430 1.00 0.00 C ATOM 0 H LEU A 202 0.309 -3.033 -5.396 1.00 0.00 H new ATOM 0 HA LEU A 202 -1.120 -4.259 -3.326 1.00 0.00 H new ATOM 0 HB2 LEU A 202 -0.015 -1.491 -3.871 1.00 0.00 H new ATOM 0 HB3 LEU A 202 -0.960 -1.777 -2.423 1.00 0.00 H new ATOM 0 HG LEU A 202 1.605 -3.214 -3.180 1.00 0.00 H new ATOM 0 HD11 LEU A 202 2.557 -2.006 -1.265 1.00 0.00 H new ATOM 0 HD12 LEU A 202 1.965 -0.888 -2.517 1.00 0.00 H new ATOM 0 HD13 LEU A 202 1.012 -1.151 -1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 202 1.445 -4.188 -0.924 1.00 0.00 H new ATOM 0 HD22 LEU A 202 -0.132 -3.396 -0.697 1.00 0.00 H new ATOM 0 HD23 LEU A 202 0.060 -4.656 -1.938 1.00 0.00 H new ATOM 501 N LYS A 203 -2.807 -1.893 -4.895 1.00 0.00 N ATOM 502 CA LYS A 203 -4.137 -1.305 -5.044 1.00 0.00 C ATOM 503 C LYS A 203 -5.160 -2.356 -5.457 1.00 0.00 C ATOM 504 O LYS A 203 -6.296 -2.339 -4.988 1.00 0.00 O ATOM 505 CB LYS A 203 -4.100 -0.167 -6.068 1.00 0.00 C ATOM 506 CG LYS A 203 -5.399 0.615 -6.179 1.00 0.00 C ATOM 507 CD LYS A 203 -5.271 1.760 -7.173 1.00 0.00 C ATOM 508 CE LYS A 203 -4.934 1.248 -8.564 1.00 0.00 C ATOM 509 NZ LYS A 203 -4.726 2.351 -9.535 1.00 0.00 N ATOM 0 H LYS A 203 -2.098 -1.490 -5.508 1.00 0.00 H new ATOM 0 HA LYS A 203 -4.440 -0.903 -4.077 1.00 0.00 H new ATOM 0 HB2 LYS A 203 -3.297 0.520 -5.802 1.00 0.00 H new ATOM 0 HB3 LYS A 203 -3.854 -0.581 -7.046 1.00 0.00 H new ATOM 0 HG2 LYS A 203 -6.202 -0.052 -6.491 1.00 0.00 H new ATOM 0 HG3 LYS A 203 -5.674 1.009 -5.200 1.00 0.00 H new ATOM 0 HD2 LYS A 203 -6.204 2.322 -7.206 1.00 0.00 H new ATOM 0 HD3 LYS A 203 -4.496 2.449 -6.839 1.00 0.00 H new ATOM 0 HE2 LYS A 203 -4.034 0.635 -8.515 1.00 0.00 H new ATOM 0 HE3 LYS A 203 -5.739 0.604 -8.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 203 -4.499 1.953 -10.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 203 -5.593 2.921 -9.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 203 -3.940 2.952 -9.214 1.00 0.00 H new ATOM 523 N LYS A 204 -4.740 -3.297 -6.291 1.00 0.00 N ATOM 524 CA LYS A 204 -5.611 -4.381 -6.722 1.00 0.00 C ATOM 525 C LYS A 204 -6.035 -5.239 -5.530 1.00 0.00 C ATOM 526 O LYS A 204 -7.195 -5.645 -5.421 1.00 0.00 O ATOM 527 CB LYS A 204 -4.900 -5.243 -7.762 1.00 0.00 C ATOM 528 CG LYS A 204 -5.782 -6.336 -8.346 1.00 0.00 C ATOM 529 CD LYS A 204 -5.033 -7.174 -9.368 1.00 0.00 C ATOM 530 CE LYS A 204 -4.630 -6.357 -10.584 1.00 0.00 C ATOM 531 NZ LYS A 204 -5.808 -5.875 -11.353 1.00 0.00 N ATOM 0 H LYS A 204 -3.799 -3.331 -6.683 1.00 0.00 H new ATOM 0 HA LYS A 204 -6.505 -3.948 -7.170 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -4.543 -4.604 -8.570 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -4.022 -5.700 -7.305 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -6.145 -6.979 -7.544 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -6.657 -5.886 -8.815 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -4.143 -7.600 -8.906 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -5.660 -8.009 -9.683 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -4.033 -5.503 -10.264 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -3.998 -6.963 -11.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -5.492 -5.487 -12.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -6.460 -6.667 -11.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -6.296 -5.133 -10.811 1.00 0.00 H new ATOM 545 N TYR A 205 -5.092 -5.477 -4.622 1.00 0.00 N ATOM 546 CA TYR A 205 -5.351 -6.274 -3.425 1.00 0.00 C ATOM 547 C TYR A 205 -6.388 -5.593 -2.534 1.00 0.00 C ATOM 548 O TYR A 205 -7.395 -6.201 -2.162 1.00 0.00 O ATOM 549 CB TYR A 205 -4.043 -6.493 -2.652 1.00 0.00 C ATOM 550 CG TYR A 205 -4.150 -7.432 -1.462 1.00 0.00 C ATOM 551 CD1 TYR A 205 -5.288 -8.194 -1.241 1.00 0.00 C ATOM 552 CD2 TYR A 205 -3.090 -7.576 -0.579 1.00 0.00 C ATOM 553 CE1 TYR A 205 -5.367 -9.070 -0.177 1.00 0.00 C ATOM 554 CE2 TYR A 205 -3.162 -8.447 0.493 1.00 0.00 C ATOM 555 CZ TYR A 205 -4.303 -9.192 0.689 1.00 0.00 C ATOM 556 OH TYR A 205 -4.382 -10.073 1.749 1.00 0.00 O ATOM 0 H TYR A 205 -4.136 -5.127 -4.693 1.00 0.00 H new ATOM 0 HA TYR A 205 -5.750 -7.241 -3.730 1.00 0.00 H new ATOM 0 HB2 TYR A 205 -3.294 -6.886 -3.339 1.00 0.00 H new ATOM 0 HB3 TYR A 205 -3.679 -5.527 -2.302 1.00 0.00 H new ATOM 0 HD1 TYR A 205 -6.128 -8.100 -1.914 1.00 0.00 H new ATOM 0 HD2 TYR A 205 -2.191 -6.997 -0.731 1.00 0.00 H new ATOM 0 HE1 TYR A 205 -6.260 -9.658 -0.024 1.00 0.00 H new ATOM 0 HE2 TYR A 205 -2.328 -8.542 1.172 1.00 0.00 H new ATOM 0 HH TYR A 205 -3.549 -10.041 2.264 1.00 0.00 H new ATOM 566 N VAL A 206 -6.141 -4.338 -2.190 1.00 0.00 N ATOM 567 CA VAL A 206 -7.050 -3.601 -1.321 1.00 0.00 C ATOM 568 C VAL A 206 -8.413 -3.410 -1.975 1.00 0.00 C ATOM 569 O VAL A 206 -9.444 -3.490 -1.315 1.00 0.00 O ATOM 570 CB VAL A 206 -6.494 -2.222 -0.902 1.00 0.00 C ATOM 571 CG1 VAL A 206 -5.851 -2.288 0.470 1.00 0.00 C ATOM 572 CG2 VAL A 206 -5.500 -1.704 -1.918 1.00 0.00 C ATOM 0 H VAL A 206 -5.324 -3.810 -2.496 1.00 0.00 H new ATOM 0 HA VAL A 206 -7.156 -4.211 -0.424 1.00 0.00 H new ATOM 0 HB VAL A 206 -7.335 -1.530 -0.857 1.00 0.00 H new ATOM 0 HG11 VAL A 206 -5.468 -1.304 0.740 1.00 0.00 H new ATOM 0 HG12 VAL A 206 -6.592 -2.603 1.204 1.00 0.00 H new ATOM 0 HG13 VAL A 206 -5.030 -3.005 0.453 1.00 0.00 H new ATOM 0 HG21 VAL A 206 -5.125 -0.732 -1.597 1.00 0.00 H new ATOM 0 HG22 VAL A 206 -4.669 -2.404 -2.003 1.00 0.00 H new ATOM 0 HG23 VAL A 206 -5.989 -1.603 -2.887 1.00 0.00 H new ATOM 582 N LYS A 207 -8.409 -3.163 -3.276 1.00 0.00 N ATOM 583 CA LYS A 207 -9.645 -2.960 -4.015 1.00 0.00 C ATOM 584 C LYS A 207 -10.507 -4.220 -4.002 1.00 0.00 C ATOM 585 O LYS A 207 -11.730 -4.148 -3.867 1.00 0.00 O ATOM 586 CB LYS A 207 -9.332 -2.558 -5.457 1.00 0.00 C ATOM 587 CG LYS A 207 -10.564 -2.322 -6.316 1.00 0.00 C ATOM 588 CD LYS A 207 -10.188 -1.956 -7.743 1.00 0.00 C ATOM 589 CE LYS A 207 -9.453 -0.625 -7.807 1.00 0.00 C ATOM 590 NZ LYS A 207 -9.092 -0.252 -9.199 1.00 0.00 N ATOM 0 H LYS A 207 -7.563 -3.098 -3.842 1.00 0.00 H new ATOM 0 HA LYS A 207 -10.203 -2.160 -3.529 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -8.729 -1.650 -5.447 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -8.725 -3.338 -5.917 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -11.183 -3.219 -6.321 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -11.164 -1.523 -5.881 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -9.560 -2.740 -8.166 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -11.089 -1.904 -8.355 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -10.079 0.155 -7.374 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -8.549 -0.681 -7.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -8.593 0.661 -9.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -8.474 -0.983 -9.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -9.956 -0.172 -9.772 1.00 0.00 H new ATOM 604 N ASP A 208 -9.875 -5.360 -4.242 1.00 0.00 N ATOM 605 CA ASP A 208 -10.602 -6.618 -4.371 1.00 0.00 C ATOM 606 C ASP A 208 -10.952 -7.216 -3.010 1.00 0.00 C ATOM 607 O ASP A 208 -12.075 -7.681 -2.799 1.00 0.00 O ATOM 608 CB ASP A 208 -9.778 -7.624 -5.175 1.00 0.00 C ATOM 609 CG ASP A 208 -10.582 -8.838 -5.590 1.00 0.00 C ATOM 610 OD1 ASP A 208 -11.522 -8.689 -6.392 1.00 0.00 O ATOM 611 OD2 ASP A 208 -10.275 -9.952 -5.116 1.00 0.00 O ATOM 0 H ASP A 208 -8.864 -5.442 -4.351 1.00 0.00 H new ATOM 0 HA ASP A 208 -11.534 -6.402 -4.894 1.00 0.00 H new ATOM 0 HB2 ASP A 208 -9.381 -7.134 -6.064 1.00 0.00 H new ATOM 0 HB3 ASP A 208 -8.923 -7.945 -4.580 1.00 0.00 H new ATOM 616 N THR A 209 -9.964 -7.312 -2.133 1.00 0.00 N ATOM 617 CA THR A 209 -10.148 -7.976 -0.850 1.00 0.00 C ATOM 618 C THR A 209 -10.660 -7.025 0.232 1.00 0.00 C ATOM 619 O THR A 209 -11.564 -7.371 0.997 1.00 0.00 O ATOM 620 CB THR A 209 -8.833 -8.627 -0.381 1.00 0.00 C ATOM 621 OG1 THR A 209 -8.399 -9.599 -1.344 1.00 0.00 O ATOM 622 CG2 THR A 209 -9.001 -9.291 0.981 1.00 0.00 C ATOM 0 H THR A 209 -9.027 -6.939 -2.286 1.00 0.00 H new ATOM 0 HA THR A 209 -10.905 -8.745 -1.004 1.00 0.00 H new ATOM 0 HB THR A 209 -8.081 -7.843 -0.288 1.00 0.00 H new ATOM 0 HG1 THR A 209 -7.441 -9.484 -1.516 1.00 0.00 H new ATOM 0 HG21 THR A 209 -8.056 -9.742 1.285 1.00 0.00 H new ATOM 0 HG22 THR A 209 -9.300 -8.543 1.716 1.00 0.00 H new ATOM 0 HG23 THR A 209 -9.767 -10.063 0.917 1.00 0.00 H new ATOM 630 N PHE A 210 -10.039 -5.856 0.347 1.00 0.00 N ATOM 631 CA PHE A 210 -10.368 -4.926 1.425 1.00 0.00 C ATOM 632 C PHE A 210 -11.591 -4.075 1.094 1.00 0.00 C ATOM 633 O PHE A 210 -11.829 -3.053 1.738 1.00 0.00 O ATOM 634 CB PHE A 210 -9.175 -4.020 1.747 1.00 0.00 C ATOM 635 CG PHE A 210 -7.964 -4.755 2.258 1.00 0.00 C ATOM 636 CD1 PHE A 210 -7.195 -5.541 1.411 1.00 0.00 C ATOM 637 CD2 PHE A 210 -7.587 -4.650 3.587 1.00 0.00 C ATOM 638 CE1 PHE A 210 -6.081 -6.208 1.883 1.00 0.00 C ATOM 639 CE2 PHE A 210 -6.473 -5.314 4.063 1.00 0.00 C ATOM 640 CZ PHE A 210 -5.719 -6.093 3.210 1.00 0.00 C ATOM 0 H PHE A 210 -9.310 -5.530 -0.287 1.00 0.00 H new ATOM 0 HA PHE A 210 -10.606 -5.529 2.301 1.00 0.00 H new ATOM 0 HB2 PHE A 210 -8.899 -3.468 0.849 1.00 0.00 H new ATOM 0 HB3 PHE A 210 -9.481 -3.285 2.491 1.00 0.00 H new ATOM 0 HD1 PHE A 210 -7.471 -5.632 0.371 1.00 0.00 H new ATOM 0 HD2 PHE A 210 -8.172 -4.041 4.260 1.00 0.00 H new ATOM 0 HE1 PHE A 210 -5.494 -6.819 1.214 1.00 0.00 H new ATOM 0 HE2 PHE A 210 -6.193 -5.223 5.102 1.00 0.00 H new ATOM 0 HZ PHE A 210 -4.847 -6.612 3.580 1.00 0.00 H new ATOM 650 N SER A 211 -12.431 -4.568 0.188 1.00 0.00 N ATOM 651 CA SER A 211 -13.684 -3.902 -0.145 1.00 0.00 C ATOM 652 C SER A 211 -14.609 -3.865 1.067 1.00 0.00 C ATOM 653 O SER A 211 -15.440 -2.971 1.209 1.00 0.00 O ATOM 654 CB SER A 211 -14.362 -4.621 -1.313 1.00 0.00 C ATOM 655 OG SER A 211 -14.448 -6.018 -1.071 1.00 0.00 O ATOM 0 H SER A 211 -12.264 -5.431 -0.330 1.00 0.00 H new ATOM 0 HA SER A 211 -13.468 -2.875 -0.440 1.00 0.00 H new ATOM 0 HB2 SER A 211 -15.361 -4.213 -1.465 1.00 0.00 H new ATOM 0 HB3 SER A 211 -13.801 -4.441 -2.230 1.00 0.00 H new ATOM 0 HG SER A 211 -13.752 -6.482 -1.582 1.00 0.00 H new ATOM 661 N SER A 212 -14.453 -4.854 1.935 1.00 0.00 N ATOM 662 CA SER A 212 -15.241 -4.946 3.148 1.00 0.00 C ATOM 663 C SER A 212 -14.757 -3.944 4.198 1.00 0.00 C ATOM 664 O SER A 212 -15.534 -3.486 5.037 1.00 0.00 O ATOM 665 CB SER A 212 -15.164 -6.371 3.688 1.00 0.00 C ATOM 666 OG SER A 212 -13.832 -6.858 3.626 1.00 0.00 O ATOM 0 H SER A 212 -13.779 -5.610 1.816 1.00 0.00 H new ATOM 0 HA SER A 212 -16.278 -4.701 2.917 1.00 0.00 H new ATOM 0 HB2 SER A 212 -15.518 -6.395 4.719 1.00 0.00 H new ATOM 0 HB3 SER A 212 -15.822 -7.021 3.110 1.00 0.00 H new ATOM 0 HG SER A 212 -13.801 -7.772 3.978 1.00 0.00 H new ATOM 672 N LYS A 213 -13.463 -3.651 4.182 1.00 0.00 N ATOM 673 CA LYS A 213 -12.872 -2.741 5.159 1.00 0.00 C ATOM 674 C LYS A 213 -13.068 -1.282 4.754 1.00 0.00 C ATOM 675 O LYS A 213 -13.606 -0.485 5.523 1.00 0.00 O ATOM 676 CB LYS A 213 -11.381 -3.041 5.340 1.00 0.00 C ATOM 677 CG LYS A 213 -11.082 -4.421 5.917 1.00 0.00 C ATOM 678 CD LYS A 213 -11.443 -4.528 7.396 1.00 0.00 C ATOM 679 CE LYS A 213 -12.934 -4.760 7.612 1.00 0.00 C ATOM 680 NZ LYS A 213 -13.284 -4.828 9.054 1.00 0.00 N ATOM 0 H LYS A 213 -12.801 -4.029 3.504 1.00 0.00 H new ATOM 0 HA LYS A 213 -13.384 -2.900 6.108 1.00 0.00 H new ATOM 0 HB2 LYS A 213 -10.884 -2.949 4.374 1.00 0.00 H new ATOM 0 HB3 LYS A 213 -10.947 -2.285 5.995 1.00 0.00 H new ATOM 0 HG2 LYS A 213 -11.636 -5.173 5.356 1.00 0.00 H new ATOM 0 HG3 LYS A 213 -10.023 -4.643 5.788 1.00 0.00 H new ATOM 0 HD2 LYS A 213 -10.881 -5.346 7.847 1.00 0.00 H new ATOM 0 HD3 LYS A 213 -11.142 -3.614 7.908 1.00 0.00 H new ATOM 0 HE2 LYS A 213 -13.498 -3.956 7.140 1.00 0.00 H new ATOM 0 HE3 LYS A 213 -13.231 -5.688 7.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 213 -14.307 -4.987 9.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 213 -12.766 -5.612 9.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 213 -13.025 -3.933 9.517 1.00 0.00 H new ATOM 694 N LEU A 214 -12.640 -0.934 3.549 1.00 0.00 N ATOM 695 CA LEU A 214 -12.796 0.431 3.055 1.00 0.00 C ATOM 696 C LEU A 214 -14.088 0.578 2.264 1.00 0.00 C ATOM 697 O LEU A 214 -14.669 -0.410 1.823 1.00 0.00 O ATOM 698 CB LEU A 214 -11.600 0.861 2.204 1.00 0.00 C ATOM 699 CG LEU A 214 -11.190 -0.105 1.099 1.00 0.00 C ATOM 700 CD1 LEU A 214 -11.393 0.513 -0.269 1.00 0.00 C ATOM 701 CD2 LEU A 214 -9.746 -0.498 1.290 1.00 0.00 C ATOM 0 H LEU A 214 -12.184 -1.572 2.897 1.00 0.00 H new ATOM 0 HA LEU A 214 -12.843 1.087 3.924 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -11.829 1.826 1.751 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -10.745 1.013 2.863 1.00 0.00 H new ATOM 0 HG LEU A 214 -11.820 -0.993 1.157 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -11.092 -0.199 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -12.445 0.767 -0.401 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -10.788 1.416 -0.354 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -9.450 -1.189 0.501 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -9.118 0.392 1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -9.626 -0.981 2.260 1.00 0.00 H new ATOM 713 N LYS A 215 -14.564 1.809 2.135 1.00 0.00 N ATOM 714 CA LYS A 215 -15.809 2.081 1.425 1.00 0.00 C ATOM 715 C LYS A 215 -15.711 1.652 -0.041 1.00 0.00 C ATOM 716 O LYS A 215 -16.709 1.265 -0.651 1.00 0.00 O ATOM 717 CB LYS A 215 -16.152 3.570 1.520 1.00 0.00 C ATOM 718 CG LYS A 215 -17.482 3.935 0.881 1.00 0.00 C ATOM 719 CD LYS A 215 -17.776 5.422 1.000 1.00 0.00 C ATOM 720 CE LYS A 215 -17.988 5.842 2.446 1.00 0.00 C ATOM 721 NZ LYS A 215 -18.365 7.276 2.553 1.00 0.00 N ATOM 0 H LYS A 215 -14.106 2.638 2.514 1.00 0.00 H new ATOM 0 HA LYS A 215 -16.604 1.501 1.894 1.00 0.00 H new ATOM 0 HB2 LYS A 215 -16.171 3.863 2.570 1.00 0.00 H new ATOM 0 HB3 LYS A 215 -15.360 4.147 1.043 1.00 0.00 H new ATOM 0 HG2 LYS A 215 -17.470 3.650 -0.171 1.00 0.00 H new ATOM 0 HG3 LYS A 215 -18.282 3.367 1.356 1.00 0.00 H new ATOM 0 HD2 LYS A 215 -16.950 5.991 0.574 1.00 0.00 H new ATOM 0 HD3 LYS A 215 -18.665 5.665 0.417 1.00 0.00 H new ATOM 0 HE2 LYS A 215 -18.769 5.226 2.893 1.00 0.00 H new ATOM 0 HE3 LYS A 215 -17.076 5.662 3.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 215 -18.501 7.525 3.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 215 -17.609 7.865 2.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 215 -19.249 7.442 2.031 1.00 0.00 H new ATOM 735 N THR A 216 -14.503 1.736 -0.600 1.00 0.00 N ATOM 736 CA THR A 216 -14.264 1.387 -2.002 1.00 0.00 C ATOM 737 C THR A 216 -15.126 2.260 -2.921 1.00 0.00 C ATOM 738 O THR A 216 -15.579 1.827 -3.982 1.00 0.00 O ATOM 739 CB THR A 216 -14.553 -0.111 -2.266 1.00 0.00 C ATOM 740 OG1 THR A 216 -14.142 -0.894 -1.136 1.00 0.00 O ATOM 741 CG2 THR A 216 -13.806 -0.601 -3.498 1.00 0.00 C ATOM 0 H THR A 216 -13.669 2.045 -0.100 1.00 0.00 H new ATOM 0 HA THR A 216 -13.212 1.571 -2.218 1.00 0.00 H new ATOM 0 HB THR A 216 -15.625 -0.222 -2.431 1.00 0.00 H new ATOM 0 HG1 THR A 216 -14.921 -1.350 -0.753 1.00 0.00 H new ATOM 0 HG21 THR A 216 -14.026 -1.656 -3.661 1.00 0.00 H new ATOM 0 HG22 THR A 216 -14.122 -0.025 -4.368 1.00 0.00 H new ATOM 0 HG23 THR A 216 -12.734 -0.473 -3.348 1.00 0.00 H new ATOM 749 N SER A 217 -15.351 3.497 -2.490 1.00 0.00 N ATOM 750 CA SER A 217 -16.161 4.460 -3.229 1.00 0.00 C ATOM 751 C SER A 217 -15.882 5.863 -2.702 1.00 0.00 C ATOM 752 O SER A 217 -16.791 6.580 -2.286 1.00 0.00 O ATOM 753 CB SER A 217 -17.659 4.145 -3.086 1.00 0.00 C ATOM 754 OG SER A 217 -17.985 2.860 -3.597 1.00 0.00 O ATOM 0 H SER A 217 -14.975 3.862 -1.615 1.00 0.00 H new ATOM 0 HA SER A 217 -15.897 4.398 -4.285 1.00 0.00 H new ATOM 0 HB2 SER A 217 -17.942 4.199 -2.035 1.00 0.00 H new ATOM 0 HB3 SER A 217 -18.240 4.902 -3.612 1.00 0.00 H new ATOM 0 HG SER A 217 -17.224 2.506 -4.103 1.00 0.00 H new ATOM 760 N SER A 218 -14.610 6.209 -2.632 1.00 0.00 N ATOM 761 CA SER A 218 -14.194 7.478 -2.063 1.00 0.00 C ATOM 762 C SER A 218 -12.811 7.869 -2.585 1.00 0.00 C ATOM 763 O SER A 218 -12.458 7.547 -3.723 1.00 0.00 O ATOM 764 CB SER A 218 -14.197 7.366 -0.534 1.00 0.00 C ATOM 765 OG SER A 218 -13.685 6.106 -0.120 1.00 0.00 O ATOM 0 H SER A 218 -13.843 5.625 -2.964 1.00 0.00 H new ATOM 0 HA SER A 218 -14.891 8.261 -2.362 1.00 0.00 H new ATOM 0 HB2 SER A 218 -13.595 8.167 -0.105 1.00 0.00 H new ATOM 0 HB3 SER A 218 -15.212 7.493 -0.157 1.00 0.00 H new ATOM 0 HG SER A 218 -13.694 6.055 0.859 1.00 0.00 H new ATOM 771 N ASN A 219 -12.007 8.496 -1.739 1.00 0.00 N ATOM 772 CA ASN A 219 -10.646 8.872 -2.109 1.00 0.00 C ATOM 773 C ASN A 219 -9.688 7.711 -1.878 1.00 0.00 C ATOM 774 O ASN A 219 -8.628 7.881 -1.280 1.00 0.00 O ATOM 775 CB ASN A 219 -10.194 10.100 -1.312 1.00 0.00 C ATOM 776 CG ASN A 219 -10.857 11.379 -1.789 1.00 0.00 C ATOM 777 OD1 ASN A 219 -12.082 11.499 -1.789 1.00 0.00 O ATOM 778 ND2 ASN A 219 -10.050 12.347 -2.190 1.00 0.00 N ATOM 0 H ASN A 219 -12.272 8.757 -0.789 1.00 0.00 H new ATOM 0 HA ASN A 219 -10.636 9.122 -3.170 1.00 0.00 H new ATOM 0 HB2 ASN A 219 -10.422 9.948 -0.257 1.00 0.00 H new ATOM 0 HB3 ASN A 219 -9.112 10.203 -1.393 1.00 0.00 H new ATOM 0 HD21 ASN A 219 -10.438 13.233 -2.515 1.00 0.00 H new ATOM 0 HD22 ASN A 219 -9.040 12.208 -2.175 1.00 0.00 H new ATOM 785 N PHE A 220 -10.098 6.526 -2.316 1.00 0.00 N ATOM 786 CA PHE A 220 -9.329 5.302 -2.111 1.00 0.00 C ATOM 787 C PHE A 220 -7.925 5.417 -2.693 1.00 0.00 C ATOM 788 O PHE A 220 -6.936 5.305 -1.971 1.00 0.00 O ATOM 789 CB PHE A 220 -10.066 4.121 -2.756 1.00 0.00 C ATOM 790 CG PHE A 220 -9.333 2.811 -2.673 1.00 0.00 C ATOM 791 CD1 PHE A 220 -8.723 2.423 -1.492 1.00 0.00 C ATOM 792 CD2 PHE A 220 -9.251 1.972 -3.771 1.00 0.00 C ATOM 793 CE1 PHE A 220 -8.046 1.223 -1.408 1.00 0.00 C ATOM 794 CE2 PHE A 220 -8.578 0.770 -3.694 1.00 0.00 C ATOM 795 CZ PHE A 220 -7.983 0.391 -2.527 1.00 0.00 C ATOM 0 H PHE A 220 -10.972 6.386 -2.823 1.00 0.00 H new ATOM 0 HA PHE A 220 -9.231 5.138 -1.038 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -11.039 4.010 -2.277 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -10.252 4.354 -3.805 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -8.778 3.067 -0.627 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -9.720 2.262 -4.700 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -7.569 0.930 -0.484 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -8.522 0.128 -4.560 1.00 0.00 H new ATOM 0 HZ PHE A 220 -7.463 -0.554 -2.469 1.00 0.00 H new ATOM 805 N ASP A 221 -7.844 5.610 -4.001 1.00 0.00 N ATOM 806 CA ASP A 221 -6.554 5.673 -4.685 1.00 0.00 C ATOM 807 C ASP A 221 -5.737 6.875 -4.216 1.00 0.00 C ATOM 808 O ASP A 221 -4.509 6.796 -4.104 1.00 0.00 O ATOM 809 CB ASP A 221 -6.737 5.700 -6.211 1.00 0.00 C ATOM 810 CG ASP A 221 -7.525 6.895 -6.712 1.00 0.00 C ATOM 811 OD1 ASP A 221 -6.955 8.004 -6.803 1.00 0.00 O ATOM 812 OD2 ASP A 221 -8.731 6.736 -7.001 1.00 0.00 O ATOM 0 H ASP A 221 -8.652 5.726 -4.612 1.00 0.00 H new ATOM 0 HA ASP A 221 -6.001 4.770 -4.427 1.00 0.00 H new ATOM 0 HB2 ASP A 221 -5.756 5.699 -6.685 1.00 0.00 H new ATOM 0 HB3 ASP A 221 -7.243 4.786 -6.523 1.00 0.00 H new ATOM 817 N TYR A 222 -6.421 7.972 -3.912 1.00 0.00 N ATOM 818 CA TYR A 222 -5.759 9.176 -3.426 1.00 0.00 C ATOM 819 C TYR A 222 -5.149 8.939 -2.048 1.00 0.00 C ATOM 820 O TYR A 222 -3.976 9.240 -1.810 1.00 0.00 O ATOM 821 CB TYR A 222 -6.755 10.341 -3.364 1.00 0.00 C ATOM 822 CG TYR A 222 -6.182 11.598 -2.744 1.00 0.00 C ATOM 823 CD1 TYR A 222 -5.038 12.194 -3.259 1.00 0.00 C ATOM 824 CD2 TYR A 222 -6.789 12.188 -1.642 1.00 0.00 C ATOM 825 CE1 TYR A 222 -4.513 13.339 -2.692 1.00 0.00 C ATOM 826 CE2 TYR A 222 -6.269 13.331 -1.069 1.00 0.00 C ATOM 827 CZ TYR A 222 -5.134 13.902 -1.598 1.00 0.00 C ATOM 828 OH TYR A 222 -4.613 15.041 -1.026 1.00 0.00 O ATOM 0 H TYR A 222 -7.435 8.052 -3.994 1.00 0.00 H new ATOM 0 HA TYR A 222 -4.958 9.429 -4.121 1.00 0.00 H new ATOM 0 HB2 TYR A 222 -7.098 10.568 -4.373 1.00 0.00 H new ATOM 0 HB3 TYR A 222 -7.629 10.030 -2.792 1.00 0.00 H new ATOM 0 HD1 TYR A 222 -4.551 11.755 -4.117 1.00 0.00 H new ATOM 0 HD2 TYR A 222 -7.682 11.745 -1.227 1.00 0.00 H new ATOM 0 HE1 TYR A 222 -3.622 13.790 -3.103 1.00 0.00 H new ATOM 0 HE2 TYR A 222 -6.750 13.775 -0.210 1.00 0.00 H new ATOM 0 HH TYR A 222 -5.170 15.309 -0.266 1.00 0.00 H new ATOM 838 N LEU A 223 -5.954 8.404 -1.140 1.00 0.00 N ATOM 839 CA LEU A 223 -5.504 8.142 0.214 1.00 0.00 C ATOM 840 C LEU A 223 -4.492 7.019 0.259 1.00 0.00 C ATOM 841 O LEU A 223 -3.571 7.058 1.063 1.00 0.00 O ATOM 842 CB LEU A 223 -6.679 7.835 1.140 1.00 0.00 C ATOM 843 CG LEU A 223 -7.371 9.073 1.700 1.00 0.00 C ATOM 844 CD1 LEU A 223 -8.462 8.683 2.685 1.00 0.00 C ATOM 845 CD2 LEU A 223 -6.342 9.985 2.354 1.00 0.00 C ATOM 0 H LEU A 223 -6.924 8.144 -1.320 1.00 0.00 H new ATOM 0 HA LEU A 223 -5.016 9.050 0.568 1.00 0.00 H new ATOM 0 HB2 LEU A 223 -7.411 7.238 0.595 1.00 0.00 H new ATOM 0 HB3 LEU A 223 -6.324 7.224 1.970 1.00 0.00 H new ATOM 0 HG LEU A 223 -7.846 9.614 0.882 1.00 0.00 H new ATOM 0 HD11 LEU A 223 -8.942 9.582 3.071 1.00 0.00 H new ATOM 0 HD12 LEU A 223 -9.204 8.064 2.180 1.00 0.00 H new ATOM 0 HD13 LEU A 223 -8.023 8.122 3.511 1.00 0.00 H new ATOM 0 HD21 LEU A 223 -6.840 10.869 2.753 1.00 0.00 H new ATOM 0 HD22 LEU A 223 -5.846 9.451 3.164 1.00 0.00 H new ATOM 0 HD23 LEU A 223 -5.602 10.289 1.613 1.00 0.00 H new ATOM 857 N PHE A 224 -4.662 6.024 -0.600 1.00 0.00 N ATOM 858 CA PHE A 224 -3.746 4.897 -0.644 1.00 0.00 C ATOM 859 C PHE A 224 -2.320 5.387 -0.884 1.00 0.00 C ATOM 860 O PHE A 224 -1.414 5.080 -0.115 1.00 0.00 O ATOM 861 CB PHE A 224 -4.158 3.913 -1.741 1.00 0.00 C ATOM 862 CG PHE A 224 -3.440 2.597 -1.670 1.00 0.00 C ATOM 863 CD1 PHE A 224 -3.402 1.878 -0.484 1.00 0.00 C ATOM 864 CD2 PHE A 224 -2.809 2.076 -2.786 1.00 0.00 C ATOM 865 CE1 PHE A 224 -2.746 0.667 -0.413 1.00 0.00 C ATOM 866 CE2 PHE A 224 -2.154 0.862 -2.722 1.00 0.00 C ATOM 867 CZ PHE A 224 -2.121 0.158 -1.534 1.00 0.00 C ATOM 0 H PHE A 224 -5.425 5.976 -1.275 1.00 0.00 H new ATOM 0 HA PHE A 224 -3.785 4.381 0.316 1.00 0.00 H new ATOM 0 HB2 PHE A 224 -5.231 3.736 -1.674 1.00 0.00 H new ATOM 0 HB3 PHE A 224 -3.971 4.367 -2.714 1.00 0.00 H new ATOM 0 HD1 PHE A 224 -3.892 2.271 0.394 1.00 0.00 H new ATOM 0 HD2 PHE A 224 -2.829 2.624 -3.716 1.00 0.00 H new ATOM 0 HE1 PHE A 224 -2.721 0.118 0.517 1.00 0.00 H new ATOM 0 HE2 PHE A 224 -1.668 0.463 -3.600 1.00 0.00 H new ATOM 0 HZ PHE A 224 -1.607 -0.790 -1.482 1.00 0.00 H new ATOM 877 N ASN A 225 -2.150 6.231 -1.899 1.00 0.00 N ATOM 878 CA ASN A 225 -0.839 6.805 -2.211 1.00 0.00 C ATOM 879 C ASN A 225 -0.322 7.661 -1.057 1.00 0.00 C ATOM 880 O ASN A 225 0.860 7.604 -0.705 1.00 0.00 O ATOM 881 CB ASN A 225 -0.906 7.655 -3.484 1.00 0.00 C ATOM 882 CG ASN A 225 0.472 8.067 -3.976 1.00 0.00 C ATOM 883 OD1 ASN A 225 1.303 7.219 -4.303 1.00 0.00 O ATOM 884 ND2 ASN A 225 0.734 9.365 -4.021 1.00 0.00 N ATOM 0 H ASN A 225 -2.901 6.534 -2.520 1.00 0.00 H new ATOM 0 HA ASN A 225 -0.150 5.975 -2.369 1.00 0.00 H new ATOM 0 HB2 ASN A 225 -1.416 7.093 -4.267 1.00 0.00 H new ATOM 0 HB3 ASN A 225 -1.502 8.547 -3.292 1.00 0.00 H new ATOM 0 HD21 ASN A 225 1.649 9.690 -4.334 1.00 0.00 H new ATOM 0 HD22 ASN A 225 0.021 10.039 -3.742 1.00 0.00 H new ATOM 891 N SER A 226 -1.209 8.470 -0.488 1.00 0.00 N ATOM 892 CA SER A 226 -0.850 9.371 0.601 1.00 0.00 C ATOM 893 C SER A 226 -0.473 8.594 1.866 1.00 0.00 C ATOM 894 O SER A 226 0.509 8.919 2.538 1.00 0.00 O ATOM 895 CB SER A 226 -2.014 10.323 0.891 1.00 0.00 C ATOM 896 OG SER A 226 -2.416 11.014 -0.285 1.00 0.00 O ATOM 0 H SER A 226 -2.189 8.520 -0.766 1.00 0.00 H new ATOM 0 HA SER A 226 0.022 9.948 0.293 1.00 0.00 H new ATOM 0 HB2 SER A 226 -2.857 9.760 1.292 1.00 0.00 H new ATOM 0 HB3 SER A 226 -1.718 11.042 1.655 1.00 0.00 H new ATOM 0 HG SER A 226 -2.949 10.416 -0.850 1.00 0.00 H new ATOM 902 N ALA A 227 -1.255 7.568 2.181 1.00 0.00 N ATOM 903 CA ALA A 227 -1.022 6.751 3.364 1.00 0.00 C ATOM 904 C ALA A 227 0.298 6.007 3.261 1.00 0.00 C ATOM 905 O ALA A 227 1.036 5.903 4.240 1.00 0.00 O ATOM 906 CB ALA A 227 -2.167 5.773 3.577 1.00 0.00 C ATOM 0 H ALA A 227 -2.062 7.281 1.628 1.00 0.00 H new ATOM 0 HA ALA A 227 -0.971 7.417 4.225 1.00 0.00 H new ATOM 0 HB1 ALA A 227 -1.972 5.173 4.466 1.00 0.00 H new ATOM 0 HB2 ALA A 227 -3.097 6.325 3.709 1.00 0.00 H new ATOM 0 HB3 ALA A 227 -2.253 5.119 2.709 1.00 0.00 H new ATOM 912 N ILE A 228 0.597 5.503 2.071 1.00 0.00 N ATOM 913 CA ILE A 228 1.846 4.775 1.849 1.00 0.00 C ATOM 914 C ILE A 228 3.048 5.679 2.105 1.00 0.00 C ATOM 915 O ILE A 228 4.001 5.280 2.768 1.00 0.00 O ATOM 916 CB ILE A 228 1.940 4.182 0.423 1.00 0.00 C ATOM 917 CG1 ILE A 228 0.810 3.180 0.186 1.00 0.00 C ATOM 918 CG2 ILE A 228 3.288 3.504 0.222 1.00 0.00 C ATOM 919 CD1 ILE A 228 0.751 2.647 -1.230 1.00 0.00 C ATOM 0 H ILE A 228 -0.001 5.582 1.248 1.00 0.00 H new ATOM 0 HA ILE A 228 1.852 3.945 2.556 1.00 0.00 H new ATOM 0 HB ILE A 228 1.843 4.995 -0.296 1.00 0.00 H new ATOM 0 HG12 ILE A 228 0.929 2.343 0.874 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -0.141 3.656 0.425 1.00 0.00 H new ATOM 0 HG21 ILE A 228 3.341 3.091 -0.785 1.00 0.00 H new ATOM 0 HG22 ILE A 228 4.086 4.234 0.357 1.00 0.00 H new ATOM 0 HG23 ILE A 228 3.403 2.701 0.950 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -0.076 1.942 -1.319 1.00 0.00 H new ATOM 0 HD12 ILE A 228 0.600 3.474 -1.924 1.00 0.00 H new ATOM 0 HD13 ILE A 228 1.686 2.140 -1.467 1.00 0.00 H new ATOM 931 N LYS A 229 2.950 6.931 1.663 1.00 0.00 N ATOM 932 CA LYS A 229 3.996 7.921 1.915 1.00 0.00 C ATOM 933 C LYS A 229 4.234 8.081 3.419 1.00 0.00 C ATOM 934 O LYS A 229 5.377 8.097 3.883 1.00 0.00 O ATOM 935 CB LYS A 229 3.616 9.267 1.291 1.00 0.00 C ATOM 936 CG LYS A 229 4.649 10.358 1.525 1.00 0.00 C ATOM 937 CD LYS A 229 4.233 11.686 0.906 1.00 0.00 C ATOM 938 CE LYS A 229 4.610 11.789 -0.567 1.00 0.00 C ATOM 939 NZ LYS A 229 3.812 10.879 -1.429 1.00 0.00 N ATOM 0 H LYS A 229 2.157 7.285 1.128 1.00 0.00 H new ATOM 0 HA LYS A 229 4.920 7.571 1.455 1.00 0.00 H new ATOM 0 HB2 LYS A 229 3.476 9.134 0.218 1.00 0.00 H new ATOM 0 HB3 LYS A 229 2.659 9.591 1.700 1.00 0.00 H new ATOM 0 HG2 LYS A 229 4.800 10.490 2.596 1.00 0.00 H new ATOM 0 HG3 LYS A 229 5.605 10.047 1.105 1.00 0.00 H new ATOM 0 HD2 LYS A 229 3.155 11.810 1.011 1.00 0.00 H new ATOM 0 HD3 LYS A 229 4.703 12.502 1.455 1.00 0.00 H new ATOM 0 HE2 LYS A 229 4.469 12.816 -0.903 1.00 0.00 H new ATOM 0 HE3 LYS A 229 5.669 11.558 -0.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 229 3.709 11.299 -2.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 229 4.296 9.962 -1.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 229 2.871 10.738 -1.008 1.00 0.00 H new ATOM 953 N LYS A 230 3.144 8.108 4.176 1.00 0.00 N ATOM 954 CA LYS A 230 3.203 8.178 5.633 1.00 0.00 C ATOM 955 C LYS A 230 3.869 6.926 6.205 1.00 0.00 C ATOM 956 O LYS A 230 4.699 7.011 7.110 1.00 0.00 O ATOM 957 CB LYS A 230 1.784 8.324 6.195 1.00 0.00 C ATOM 958 CG LYS A 230 1.695 8.358 7.717 1.00 0.00 C ATOM 959 CD LYS A 230 2.106 9.706 8.292 1.00 0.00 C ATOM 960 CE LYS A 230 3.606 9.805 8.517 1.00 0.00 C ATOM 961 NZ LYS A 230 3.993 11.116 9.101 1.00 0.00 N ATOM 0 H LYS A 230 2.196 8.082 3.800 1.00 0.00 H new ATOM 0 HA LYS A 230 3.798 9.044 5.922 1.00 0.00 H new ATOM 0 HB2 LYS A 230 1.345 9.240 5.800 1.00 0.00 H new ATOM 0 HB3 LYS A 230 1.177 7.496 5.829 1.00 0.00 H new ATOM 0 HG2 LYS A 230 0.674 8.131 8.024 1.00 0.00 H new ATOM 0 HG3 LYS A 230 2.333 7.579 8.133 1.00 0.00 H new ATOM 0 HD2 LYS A 230 1.790 10.499 7.614 1.00 0.00 H new ATOM 0 HD3 LYS A 230 1.588 9.868 9.237 1.00 0.00 H new ATOM 0 HE2 LYS A 230 3.927 9.003 9.181 1.00 0.00 H new ATOM 0 HE3 LYS A 230 4.126 9.662 7.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 230 4.977 11.334 8.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 230 3.366 11.859 8.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 230 3.907 11.074 10.137 1.00 0.00 H new ATOM 975 N CYS A 231 3.518 5.774 5.652 1.00 0.00 N ATOM 976 CA CYS A 231 4.063 4.495 6.097 1.00 0.00 C ATOM 977 C CYS A 231 5.573 4.408 5.863 1.00 0.00 C ATOM 978 O CYS A 231 6.279 3.677 6.559 1.00 0.00 O ATOM 979 CB CYS A 231 3.350 3.351 5.385 1.00 0.00 C ATOM 980 SG CYS A 231 1.569 3.317 5.671 1.00 0.00 S ATOM 0 H CYS A 231 2.850 5.697 4.885 1.00 0.00 H new ATOM 0 HA CYS A 231 3.894 4.415 7.171 1.00 0.00 H new ATOM 0 HB2 CYS A 231 3.536 3.430 4.314 1.00 0.00 H new ATOM 0 HB3 CYS A 231 3.780 2.405 5.715 1.00 0.00 H new ATOM 0 HG CYS A 231 1.038 4.420 5.233 1.00 0.00 H new ATOM 986 N VAL A 232 6.069 5.170 4.902 1.00 0.00 N ATOM 987 CA VAL A 232 7.499 5.212 4.636 1.00 0.00 C ATOM 988 C VAL A 232 8.212 5.995 5.727 1.00 0.00 C ATOM 989 O VAL A 232 9.245 5.561 6.245 1.00 0.00 O ATOM 990 CB VAL A 232 7.793 5.823 3.258 1.00 0.00 C ATOM 991 CG1 VAL A 232 9.285 5.814 2.959 1.00 0.00 C ATOM 992 CG2 VAL A 232 7.022 5.061 2.203 1.00 0.00 C ATOM 0 H VAL A 232 5.506 5.766 4.295 1.00 0.00 H new ATOM 0 HA VAL A 232 7.872 4.188 4.632 1.00 0.00 H new ATOM 0 HB VAL A 232 7.472 6.865 3.254 1.00 0.00 H new ATOM 0 HG11 VAL A 232 9.462 6.253 1.977 1.00 0.00 H new ATOM 0 HG12 VAL A 232 9.811 6.395 3.716 1.00 0.00 H new ATOM 0 HG13 VAL A 232 9.652 4.788 2.969 1.00 0.00 H new ATOM 0 HG21 VAL A 232 7.226 5.490 1.222 1.00 0.00 H new ATOM 0 HG22 VAL A 232 7.329 4.015 2.213 1.00 0.00 H new ATOM 0 HG23 VAL A 232 5.955 5.128 2.413 1.00 0.00 H new ATOM 1002 N GLU A 233 7.565 7.061 6.183 1.00 0.00 N ATOM 1003 CA GLU A 233 8.044 7.812 7.335 1.00 0.00 C ATOM 1004 C GLU A 233 7.923 6.951 8.587 1.00 0.00 C ATOM 1005 O GLU A 233 8.728 7.052 9.515 1.00 0.00 O ATOM 1006 CB GLU A 233 7.244 9.105 7.504 1.00 0.00 C ATOM 1007 CG GLU A 233 7.283 10.004 6.279 1.00 0.00 C ATOM 1008 CD GLU A 233 6.705 11.380 6.540 1.00 0.00 C ATOM 1009 OE1 GLU A 233 6.131 11.596 7.626 1.00 0.00 O ATOM 1010 OE2 GLU A 233 6.816 12.254 5.657 1.00 0.00 O ATOM 0 H GLU A 233 6.706 7.425 5.771 1.00 0.00 H new ATOM 0 HA GLU A 233 9.090 8.076 7.177 1.00 0.00 H new ATOM 0 HB2 GLU A 233 6.207 8.855 7.729 1.00 0.00 H new ATOM 0 HB3 GLU A 233 7.633 9.655 8.361 1.00 0.00 H new ATOM 0 HG2 GLU A 233 8.315 10.106 5.942 1.00 0.00 H new ATOM 0 HG3 GLU A 233 6.729 9.530 5.469 1.00 0.00 H new ATOM 1017 N ASN A 234 6.931 6.067 8.566 1.00 0.00 N ATOM 1018 CA ASN A 234 6.708 5.106 9.640 1.00 0.00 C ATOM 1019 C ASN A 234 7.917 4.199 9.812 1.00 0.00 C ATOM 1020 O ASN A 234 8.445 4.059 10.916 1.00 0.00 O ATOM 1021 CB ASN A 234 5.461 4.265 9.347 1.00 0.00 C ATOM 1022 CG ASN A 234 4.177 4.940 9.801 1.00 0.00 C ATOM 1023 OD1 ASN A 234 3.080 4.447 9.544 1.00 0.00 O ATOM 1024 ND2 ASN A 234 4.300 6.062 10.496 1.00 0.00 N ATOM 0 H ASN A 234 6.258 5.997 7.803 1.00 0.00 H new ATOM 0 HA ASN A 234 6.556 5.659 10.567 1.00 0.00 H new ATOM 0 HB2 ASN A 234 5.404 4.068 8.276 1.00 0.00 H new ATOM 0 HB3 ASN A 234 5.554 3.299 9.844 1.00 0.00 H new ATOM 0 HD21 ASN A 234 3.468 6.545 10.836 1.00 0.00 H new ATOM 0 HD22 ASN A 234 5.226 6.442 10.691 1.00 0.00 H new ATOM 1031 N GLY A 235 8.401 3.651 8.709 1.00 0.00 N ATOM 1032 CA GLY A 235 9.603 2.847 8.760 1.00 0.00 C ATOM 1033 C GLY A 235 9.455 1.516 8.056 1.00 0.00 C ATOM 1034 O GLY A 235 10.403 1.032 7.444 1.00 0.00 O ATOM 0 H GLY A 235 7.985 3.748 7.783 1.00 0.00 H new ATOM 0 HA2 GLY A 235 10.424 3.402 8.307 1.00 0.00 H new ATOM 0 HA3 GLY A 235 9.873 2.673 9.802 1.00 0.00 H new ATOM 1038 N GLU A 236 8.297 0.887 8.224 1.00 0.00 N ATOM 1039 CA GLU A 236 8.059 -0.442 7.671 1.00 0.00 C ATOM 1040 C GLU A 236 8.129 -0.416 6.145 1.00 0.00 C ATOM 1041 O GLU A 236 8.865 -1.184 5.527 1.00 0.00 O ATOM 1042 CB GLU A 236 6.686 -0.960 8.103 1.00 0.00 C ATOM 1043 CG GLU A 236 6.567 -2.471 8.038 1.00 0.00 C ATOM 1044 CD GLU A 236 7.219 -3.145 9.228 1.00 0.00 C ATOM 1045 OE1 GLU A 236 6.600 -3.171 10.315 1.00 0.00 O ATOM 1046 OE2 GLU A 236 8.357 -3.632 9.095 1.00 0.00 O ATOM 0 H GLU A 236 7.507 1.276 8.739 1.00 0.00 H new ATOM 0 HA GLU A 236 8.835 -1.106 8.051 1.00 0.00 H new ATOM 0 HB2 GLU A 236 6.485 -0.630 9.122 1.00 0.00 H new ATOM 0 HB3 GLU A 236 5.921 -0.515 7.467 1.00 0.00 H new ATOM 0 HG2 GLU A 236 5.514 -2.750 7.996 1.00 0.00 H new ATOM 0 HG3 GLU A 236 7.029 -2.832 7.119 1.00 0.00 H new ATOM 1053 N LEU A 237 7.349 0.472 5.552 1.00 0.00 N ATOM 1054 CA LEU A 237 7.299 0.604 4.107 1.00 0.00 C ATOM 1055 C LEU A 237 8.351 1.598 3.637 1.00 0.00 C ATOM 1056 O LEU A 237 8.741 2.498 4.383 1.00 0.00 O ATOM 1057 CB LEU A 237 5.904 1.050 3.645 1.00 0.00 C ATOM 1058 CG LEU A 237 4.766 0.043 3.885 1.00 0.00 C ATOM 1059 CD1 LEU A 237 5.190 -1.351 3.464 1.00 0.00 C ATOM 1060 CD2 LEU A 237 4.319 0.041 5.341 1.00 0.00 C ATOM 0 H LEU A 237 6.738 1.116 6.054 1.00 0.00 H new ATOM 0 HA LEU A 237 7.508 -0.371 3.666 1.00 0.00 H new ATOM 0 HB2 LEU A 237 5.654 1.981 4.154 1.00 0.00 H new ATOM 0 HB3 LEU A 237 5.949 1.272 2.579 1.00 0.00 H new ATOM 0 HG LEU A 237 3.918 0.354 3.275 1.00 0.00 H new ATOM 0 HD11 LEU A 237 4.372 -2.049 3.641 1.00 0.00 H new ATOM 0 HD12 LEU A 237 5.443 -1.350 2.404 1.00 0.00 H new ATOM 0 HD13 LEU A 237 6.061 -1.657 4.044 1.00 0.00 H new ATOM 0 HD21 LEU A 237 3.514 -0.682 5.474 1.00 0.00 H new ATOM 0 HD22 LEU A 237 5.160 -0.231 5.979 1.00 0.00 H new ATOM 0 HD23 LEU A 237 3.963 1.034 5.614 1.00 0.00 H new ATOM 1072 N VAL A 238 8.825 1.429 2.414 1.00 0.00 N ATOM 1073 CA VAL A 238 9.828 2.323 1.864 1.00 0.00 C ATOM 1074 C VAL A 238 9.678 2.428 0.348 1.00 0.00 C ATOM 1075 O VAL A 238 9.412 1.436 -0.338 1.00 0.00 O ATOM 1076 CB VAL A 238 11.265 1.866 2.226 1.00 0.00 C ATOM 1077 CG1 VAL A 238 11.658 0.612 1.469 1.00 0.00 C ATOM 1078 CG2 VAL A 238 12.276 2.970 1.976 1.00 0.00 C ATOM 0 H VAL A 238 8.532 0.682 1.785 1.00 0.00 H new ATOM 0 HA VAL A 238 9.667 3.305 2.308 1.00 0.00 H new ATOM 0 HB VAL A 238 11.267 1.634 3.291 1.00 0.00 H new ATOM 0 HG11 VAL A 238 12.671 0.321 1.748 1.00 0.00 H new ATOM 0 HG12 VAL A 238 10.968 -0.194 1.717 1.00 0.00 H new ATOM 0 HG13 VAL A 238 11.618 0.807 0.397 1.00 0.00 H new ATOM 0 HG21 VAL A 238 13.273 2.617 2.240 1.00 0.00 H new ATOM 0 HG22 VAL A 238 12.257 3.249 0.923 1.00 0.00 H new ATOM 0 HG23 VAL A 238 12.025 3.838 2.586 1.00 0.00 H new ATOM 1088 N GLN A 239 9.826 3.638 -0.162 1.00 0.00 N ATOM 1089 CA GLN A 239 9.759 3.878 -1.594 1.00 0.00 C ATOM 1090 C GLN A 239 11.003 4.638 -2.029 1.00 0.00 C ATOM 1091 O GLN A 239 11.125 5.838 -1.773 1.00 0.00 O ATOM 1092 CB GLN A 239 8.507 4.676 -1.972 1.00 0.00 C ATOM 1093 CG GLN A 239 7.207 4.050 -1.499 1.00 0.00 C ATOM 1094 CD GLN A 239 5.984 4.727 -2.089 1.00 0.00 C ATOM 1095 OE1 GLN A 239 5.647 4.529 -3.257 1.00 0.00 O ATOM 1096 NE2 GLN A 239 5.322 5.548 -1.292 1.00 0.00 N ATOM 0 H GLN A 239 9.994 4.474 0.397 1.00 0.00 H new ATOM 0 HA GLN A 239 9.707 2.916 -2.103 1.00 0.00 H new ATOM 0 HB2 GLN A 239 8.588 5.679 -1.553 1.00 0.00 H new ATOM 0 HB3 GLN A 239 8.472 4.785 -3.056 1.00 0.00 H new ATOM 0 HG2 GLN A 239 7.198 2.994 -1.768 1.00 0.00 H new ATOM 0 HG3 GLN A 239 7.157 4.103 -0.411 1.00 0.00 H new ATOM 0 HE21 GLN A 239 5.632 5.686 -0.330 1.00 0.00 H new ATOM 0 HE22 GLN A 239 4.501 6.044 -1.639 1.00 0.00 H new ATOM 1105 N PRO A 240 12.001 3.916 -2.558 1.00 0.00 N ATOM 1106 CA PRO A 240 13.299 4.491 -2.926 1.00 0.00 C ATOM 1107 C PRO A 240 13.175 5.769 -3.753 1.00 0.00 C ATOM 1108 O PRO A 240 13.764 6.798 -3.417 1.00 0.00 O ATOM 1109 CB PRO A 240 13.942 3.385 -3.753 1.00 0.00 C ATOM 1110 CG PRO A 240 13.365 2.119 -3.220 1.00 0.00 C ATOM 1111 CD PRO A 240 11.978 2.450 -2.733 1.00 0.00 C ATOM 0 HA PRO A 240 13.872 4.787 -2.048 1.00 0.00 H new ATOM 0 HB2 PRO A 240 13.719 3.505 -4.813 1.00 0.00 H new ATOM 0 HB3 PRO A 240 15.027 3.397 -3.652 1.00 0.00 H new ATOM 0 HG2 PRO A 240 13.331 1.352 -3.994 1.00 0.00 H new ATOM 0 HG3 PRO A 240 13.977 1.726 -2.408 1.00 0.00 H new ATOM 0 HD2 PRO A 240 11.219 2.146 -3.454 1.00 0.00 H new ATOM 0 HD3 PRO A 240 11.751 1.940 -1.797 1.00 0.00 H new ATOM 1119 N LYS A 241 12.359 5.721 -4.796 1.00 0.00 N ATOM 1120 CA LYS A 241 12.133 6.887 -5.640 1.00 0.00 C ATOM 1121 C LYS A 241 10.700 7.391 -5.506 1.00 0.00 C ATOM 1122 O LYS A 241 10.147 7.985 -6.435 1.00 0.00 O ATOM 1123 CB LYS A 241 12.441 6.549 -7.098 1.00 0.00 C ATOM 1124 CG LYS A 241 13.904 6.226 -7.353 1.00 0.00 C ATOM 1125 CD LYS A 241 14.154 5.851 -8.805 1.00 0.00 C ATOM 1126 CE LYS A 241 13.720 6.957 -9.760 1.00 0.00 C ATOM 1127 NZ LYS A 241 14.416 8.243 -9.493 1.00 0.00 N ATOM 0 H LYS A 241 11.842 4.888 -5.079 1.00 0.00 H new ATOM 0 HA LYS A 241 12.803 7.681 -5.310 1.00 0.00 H new ATOM 0 HB2 LYS A 241 11.832 5.698 -7.401 1.00 0.00 H new ATOM 0 HB3 LYS A 241 12.149 7.390 -7.727 1.00 0.00 H new ATOM 0 HG2 LYS A 241 14.518 7.087 -7.089 1.00 0.00 H new ATOM 0 HG3 LYS A 241 14.213 5.404 -6.707 1.00 0.00 H new ATOM 0 HD2 LYS A 241 15.214 5.642 -8.949 1.00 0.00 H new ATOM 0 HD3 LYS A 241 13.614 4.934 -9.041 1.00 0.00 H new ATOM 0 HE2 LYS A 241 13.918 6.646 -10.786 1.00 0.00 H new ATOM 0 HE3 LYS A 241 12.644 7.105 -9.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 241 14.177 8.928 -10.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 241 14.114 8.616 -8.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 241 15.444 8.086 -9.483 1.00 0.00 H new ATOM 1141 N GLY A 242 10.120 7.174 -4.330 1.00 0.00 N ATOM 1142 CA GLY A 242 8.760 7.609 -4.078 1.00 0.00 C ATOM 1143 C GLY A 242 7.768 6.970 -5.029 1.00 0.00 C ATOM 1144 O GLY A 242 7.860 5.773 -5.307 1.00 0.00 O ATOM 0 H GLY A 242 10.570 6.703 -3.545 1.00 0.00 H new ATOM 0 HA2 GLY A 242 8.486 7.364 -3.052 1.00 0.00 H new ATOM 0 HA3 GLY A 242 8.704 8.693 -4.172 1.00 0.00 H new ATOM 1148 N PRO A 243 6.827 7.756 -5.569 1.00 0.00 N ATOM 1149 CA PRO A 243 5.821 7.268 -6.520 1.00 0.00 C ATOM 1150 C PRO A 243 6.451 6.751 -7.811 1.00 0.00 C ATOM 1151 O PRO A 243 5.903 5.870 -8.470 1.00 0.00 O ATOM 1152 CB PRO A 243 4.953 8.503 -6.803 1.00 0.00 C ATOM 1153 CG PRO A 243 5.243 9.447 -5.689 1.00 0.00 C ATOM 1154 CD PRO A 243 6.669 9.192 -5.302 1.00 0.00 C ATOM 0 HA PRO A 243 5.259 6.426 -6.117 1.00 0.00 H new ATOM 0 HB2 PRO A 243 5.200 8.945 -7.768 1.00 0.00 H new ATOM 0 HB3 PRO A 243 3.895 8.242 -6.833 1.00 0.00 H new ATOM 0 HG2 PRO A 243 5.102 10.481 -6.005 1.00 0.00 H new ATOM 0 HG3 PRO A 243 4.572 9.277 -4.847 1.00 0.00 H new ATOM 0 HD2 PRO A 243 7.362 9.792 -5.892 1.00 0.00 H new ATOM 0 HD3 PRO A 243 6.853 9.431 -4.255 1.00 0.00 H new ATOM 1162 N SER A 244 7.610 7.293 -8.161 1.00 0.00 N ATOM 1163 CA SER A 244 8.328 6.862 -9.355 1.00 0.00 C ATOM 1164 C SER A 244 9.286 5.717 -9.023 1.00 0.00 C ATOM 1165 O SER A 244 10.413 5.666 -9.520 1.00 0.00 O ATOM 1166 CB SER A 244 9.097 8.042 -9.948 1.00 0.00 C ATOM 1167 OG SER A 244 8.266 9.190 -10.041 1.00 0.00 O ATOM 0 H SER A 244 8.074 8.033 -7.635 1.00 0.00 H new ATOM 0 HA SER A 244 7.607 6.501 -10.088 1.00 0.00 H new ATOM 0 HB2 SER A 244 9.965 8.265 -9.327 1.00 0.00 H new ATOM 0 HB3 SER A 244 9.472 7.778 -10.937 1.00 0.00 H new ATOM 0 HG SER A 244 8.778 9.934 -10.421 1.00 0.00 H new ATOM 1173 N GLY A 245 8.835 4.816 -8.163 1.00 0.00 N ATOM 1174 CA GLY A 245 9.654 3.698 -7.747 1.00 0.00 C ATOM 1175 C GLY A 245 8.838 2.645 -7.030 1.00 0.00 C ATOM 1176 O GLY A 245 7.798 2.957 -6.446 1.00 0.00 O ATOM 0 H GLY A 245 7.906 4.841 -7.742 1.00 0.00 H new ATOM 0 HA2 GLY A 245 10.135 3.255 -8.619 1.00 0.00 H new ATOM 0 HA3 GLY A 245 10.448 4.053 -7.090 1.00 0.00 H new ATOM 1180 N ILE A 246 9.253 1.394 -7.151 1.00 0.00 N ATOM 1181 CA ILE A 246 8.521 0.285 -6.555 1.00 0.00 C ATOM 1182 C ILE A 246 8.570 0.344 -5.024 1.00 0.00 C ATOM 1183 O ILE A 246 9.629 0.554 -4.429 1.00 0.00 O ATOM 1184 CB ILE A 246 9.074 -1.079 -7.040 1.00 0.00 C ATOM 1185 CG1 ILE A 246 8.286 -2.234 -6.409 1.00 0.00 C ATOM 1186 CG2 ILE A 246 10.564 -1.202 -6.735 1.00 0.00 C ATOM 1187 CD1 ILE A 246 8.883 -3.601 -6.673 1.00 0.00 C ATOM 0 H ILE A 246 10.095 1.120 -7.658 1.00 0.00 H new ATOM 0 HA ILE A 246 7.484 0.378 -6.877 1.00 0.00 H new ATOM 0 HB ILE A 246 8.950 -1.134 -8.122 1.00 0.00 H new ATOM 0 HG12 ILE A 246 8.228 -2.076 -5.332 1.00 0.00 H new ATOM 0 HG13 ILE A 246 7.265 -2.215 -6.790 1.00 0.00 H new ATOM 0 HG21 ILE A 246 10.929 -2.168 -7.085 1.00 0.00 H new ATOM 0 HG22 ILE A 246 11.106 -0.404 -7.242 1.00 0.00 H new ATOM 0 HG23 ILE A 246 10.723 -1.122 -5.660 1.00 0.00 H new ATOM 0 HD11 ILE A 246 8.270 -4.364 -6.195 1.00 0.00 H new ATOM 0 HD12 ILE A 246 8.916 -3.782 -7.747 1.00 0.00 H new ATOM 0 HD13 ILE A 246 9.894 -3.641 -6.267 1.00 0.00 H new ATOM 1199 N ILE A 247 7.428 0.093 -4.395 1.00 0.00 N ATOM 1200 CA ILE A 247 7.364 -0.006 -2.944 1.00 0.00 C ATOM 1201 C ILE A 247 7.984 -1.325 -2.516 1.00 0.00 C ATOM 1202 O ILE A 247 7.645 -2.367 -3.064 1.00 0.00 O ATOM 1203 CB ILE A 247 5.908 0.037 -2.437 1.00 0.00 C ATOM 1204 CG1 ILE A 247 5.167 1.236 -3.028 1.00 0.00 C ATOM 1205 CG2 ILE A 247 5.871 0.081 -0.913 1.00 0.00 C ATOM 1206 CD1 ILE A 247 3.679 1.218 -2.758 1.00 0.00 C ATOM 0 H ILE A 247 6.535 -0.045 -4.868 1.00 0.00 H new ATOM 0 HA ILE A 247 7.903 0.841 -2.520 1.00 0.00 H new ATOM 0 HB ILE A 247 5.405 -0.872 -2.766 1.00 0.00 H new ATOM 0 HG12 ILE A 247 5.591 2.153 -2.619 1.00 0.00 H new ATOM 0 HG13 ILE A 247 5.333 1.261 -4.105 1.00 0.00 H new ATOM 0 HG21 ILE A 247 4.835 0.111 -0.575 1.00 0.00 H new ATOM 0 HG22 ILE A 247 6.358 -0.808 -0.511 1.00 0.00 H new ATOM 0 HG23 ILE A 247 6.393 0.971 -0.562 1.00 0.00 H new ATOM 0 HD11 ILE A 247 3.217 2.098 -3.206 1.00 0.00 H new ATOM 0 HD12 ILE A 247 3.242 0.318 -3.191 1.00 0.00 H new ATOM 0 HD13 ILE A 247 3.504 1.225 -1.682 1.00 0.00 H new ATOM 1218 N LYS A 248 8.905 -1.292 -1.574 1.00 0.00 N ATOM 1219 CA LYS A 248 9.564 -2.516 -1.145 1.00 0.00 C ATOM 1220 C LYS A 248 9.616 -2.603 0.372 1.00 0.00 C ATOM 1221 O LYS A 248 9.608 -1.587 1.062 1.00 0.00 O ATOM 1222 CB LYS A 248 10.969 -2.614 -1.752 1.00 0.00 C ATOM 1223 CG LYS A 248 10.956 -2.684 -3.272 1.00 0.00 C ATOM 1224 CD LYS A 248 12.306 -3.081 -3.848 1.00 0.00 C ATOM 1225 CE LYS A 248 13.344 -1.988 -3.681 1.00 0.00 C ATOM 1226 NZ LYS A 248 14.630 -2.348 -4.334 1.00 0.00 N ATOM 0 H LYS A 248 9.213 -0.446 -1.095 1.00 0.00 H new ATOM 0 HA LYS A 248 8.980 -3.362 -1.506 1.00 0.00 H new ATOM 0 HB2 LYS A 248 11.555 -1.750 -1.439 1.00 0.00 H new ATOM 0 HB3 LYS A 248 11.469 -3.499 -1.357 1.00 0.00 H new ATOM 0 HG2 LYS A 248 10.202 -3.403 -3.593 1.00 0.00 H new ATOM 0 HG3 LYS A 248 10.664 -1.714 -3.675 1.00 0.00 H new ATOM 0 HD2 LYS A 248 12.655 -3.989 -3.357 1.00 0.00 H new ATOM 0 HD3 LYS A 248 12.193 -3.314 -4.907 1.00 0.00 H new ATOM 0 HE2 LYS A 248 12.966 -1.059 -4.108 1.00 0.00 H new ATOM 0 HE3 LYS A 248 13.513 -1.805 -2.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 248 15.315 -1.578 -4.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 248 15.003 -3.221 -3.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 248 14.473 -2.498 -5.351 1.00 0.00 H new ATOM 1240 N LEU A 249 9.582 -3.824 0.883 1.00 0.00 N ATOM 1241 CA LEU A 249 9.613 -4.049 2.318 1.00 0.00 C ATOM 1242 C LEU A 249 11.063 -4.101 2.781 1.00 0.00 C ATOM 1243 O LEU A 249 11.830 -4.975 2.363 1.00 0.00 O ATOM 1244 CB LEU A 249 8.874 -5.351 2.664 1.00 0.00 C ATOM 1245 CG LEU A 249 8.367 -5.481 4.109 1.00 0.00 C ATOM 1246 CD1 LEU A 249 9.518 -5.673 5.090 1.00 0.00 C ATOM 1247 CD2 LEU A 249 7.540 -4.261 4.490 1.00 0.00 C ATOM 0 H LEU A 249 9.533 -4.675 0.323 1.00 0.00 H new ATOM 0 HA LEU A 249 9.107 -3.232 2.833 1.00 0.00 H new ATOM 0 HB2 LEU A 249 8.022 -5.450 1.992 1.00 0.00 H new ATOM 0 HB3 LEU A 249 9.541 -6.188 2.458 1.00 0.00 H new ATOM 0 HG LEU A 249 7.735 -6.368 4.163 1.00 0.00 H new ATOM 0 HD11 LEU A 249 9.123 -5.761 6.102 1.00 0.00 H new ATOM 0 HD12 LEU A 249 10.067 -6.580 4.834 1.00 0.00 H new ATOM 0 HD13 LEU A 249 10.189 -4.816 5.036 1.00 0.00 H new ATOM 0 HD21 LEU A 249 7.187 -4.366 5.516 1.00 0.00 H new ATOM 0 HD22 LEU A 249 8.155 -3.365 4.408 1.00 0.00 H new ATOM 0 HD23 LEU A 249 6.685 -4.177 3.819 1.00 0.00 H new ATOM 1259 N ASN A 250 11.449 -3.132 3.592 1.00 0.00 N ATOM 1260 CA ASN A 250 12.824 -3.026 4.059 1.00 0.00 C ATOM 1261 C ASN A 250 12.861 -2.902 5.574 1.00 0.00 C ATOM 1262 O ASN A 250 11.823 -3.002 6.229 1.00 0.00 O ATOM 1263 CB ASN A 250 13.526 -1.824 3.409 1.00 0.00 C ATOM 1264 CG ASN A 250 13.914 -2.080 1.959 1.00 0.00 C ATOM 1265 OD1 ASN A 250 13.062 -2.298 1.097 1.00 0.00 O ATOM 1266 ND2 ASN A 250 15.205 -2.059 1.674 1.00 0.00 N ATOM 0 H ASN A 250 10.828 -2.403 3.943 1.00 0.00 H new ATOM 0 HA ASN A 250 13.355 -3.933 3.770 1.00 0.00 H new ATOM 0 HB2 ASN A 250 12.869 -0.956 3.456 1.00 0.00 H new ATOM 0 HB3 ASN A 250 14.420 -1.578 3.982 1.00 0.00 H new ATOM 0 HD21 ASN A 250 15.519 -2.226 0.718 1.00 0.00 H new ATOM 0 HD22 ASN A 250 15.887 -1.876 2.410 1.00 0.00 H new ATOM 1273 N LYS A 251 14.063 -2.691 6.112 1.00 0.00 N ATOM 1274 CA LYS A 251 14.296 -2.546 7.556 1.00 0.00 C ATOM 1275 C LYS A 251 14.077 -3.862 8.306 1.00 0.00 C ATOM 1276 O LYS A 251 14.985 -4.359 8.973 1.00 0.00 O ATOM 1277 CB LYS A 251 13.423 -1.438 8.167 1.00 0.00 C ATOM 1278 CG LYS A 251 13.846 -0.025 7.783 1.00 0.00 C ATOM 1279 CD LYS A 251 13.455 0.320 6.354 1.00 0.00 C ATOM 1280 CE LYS A 251 13.955 1.694 5.952 1.00 0.00 C ATOM 1281 NZ LYS A 251 13.356 2.771 6.780 1.00 0.00 N ATOM 0 H LYS A 251 14.914 -2.615 5.554 1.00 0.00 H new ATOM 0 HA LYS A 251 15.342 -2.260 7.670 1.00 0.00 H new ATOM 0 HB2 LYS A 251 12.390 -1.593 7.857 1.00 0.00 H new ATOM 0 HB3 LYS A 251 13.447 -1.530 9.253 1.00 0.00 H new ATOM 0 HG2 LYS A 251 13.387 0.689 8.467 1.00 0.00 H new ATOM 0 HG3 LYS A 251 14.926 0.074 7.897 1.00 0.00 H new ATOM 0 HD2 LYS A 251 13.862 -0.429 5.674 1.00 0.00 H new ATOM 0 HD3 LYS A 251 12.370 0.284 6.255 1.00 0.00 H new ATOM 0 HE2 LYS A 251 15.040 1.726 6.046 1.00 0.00 H new ATOM 0 HE3 LYS A 251 13.721 1.872 4.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 251 13.618 3.698 6.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 251 12.320 2.674 6.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 251 13.710 2.696 7.755 1.00 0.00 H new