USER MOD reduce.3.24.130724 H: found=0, std=0, add=557, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 558 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 981 THR OG1 : rot 89:sc= 1.27 USER MOD Single : A 987 MET CE :methyl 167:sc= -3.36! (180deg=-3.87!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 994 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 699 SER OG : rot 73:sc= 1.1 USER MOD Single : B 701 MET CE :methyl 158:sc= -0.129 (180deg=-0.87) USER MOD Single : B 716 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 720 THR OG1 : rot 82:sc= 1.05 USER MOD Single : B 722 HIS : no HE2:sc= 1.14 K(o=1.1,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 136 N ILE A 966 32.635 -19.217 -1.239 1.00 1.00 N ATOM 137 CA ILE A 966 32.910 -18.485 -0.016 1.00 1.00 C ATOM 138 C ILE A 966 34.211 -17.684 -0.128 1.00 1.00 C ATOM 139 O ILE A 966 34.270 -16.546 0.337 1.00 1.00 O ATOM 140 CB ILE A 966 33.017 -19.455 1.167 1.00 1.00 C ATOM 141 CG1 ILE A 966 31.638 -20.057 1.446 1.00 1.00 C ATOM 142 CG2 ILE A 966 33.492 -18.701 2.413 1.00 1.00 C ATOM 143 CD1 ILE A 966 31.765 -21.228 2.412 1.00 1.00 C ATOM 0 HA ILE A 966 32.085 -17.791 0.147 1.00 1.00 H new ATOM 0 HB ILE A 966 33.730 -20.244 0.925 1.00 1.00 H new ATOM 0 HG12 ILE A 966 30.979 -19.298 1.867 1.00 1.00 H new ATOM 0 HG13 ILE A 966 31.183 -20.392 0.514 1.00 1.00 H new ATOM 0 HG21 ILE A 966 33.567 -19.394 3.251 1.00 1.00 H new ATOM 0 HG22 ILE A 966 34.469 -18.258 2.220 1.00 1.00 H new ATOM 0 HG23 ILE A 966 32.779 -17.913 2.656 1.00 1.00 H new ATOM 0 HD11 ILE A 966 30.778 -21.650 2.604 1.00 1.00 H new ATOM 0 HD12 ILE A 966 32.407 -21.992 1.975 1.00 1.00 H new ATOM 0 HD13 ILE A 966 32.200 -20.881 3.349 1.00 1.00 H new ATOM 155 N TRP A 967 35.254 -18.268 -0.717 1.00 1.00 N ATOM 156 CA TRP A 967 36.544 -17.555 -0.834 1.00 1.00 C ATOM 157 C TRP A 967 36.394 -16.265 -1.656 1.00 1.00 C ATOM 158 O TRP A 967 37.030 -15.236 -1.387 1.00 1.00 O ATOM 159 CB TRP A 967 37.584 -18.443 -1.516 1.00 1.00 C ATOM 160 CG TRP A 967 37.938 -19.594 -0.626 1.00 1.00 C ATOM 161 CD1 TRP A 967 37.609 -20.885 -0.867 1.00 1.00 C ATOM 162 CD2 TRP A 967 38.662 -19.587 0.640 1.00 1.00 C ATOM 163 NE1 TRP A 967 38.085 -21.673 0.166 1.00 1.00 N ATOM 164 CE2 TRP A 967 38.740 -20.921 1.119 1.00 1.00 C ATOM 165 CE3 TRP A 967 39.254 -18.567 1.411 1.00 1.00 C ATOM 166 CZ2 TRP A 967 39.380 -21.229 2.318 1.00 1.00 C ATOM 167 CZ3 TRP A 967 39.900 -18.878 2.618 1.00 1.00 C ATOM 168 CH2 TRP A 967 39.962 -20.206 3.070 1.00 1.00 C ATOM 0 H TRP A 967 35.243 -19.208 -1.114 1.00 1.00 H new ATOM 0 HA TRP A 967 36.868 -17.304 0.176 1.00 1.00 H new ATOM 0 HB2 TRP A 967 37.193 -18.813 -2.464 1.00 1.00 H new ATOM 0 HB3 TRP A 967 38.477 -17.861 -1.745 1.00 1.00 H new ATOM 0 HD1 TRP A 967 37.063 -21.242 -1.727 1.00 1.00 H new ATOM 0 HE1 TRP A 967 37.966 -22.685 0.217 1.00 1.00 H new ATOM 0 HE3 TRP A 967 39.211 -17.542 1.072 1.00 1.00 H new ATOM 0 HZ2 TRP A 967 39.426 -22.251 2.663 1.00 1.00 H new ATOM 0 HZ3 TRP A 967 40.352 -18.091 3.203 1.00 1.00 H new ATOM 0 HH2 TRP A 967 40.460 -20.437 4.000 1.00 1.00 H new ATOM 179 N TRP A 968 35.579 -16.335 -2.706 1.00 1.00 N ATOM 180 CA TRP A 968 35.400 -15.163 -3.578 1.00 1.00 C ATOM 181 C TRP A 968 34.730 -13.987 -2.854 1.00 1.00 C ATOM 182 O TRP A 968 35.184 -12.847 -2.967 1.00 1.00 O ATOM 183 CB TRP A 968 34.578 -15.541 -4.809 1.00 1.00 C ATOM 184 CG TRP A 968 35.414 -16.358 -5.744 1.00 1.00 C ATOM 185 CD1 TRP A 968 35.327 -17.698 -5.902 1.00 1.00 C ATOM 186 CD2 TRP A 968 36.454 -15.907 -6.658 1.00 1.00 C ATOM 187 NE1 TRP A 968 36.257 -18.099 -6.841 1.00 1.00 N ATOM 188 CE2 TRP A 968 36.977 -17.031 -7.336 1.00 1.00 C ATOM 189 CE3 TRP A 968 36.990 -14.642 -6.955 1.00 1.00 C ATOM 190 CZ2 TRP A 968 38.001 -16.906 -8.276 1.00 1.00 C ATOM 191 CZ3 TRP A 968 38.018 -14.512 -7.903 1.00 1.00 C ATOM 192 CH2 TRP A 968 38.524 -15.641 -8.560 1.00 1.00 C ATOM 0 H TRP A 968 35.044 -17.161 -2.974 1.00 1.00 H new ATOM 0 HA TRP A 968 36.396 -14.839 -3.880 1.00 1.00 H new ATOM 0 HB2 TRP A 968 33.695 -16.105 -4.509 1.00 1.00 H new ATOM 0 HB3 TRP A 968 34.226 -14.641 -5.313 1.00 1.00 H new ATOM 0 HD1 TRP A 968 34.642 -18.349 -5.379 1.00 1.00 H new ATOM 0 HE1 TRP A 968 36.395 -19.067 -7.133 1.00 1.00 H new ATOM 0 HE3 TRP A 968 36.609 -13.766 -6.452 1.00 1.00 H new ATOM 0 HZ2 TRP A 968 38.386 -17.780 -8.780 1.00 1.00 H new ATOM 0 HZ3 TRP A 968 38.421 -13.535 -8.127 1.00 1.00 H new ATOM 0 HH2 TRP A 968 39.317 -15.534 -9.285 1.00 1.00 H new ATOM 203 N VAL A 969 33.654 -14.250 -2.115 1.00 1.00 N ATOM 204 CA VAL A 969 32.976 -13.161 -1.408 1.00 1.00 C ATOM 205 C VAL A 969 33.880 -12.567 -0.327 1.00 1.00 C ATOM 206 O VAL A 969 33.885 -11.354 -0.109 1.00 1.00 O ATOM 207 CB VAL A 969 31.642 -13.619 -0.803 1.00 1.00 C ATOM 208 CG1 VAL A 969 31.881 -14.748 0.184 1.00 1.00 C ATOM 209 CG2 VAL A 969 30.974 -12.438 -0.080 1.00 1.00 C ATOM 0 H VAL A 969 33.242 -15.175 -1.991 1.00 1.00 H new ATOM 0 HA VAL A 969 32.757 -12.385 -2.142 1.00 1.00 H new ATOM 0 HB VAL A 969 30.991 -13.974 -1.602 1.00 1.00 H new ATOM 0 HG11 VAL A 969 30.929 -15.067 0.609 1.00 1.00 H new ATOM 0 HG12 VAL A 969 32.349 -15.588 -0.330 1.00 1.00 H new ATOM 0 HG13 VAL A 969 32.537 -14.401 0.983 1.00 1.00 H new ATOM 0 HG21 VAL A 969 30.027 -12.763 0.350 1.00 1.00 H new ATOM 0 HG22 VAL A 969 31.629 -12.080 0.714 1.00 1.00 H new ATOM 0 HG23 VAL A 969 30.792 -11.632 -0.791 1.00 1.00 H new ATOM 219 N LEU A 970 34.647 -13.425 0.343 1.00 1.00 N ATOM 220 CA LEU A 970 35.549 -12.967 1.392 1.00 1.00 C ATOM 221 C LEU A 970 36.607 -12.036 0.812 1.00 1.00 C ATOM 222 O LEU A 970 36.947 -11.015 1.411 1.00 1.00 O ATOM 223 CB LEU A 970 36.224 -14.168 2.064 1.00 1.00 C ATOM 224 CG LEU A 970 35.190 -14.961 2.878 1.00 1.00 C ATOM 225 CD1 LEU A 970 35.813 -16.274 3.366 1.00 1.00 C ATOM 226 CD2 LEU A 970 34.717 -14.141 4.085 1.00 1.00 C ATOM 0 H LEU A 970 34.661 -14.432 0.179 1.00 1.00 H new ATOM 0 HA LEU A 970 34.970 -12.420 2.136 1.00 1.00 H new ATOM 0 HB2 LEU A 970 36.676 -14.811 1.309 1.00 1.00 H new ATOM 0 HB3 LEU A 970 37.028 -13.827 2.716 1.00 1.00 H new ATOM 0 HG LEU A 970 34.334 -15.177 2.239 1.00 1.00 H new ATOM 0 HD11 LEU A 970 35.077 -16.834 3.943 1.00 1.00 H new ATOM 0 HD12 LEU A 970 36.129 -16.868 2.508 1.00 1.00 H new ATOM 0 HD13 LEU A 970 36.676 -16.056 3.994 1.00 1.00 H new ATOM 0 HD21 LEU A 970 33.985 -14.716 4.651 1.00 1.00 H new ATOM 0 HD22 LEU A 970 35.569 -13.909 4.724 1.00 1.00 H new ATOM 0 HD23 LEU A 970 34.260 -13.214 3.739 1.00 1.00 H new ATOM 238 N VAL A 971 37.128 -12.396 -0.358 1.00 1.00 N ATOM 239 CA VAL A 971 38.151 -11.586 -1.004 1.00 1.00 C ATOM 240 C VAL A 971 37.610 -10.200 -1.337 1.00 1.00 C ATOM 241 O VAL A 971 38.271 -9.194 -1.093 1.00 1.00 O ATOM 242 CB VAL A 971 38.631 -12.272 -2.285 1.00 1.00 C ATOM 243 CG1 VAL A 971 39.548 -11.322 -3.064 1.00 1.00 C ATOM 244 CG2 VAL A 971 39.403 -13.539 -1.917 1.00 1.00 C ATOM 0 H VAL A 971 36.861 -13.235 -0.872 1.00 1.00 H new ATOM 0 HA VAL A 971 38.989 -11.478 -0.315 1.00 1.00 H new ATOM 0 HB VAL A 971 37.773 -12.532 -2.904 1.00 1.00 H new ATOM 0 HG11 VAL A 971 39.889 -11.812 -3.976 1.00 1.00 H new ATOM 0 HG12 VAL A 971 38.999 -10.416 -3.322 1.00 1.00 H new ATOM 0 HG13 VAL A 971 40.409 -11.061 -2.449 1.00 1.00 H new ATOM 0 HG21 VAL A 971 39.747 -14.032 -2.826 1.00 1.00 H new ATOM 0 HG22 VAL A 971 40.262 -13.275 -1.299 1.00 1.00 H new ATOM 0 HG23 VAL A 971 38.751 -14.214 -1.363 1.00 1.00 H new ATOM 254 N GLY A 972 36.401 -10.156 -1.888 1.00 1.00 N ATOM 255 CA GLY A 972 35.781 -8.883 -2.250 1.00 1.00 C ATOM 256 C GLY A 972 35.571 -8.008 -1.020 1.00 1.00 C ATOM 257 O GLY A 972 35.766 -6.792 -1.072 1.00 1.00 O ATOM 0 H GLY A 972 35.834 -10.979 -2.093 1.00 1.00 H new ATOM 0 HA2 GLY A 972 36.410 -8.360 -2.970 1.00 1.00 H new ATOM 0 HA3 GLY A 972 34.824 -9.066 -2.738 1.00 1.00 H new ATOM 261 N VAL A 973 35.178 -8.632 0.084 1.00 1.00 N ATOM 262 CA VAL A 973 34.951 -7.901 1.325 1.00 1.00 C ATOM 263 C VAL A 973 36.250 -7.270 1.814 1.00 1.00 C ATOM 264 O VAL A 973 36.276 -6.109 2.224 1.00 1.00 O ATOM 265 CB VAL A 973 34.398 -8.846 2.393 1.00 1.00 C ATOM 266 CG1 VAL A 973 34.383 -8.133 3.747 1.00 1.00 C ATOM 267 CG2 VAL A 973 32.972 -9.259 2.022 1.00 1.00 C ATOM 0 H VAL A 973 35.011 -9.636 0.146 1.00 1.00 H new ATOM 0 HA VAL A 973 34.226 -7.109 1.137 1.00 1.00 H new ATOM 0 HB VAL A 973 35.030 -9.732 2.454 1.00 1.00 H new ATOM 0 HG11 VAL A 973 33.989 -8.806 4.508 1.00 1.00 H new ATOM 0 HG12 VAL A 973 35.398 -7.838 4.014 1.00 1.00 H new ATOM 0 HG13 VAL A 973 33.752 -7.247 3.684 1.00 1.00 H new ATOM 0 HG21 VAL A 973 32.578 -9.932 2.783 1.00 1.00 H new ATOM 0 HG22 VAL A 973 32.341 -8.372 1.960 1.00 1.00 H new ATOM 0 HG23 VAL A 973 32.980 -9.767 1.057 1.00 1.00 H new ATOM 277 N LEU A 974 37.328 -8.044 1.764 1.00 1.00 N ATOM 278 CA LEU A 974 38.630 -7.554 2.200 1.00 1.00 C ATOM 279 C LEU A 974 39.069 -6.381 1.328 1.00 1.00 C ATOM 280 O LEU A 974 39.598 -5.387 1.827 1.00 1.00 O ATOM 281 CB LEU A 974 39.665 -8.685 2.115 1.00 1.00 C ATOM 282 CG LEU A 974 41.049 -8.183 2.548 1.00 1.00 C ATOM 283 CD1 LEU A 974 40.983 -7.623 3.972 1.00 1.00 C ATOM 284 CD2 LEU A 974 42.042 -9.347 2.509 1.00 1.00 C ATOM 0 H LEU A 974 37.327 -9.007 1.428 1.00 1.00 H new ATOM 0 HA LEU A 974 38.553 -7.215 3.233 1.00 1.00 H new ATOM 0 HB2 LEU A 974 39.358 -9.515 2.751 1.00 1.00 H new ATOM 0 HB3 LEU A 974 39.713 -9.066 1.095 1.00 1.00 H new ATOM 0 HG LEU A 974 41.372 -7.394 1.869 1.00 1.00 H new ATOM 0 HD11 LEU A 974 41.970 -7.269 4.270 1.00 1.00 H new ATOM 0 HD12 LEU A 974 40.276 -6.794 4.005 1.00 1.00 H new ATOM 0 HD13 LEU A 974 40.656 -8.406 4.656 1.00 1.00 H new ATOM 0 HD21 LEU A 974 43.027 -8.995 2.816 1.00 1.00 H new ATOM 0 HD22 LEU A 974 41.709 -10.132 3.188 1.00 1.00 H new ATOM 0 HD23 LEU A 974 42.098 -9.744 1.495 1.00 1.00 H new ATOM 296 N GLY A 975 38.850 -6.505 0.023 1.00 1.00 N ATOM 297 CA GLY A 975 39.231 -5.448 -0.908 1.00 1.00 C ATOM 298 C GLY A 975 38.474 -4.157 -0.608 1.00 1.00 C ATOM 299 O GLY A 975 39.040 -3.067 -0.677 1.00 1.00 O ATOM 0 H GLY A 975 38.415 -7.319 -0.411 1.00 1.00 H new ATOM 0 HA2 GLY A 975 40.304 -5.269 -0.841 1.00 1.00 H new ATOM 0 HA3 GLY A 975 39.024 -5.766 -1.930 1.00 1.00 H new ATOM 303 N GLY A 976 37.194 -4.285 -0.272 1.00 1.00 N ATOM 304 CA GLY A 976 36.385 -3.112 0.038 1.00 1.00 C ATOM 305 C GLY A 976 36.933 -2.398 1.271 1.00 1.00 C ATOM 306 O GLY A 976 36.989 -1.168 1.316 1.00 1.00 O ATOM 0 H GLY A 976 36.701 -5.175 -0.208 1.00 1.00 H new ATOM 0 HA2 GLY A 976 36.380 -2.430 -0.813 1.00 1.00 H new ATOM 0 HA3 GLY A 976 35.351 -3.411 0.212 1.00 1.00 H new ATOM 310 N LEU A 977 37.348 -3.182 2.261 1.00 1.00 N ATOM 311 CA LEU A 977 37.908 -2.622 3.488 1.00 1.00 C ATOM 312 C LEU A 977 39.187 -1.853 3.175 1.00 1.00 C ATOM 313 O LEU A 977 39.425 -0.769 3.711 1.00 1.00 O ATOM 314 CB LEU A 977 38.205 -3.747 4.487 1.00 1.00 C ATOM 315 CG LEU A 977 38.810 -3.176 5.778 1.00 1.00 C ATOM 316 CD1 LEU A 977 37.859 -2.146 6.394 1.00 1.00 C ATOM 317 CD2 LEU A 977 39.034 -4.317 6.775 1.00 1.00 C ATOM 0 H LEU A 977 37.308 -4.201 2.239 1.00 1.00 H new ATOM 0 HA LEU A 977 37.183 -1.937 3.928 1.00 1.00 H new ATOM 0 HB2 LEU A 977 37.287 -4.288 4.717 1.00 1.00 H new ATOM 0 HB3 LEU A 977 38.895 -4.464 4.042 1.00 1.00 H new ATOM 0 HG LEU A 977 39.758 -2.691 5.546 1.00 1.00 H new ATOM 0 HD11 LEU A 977 38.297 -1.747 7.309 1.00 1.00 H new ATOM 0 HD12 LEU A 977 37.695 -1.333 5.686 1.00 1.00 H new ATOM 0 HD13 LEU A 977 36.907 -2.623 6.626 1.00 1.00 H new ATOM 0 HD21 LEU A 977 39.464 -3.918 7.694 1.00 1.00 H new ATOM 0 HD22 LEU A 977 38.081 -4.797 6.998 1.00 1.00 H new ATOM 0 HD23 LEU A 977 39.717 -5.049 6.343 1.00 1.00 H new ATOM 329 N LEU A 978 40.008 -2.428 2.304 1.00 1.00 N ATOM 330 CA LEU A 978 41.267 -1.799 1.917 1.00 1.00 C ATOM 331 C LEU A 978 41.004 -0.461 1.236 1.00 1.00 C ATOM 332 O LEU A 978 41.707 0.519 1.484 1.00 1.00 O ATOM 333 CB LEU A 978 42.039 -2.726 0.969 1.00 1.00 C ATOM 334 CG LEU A 978 43.362 -2.078 0.535 1.00 1.00 C ATOM 335 CD1 LEU A 978 44.210 -1.746 1.765 1.00 1.00 C ATOM 336 CD2 LEU A 978 44.133 -3.054 -0.358 1.00 1.00 C ATOM 0 H LEU A 978 39.827 -3.325 1.853 1.00 1.00 H new ATOM 0 HA LEU A 978 41.863 -1.623 2.813 1.00 1.00 H new ATOM 0 HB2 LEU A 978 42.239 -3.676 1.464 1.00 1.00 H new ATOM 0 HB3 LEU A 978 41.431 -2.946 0.092 1.00 1.00 H new ATOM 0 HG LEU A 978 43.148 -1.160 -0.013 1.00 1.00 H new ATOM 0 HD11 LEU A 978 45.146 -1.287 1.448 1.00 1.00 H new ATOM 0 HD12 LEU A 978 43.665 -1.053 2.406 1.00 1.00 H new ATOM 0 HD13 LEU A 978 44.423 -2.661 2.318 1.00 1.00 H new ATOM 0 HD21 LEU A 978 45.073 -2.598 -0.669 1.00 1.00 H new ATOM 0 HD22 LEU A 978 44.339 -3.969 0.197 1.00 1.00 H new ATOM 0 HD23 LEU A 978 43.536 -3.290 -1.239 1.00 1.00 H new ATOM 348 N LEU A 979 39.999 -0.425 0.369 1.00 1.00 N ATOM 349 CA LEU A 979 39.665 0.805 -0.346 1.00 1.00 C ATOM 350 C LEU A 979 39.272 1.898 0.649 1.00 1.00 C ATOM 351 O LEU A 979 39.706 3.040 0.530 1.00 1.00 O ATOM 352 CB LEU A 979 38.503 0.524 -1.323 1.00 1.00 C ATOM 353 CG LEU A 979 38.039 1.799 -2.067 1.00 1.00 C ATOM 354 CD1 LEU A 979 37.231 2.722 -1.141 1.00 1.00 C ATOM 355 CD2 LEU A 979 39.244 2.567 -2.611 1.00 1.00 C ATOM 0 H LEU A 979 39.405 -1.223 0.144 1.00 1.00 H new ATOM 0 HA LEU A 979 40.533 1.148 -0.909 1.00 1.00 H new ATOM 0 HB2 LEU A 979 38.816 -0.225 -2.051 1.00 1.00 H new ATOM 0 HB3 LEU A 979 37.663 0.101 -0.772 1.00 1.00 H new ATOM 0 HG LEU A 979 37.401 1.483 -2.892 1.00 1.00 H new ATOM 0 HD11 LEU A 979 36.919 3.609 -1.693 1.00 1.00 H new ATOM 0 HD12 LEU A 979 36.350 2.192 -0.778 1.00 1.00 H new ATOM 0 HD13 LEU A 979 37.850 3.020 -0.295 1.00 1.00 H new ATOM 0 HD21 LEU A 979 38.901 3.461 -3.132 1.00 1.00 H new ATOM 0 HD22 LEU A 979 39.895 2.855 -1.785 1.00 1.00 H new ATOM 0 HD23 LEU A 979 39.797 1.933 -3.304 1.00 1.00 H new ATOM 367 N LEU A 980 38.456 1.536 1.635 1.00 1.00 N ATOM 368 CA LEU A 980 38.021 2.493 2.648 1.00 1.00 C ATOM 369 C LEU A 980 39.219 2.997 3.448 1.00 1.00 C ATOM 370 O LEU A 980 39.326 4.185 3.754 1.00 1.00 O ATOM 371 CB LEU A 980 36.997 1.836 3.584 1.00 1.00 C ATOM 372 CG LEU A 980 36.534 2.836 4.647 1.00 1.00 C ATOM 373 CD1 LEU A 980 35.911 4.068 3.982 1.00 1.00 C ATOM 374 CD2 LEU A 980 35.493 2.168 5.545 1.00 1.00 C ATOM 0 H LEU A 980 38.085 0.593 1.754 1.00 1.00 H new ATOM 0 HA LEU A 980 37.552 3.343 2.152 1.00 1.00 H new ATOM 0 HB2 LEU A 980 36.141 1.484 3.008 1.00 1.00 H new ATOM 0 HB3 LEU A 980 37.440 0.963 4.064 1.00 1.00 H new ATOM 0 HG LEU A 980 37.394 3.149 5.239 1.00 1.00 H new ATOM 0 HD11 LEU A 980 35.586 4.771 4.749 1.00 1.00 H new ATOM 0 HD12 LEU A 980 36.650 4.548 3.340 1.00 1.00 H new ATOM 0 HD13 LEU A 980 35.053 3.763 3.383 1.00 1.00 H new ATOM 0 HD21 LEU A 980 35.160 2.876 6.304 1.00 1.00 H new ATOM 0 HD22 LEU A 980 34.641 1.854 4.943 1.00 1.00 H new ATOM 0 HD23 LEU A 980 35.935 1.298 6.030 1.00 1.00 H new ATOM 386 N THR A 981 40.112 2.077 3.783 1.00 1.00 N ATOM 387 CA THR A 981 41.307 2.407 4.556 1.00 1.00 C ATOM 388 C THR A 981 42.206 3.403 3.822 1.00 1.00 C ATOM 389 O THR A 981 42.709 4.346 4.428 1.00 1.00 O ATOM 390 CB THR A 981 42.106 1.130 4.845 1.00 1.00 C ATOM 391 OG1 THR A 981 41.228 0.139 5.349 1.00 1.00 O ATOM 392 CG2 THR A 981 43.188 1.426 5.884 1.00 1.00 C ATOM 0 H THR A 981 40.034 1.092 3.532 1.00 1.00 H new ATOM 0 HA THR A 981 40.977 2.869 5.487 1.00 1.00 H new ATOM 0 HB THR A 981 42.575 0.776 3.927 1.00 1.00 H new ATOM 0 HG1 THR A 981 40.845 -0.369 4.603 1.00 1.00 H new ATOM 0 HG21 THR A 981 43.755 0.518 6.088 1.00 1.00 H new ATOM 0 HG22 THR A 981 43.860 2.194 5.501 1.00 1.00 H new ATOM 0 HG23 THR A 981 42.722 1.777 6.805 1.00 1.00 H new ATOM 400 N ILE A 982 42.419 3.189 2.522 1.00 1.00 N ATOM 401 CA ILE A 982 43.291 4.078 1.760 1.00 1.00 C ATOM 402 C ILE A 982 42.748 5.507 1.721 1.00 1.00 C ATOM 403 O ILE A 982 43.497 6.468 1.928 1.00 1.00 O ATOM 404 CB ILE A 982 43.442 3.548 0.331 1.00 1.00 C ATOM 405 CG1 ILE A 982 44.241 2.239 0.356 1.00 1.00 C ATOM 406 CG2 ILE A 982 44.186 4.579 -0.520 1.00 1.00 C ATOM 407 CD1 ILE A 982 44.157 1.562 -1.016 1.00 1.00 C ATOM 0 H ILE A 982 42.009 2.424 1.986 1.00 1.00 H new ATOM 0 HA ILE A 982 44.261 4.101 2.256 1.00 1.00 H new ATOM 0 HB ILE A 982 42.455 3.367 -0.096 1.00 1.00 H new ATOM 0 HG12 ILE A 982 45.281 2.441 0.611 1.00 1.00 H new ATOM 0 HG13 ILE A 982 43.847 1.575 1.126 1.00 1.00 H new ATOM 0 HG21 ILE A 982 44.294 4.202 -1.537 1.00 1.00 H new ATOM 0 HG22 ILE A 982 43.622 5.512 -0.537 1.00 1.00 H new ATOM 0 HG23 ILE A 982 45.173 4.759 -0.094 1.00 1.00 H new ATOM 0 HD11 ILE A 982 44.725 0.632 -0.998 1.00 1.00 H new ATOM 0 HD12 ILE A 982 43.115 1.347 -1.252 1.00 1.00 H new ATOM 0 HD13 ILE A 982 44.571 2.225 -1.775 1.00 1.00 H new ATOM 419 N LEU A 983 41.452 5.637 1.477 1.00 1.00 N ATOM 420 CA LEU A 983 40.821 6.962 1.428 1.00 1.00 C ATOM 421 C LEU A 983 40.844 7.626 2.822 1.00 1.00 C ATOM 422 O LEU A 983 40.956 8.852 2.993 1.00 1.00 O ATOM 423 CB LEU A 983 39.382 6.853 0.932 1.00 1.00 C ATOM 424 CG LEU A 983 39.355 6.933 -0.595 1.00 1.00 C ATOM 425 CD1 LEU A 983 40.228 5.833 -1.195 1.00 1.00 C ATOM 426 CD2 LEU A 983 37.916 6.756 -1.082 1.00 1.00 C ATOM 0 H LEU A 983 40.817 4.856 1.311 1.00 1.00 H new ATOM 0 HA LEU A 983 41.388 7.581 0.733 1.00 1.00 H new ATOM 0 HB2 LEU A 983 38.943 5.912 1.264 1.00 1.00 H new ATOM 0 HB3 LEU A 983 38.779 7.654 1.358 1.00 1.00 H new ATOM 0 HG LEU A 983 39.739 7.904 -0.909 1.00 1.00 H new ATOM 0 HD11 LEU A 983 40.201 5.900 -2.283 1.00 1.00 H new ATOM 0 HD12 LEU A 983 41.255 5.954 -0.849 1.00 1.00 H new ATOM 0 HD13 LEU A 983 39.852 4.859 -0.882 1.00 1.00 H new ATOM 0 HD21 LEU A 983 37.891 6.812 -2.170 1.00 1.00 H new ATOM 0 HD22 LEU A 983 37.540 5.785 -0.760 1.00 1.00 H new ATOM 0 HD23 LEU A 983 37.291 7.545 -0.663 1.00 1.00 H new ATOM 438 N VAL A 984 40.704 6.784 3.856 1.00 1.00 N ATOM 439 CA VAL A 984 40.713 7.328 5.230 1.00 1.00 C ATOM 440 C VAL A 984 42.090 7.892 5.581 1.00 1.00 C ATOM 441 O VAL A 984 42.209 8.976 6.164 1.00 1.00 O ATOM 442 CB VAL A 984 40.293 6.275 6.253 1.00 1.00 C ATOM 443 CG1 VAL A 984 40.559 6.770 7.673 1.00 1.00 C ATOM 444 CG2 VAL A 984 38.799 5.981 6.091 1.00 1.00 C ATOM 0 H VAL A 984 40.588 5.773 3.782 1.00 1.00 H new ATOM 0 HA VAL A 984 39.984 8.138 5.266 1.00 1.00 H new ATOM 0 HB VAL A 984 40.874 5.368 6.083 1.00 1.00 H new ATOM 0 HG11 VAL A 984 40.253 6.006 8.388 1.00 1.00 H new ATOM 0 HG12 VAL A 984 41.623 6.975 7.794 1.00 1.00 H new ATOM 0 HG13 VAL A 984 39.991 7.683 7.852 1.00 1.00 H new ATOM 0 HG21 VAL A 984 38.495 5.230 6.820 1.00 1.00 H new ATOM 0 HG22 VAL A 984 38.229 6.896 6.253 1.00 1.00 H new ATOM 0 HG23 VAL A 984 38.609 5.608 5.085 1.00 1.00 H new ATOM 454 N LEU A 985 43.135 7.138 5.233 1.00 1.00 N ATOM 455 CA LEU A 985 44.508 7.568 5.529 1.00 1.00 C ATOM 456 C LEU A 985 44.812 8.875 4.777 1.00 1.00 C ATOM 457 O LEU A 985 45.457 9.803 5.285 1.00 1.00 O ATOM 458 CB LEU A 985 45.492 6.477 5.097 1.00 1.00 C ATOM 459 CG LEU A 985 45.344 5.250 6.006 1.00 1.00 C ATOM 460 CD1 LEU A 985 46.164 4.091 5.432 1.00 1.00 C ATOM 461 CD2 LEU A 985 45.832 5.568 7.427 1.00 1.00 C ATOM 0 H LEU A 985 43.062 6.241 4.754 1.00 1.00 H new ATOM 0 HA LEU A 985 44.612 7.739 6.600 1.00 1.00 H new ATOM 0 HB2 LEU A 985 45.306 6.197 4.060 1.00 1.00 H new ATOM 0 HB3 LEU A 985 46.513 6.856 5.146 1.00 1.00 H new ATOM 0 HG LEU A 985 44.291 4.973 6.053 1.00 1.00 H new ATOM 0 HD11 LEU A 985 46.060 3.218 6.076 1.00 1.00 H new ATOM 0 HD12 LEU A 985 45.802 3.849 4.433 1.00 1.00 H new ATOM 0 HD13 LEU A 985 47.214 4.380 5.378 1.00 1.00 H new ATOM 0 HD21 LEU A 985 45.719 4.685 8.057 1.00 1.00 H new ATOM 0 HD22 LEU A 985 46.882 5.859 7.395 1.00 1.00 H new ATOM 0 HD23 LEU A 985 45.242 6.386 7.840 1.00 1.00 H new ATOM 473 N ALA A 986 44.331 8.945 3.526 1.00 1.00 N ATOM 474 CA ALA A 986 44.577 10.167 2.729 1.00 1.00 C ATOM 475 C ALA A 986 43.886 11.371 3.376 1.00 1.00 C ATOM 476 O ALA A 986 44.441 12.467 3.424 1.00 1.00 O ATOM 477 CB ALA A 986 44.080 10.016 1.289 1.00 1.00 C ATOM 0 H ALA A 986 43.796 8.213 3.059 1.00 1.00 H new ATOM 0 HA ALA A 986 45.655 10.325 2.706 1.00 1.00 H new ATOM 0 HB1 ALA A 986 44.279 10.935 0.737 1.00 1.00 H new ATOM 0 HB2 ALA A 986 44.599 9.185 0.810 1.00 1.00 H new ATOM 0 HB3 ALA A 986 43.008 9.820 1.293 1.00 1.00 H new ATOM 483 N MET A 987 42.680 11.157 3.889 1.00 1.00 N ATOM 484 CA MET A 987 41.945 12.237 4.534 1.00 1.00 C ATOM 485 C MET A 987 42.685 12.717 5.782 1.00 1.00 C ATOM 486 O MET A 987 42.780 13.916 6.038 1.00 1.00 O ATOM 487 CB MET A 987 40.552 11.747 4.917 1.00 1.00 C ATOM 488 CG MET A 987 39.679 11.663 3.662 1.00 1.00 C ATOM 489 SD MET A 987 38.046 11.008 4.096 1.00 1.00 S ATOM 490 CE MET A 987 37.469 10.694 2.407 1.00 1.00 C ATOM 0 H MET A 987 42.196 10.259 3.872 1.00 1.00 H new ATOM 0 HA MET A 987 41.861 13.071 3.837 1.00 1.00 H new ATOM 0 HB2 MET A 987 40.617 10.769 5.394 1.00 1.00 H new ATOM 0 HB3 MET A 987 40.102 12.426 5.641 1.00 1.00 H new ATOM 0 HG2 MET A 987 39.577 12.650 3.211 1.00 1.00 H new ATOM 0 HG3 MET A 987 40.153 11.021 2.920 1.00 1.00 H new ATOM 0 HE1 MET A 987 36.572 10.075 2.438 1.00 1.00 H new ATOM 0 HE2 MET A 987 37.239 11.641 1.919 1.00 1.00 H new ATOM 0 HE3 MET A 987 38.248 10.177 1.847 1.00 1.00 H new ATOM 500 N TRP A 988 43.229 11.772 6.539 1.00 1.00 N ATOM 501 CA TRP A 988 43.978 12.098 7.749 1.00 1.00 C ATOM 502 C TRP A 988 45.186 12.963 7.380 1.00 1.00 C ATOM 503 O TRP A 988 45.490 13.958 8.043 1.00 1.00 O ATOM 504 CB TRP A 988 44.455 10.801 8.425 1.00 1.00 C ATOM 505 CG TRP A 988 44.586 10.976 9.911 1.00 1.00 C ATOM 506 CD1 TRP A 988 44.793 12.149 10.562 1.00 1.00 C ATOM 507 CD2 TRP A 988 44.520 9.946 10.942 1.00 1.00 C ATOM 508 NE1 TRP A 988 44.852 11.900 11.922 1.00 1.00 N ATOM 509 CE2 TRP A 988 44.691 10.559 12.205 1.00 1.00 C ATOM 510 CE3 TRP A 988 44.330 8.551 10.904 1.00 1.00 C ATOM 511 CZ2 TRP A 988 44.672 9.819 13.386 1.00 1.00 C ATOM 512 CZ3 TRP A 988 44.311 7.801 12.092 1.00 1.00 C ATOM 513 CH2 TRP A 988 44.481 8.436 13.331 1.00 1.00 C ATOM 0 H TRP A 988 43.166 10.774 6.338 1.00 1.00 H new ATOM 0 HA TRP A 988 43.337 12.647 8.439 1.00 1.00 H new ATOM 0 HB2 TRP A 988 43.750 9.997 8.212 1.00 1.00 H new ATOM 0 HB3 TRP A 988 45.416 10.502 8.006 1.00 1.00 H new ATOM 0 HD1 TRP A 988 44.895 13.118 10.095 1.00 1.00 H new ATOM 0 HE1 TRP A 988 44.997 12.620 12.629 1.00 1.00 H new ATOM 0 HE3 TRP A 988 44.198 8.054 9.954 1.00 1.00 H new ATOM 0 HZ2 TRP A 988 44.804 10.312 14.338 1.00 1.00 H new ATOM 0 HZ3 TRP A 988 44.165 6.732 12.051 1.00 1.00 H new ATOM 0 HH2 TRP A 988 44.464 7.856 14.242 1.00 1.00 H new ATOM 524 N LYS A 989 45.869 12.567 6.307 1.00 1.00 N ATOM 525 CA LYS A 989 47.051 13.290 5.844 1.00 1.00 C ATOM 526 C LYS A 989 46.640 14.620 5.210 1.00 1.00 C ATOM 527 O LYS A 989 47.482 15.474 4.942 1.00 1.00 O ATOM 528 CB LYS A 989 47.805 12.442 4.804 1.00 1.00 C ATOM 529 CG LYS A 989 49.170 11.955 5.346 1.00 1.00 C ATOM 530 CD LYS A 989 50.296 12.979 5.086 1.00 1.00 C ATOM 531 CE LYS A 989 50.273 14.099 6.133 1.00 1.00 C ATOM 532 NZ LYS A 989 51.543 14.875 6.048 1.00 1.00 N ATOM 0 H LYS A 989 45.625 11.752 5.744 1.00 1.00 H new ATOM 0 HA LYS A 989 47.700 13.485 6.698 1.00 1.00 H new ATOM 0 HB2 LYS A 989 47.196 11.582 4.525 1.00 1.00 H new ATOM 0 HB3 LYS A 989 47.961 13.029 3.899 1.00 1.00 H new ATOM 0 HG2 LYS A 989 49.089 11.770 6.417 1.00 1.00 H new ATOM 0 HG3 LYS A 989 49.428 11.006 4.877 1.00 1.00 H new ATOM 0 HD2 LYS A 989 51.262 12.475 5.108 1.00 1.00 H new ATOM 0 HD3 LYS A 989 50.182 13.406 4.089 1.00 1.00 H new ATOM 0 HE2 LYS A 989 49.420 14.755 5.962 1.00 1.00 H new ATOM 0 HE3 LYS A 989 50.156 13.678 7.131 1.00 1.00 H new ATOM 0 HZ1 LYS A 989 51.533 15.636 6.756 1.00 1.00 H new ATOM 0 HZ2 LYS A 989 52.349 14.243 6.230 1.00 1.00 H new ATOM 0 HZ3 LYS A 989 51.635 15.288 5.098 1.00 1.00 H new ATOM 546 N VAL A 990 45.345 14.790 4.963 1.00 1.00 N ATOM 547 CA VAL A 990 44.859 16.024 4.354 1.00 1.00 C ATOM 548 C VAL A 990 44.505 17.037 5.435 1.00 1.00 C ATOM 549 O VAL A 990 44.350 18.224 5.160 1.00 1.00 O ATOM 550 CB VAL A 990 43.633 15.741 3.494 1.00 1.00 C ATOM 551 CG1 VAL A 990 42.928 17.056 3.162 1.00 1.00 C ATOM 552 CG2 VAL A 990 44.064 15.051 2.198 1.00 1.00 C ATOM 0 H VAL A 990 44.623 14.101 5.171 1.00 1.00 H new ATOM 0 HA VAL A 990 45.648 16.434 3.723 1.00 1.00 H new ATOM 0 HB VAL A 990 42.950 15.091 4.040 1.00 1.00 H new ATOM 0 HG11 VAL A 990 42.051 16.854 2.547 1.00 1.00 H new ATOM 0 HG12 VAL A 990 42.618 17.546 4.085 1.00 1.00 H new ATOM 0 HG13 VAL A 990 43.611 17.707 2.617 1.00 1.00 H new ATOM 0 HG21 VAL A 990 43.186 14.849 1.584 1.00 1.00 H new ATOM 0 HG22 VAL A 990 44.748 15.699 1.651 1.00 1.00 H new ATOM 0 HG23 VAL A 990 44.565 14.112 2.435 1.00 1.00 H new ATOM 562 N GLY A 991 44.376 16.556 6.665 1.00 1.00 N ATOM 563 CA GLY A 991 44.036 17.428 7.776 1.00 1.00 C ATOM 564 C GLY A 991 42.527 17.612 7.875 1.00 1.00 C ATOM 565 O GLY A 991 42.043 18.483 8.599 1.00 1.00 O ATOM 0 H GLY A 991 44.501 15.575 6.915 1.00 1.00 H new ATOM 0 HA2 GLY A 991 44.417 17.006 8.706 1.00 1.00 H new ATOM 0 HA3 GLY A 991 44.518 18.397 7.645 1.00 1.00 H new ATOM 569 N PHE A 992 41.786 16.785 7.147 1.00 1.00 N ATOM 570 CA PHE A 992 40.331 16.867 7.167 1.00 1.00 C ATOM 571 C PHE A 992 39.798 16.608 8.571 1.00 1.00 C ATOM 572 O PHE A 992 38.876 17.286 9.027 1.00 1.00 O ATOM 573 CB PHE A 992 39.724 15.853 6.191 1.00 1.00 C ATOM 574 CG PHE A 992 38.209 15.771 6.339 1.00 1.00 C ATOM 575 CD1 PHE A 992 37.434 16.893 6.700 1.00 1.00 C ATOM 576 CD2 PHE A 992 37.575 14.542 6.119 1.00 1.00 C ATOM 577 CE1 PHE A 992 36.046 16.772 6.835 1.00 1.00 C ATOM 578 CE2 PHE A 992 36.188 14.429 6.254 1.00 1.00 C ATOM 579 CZ PHE A 992 35.424 15.541 6.612 1.00 1.00 C ATOM 0 H PHE A 992 42.164 16.057 6.541 1.00 1.00 H new ATOM 0 HA PHE A 992 40.045 17.873 6.860 1.00 1.00 H new ATOM 0 HB2 PHE A 992 39.976 16.135 5.169 1.00 1.00 H new ATOM 0 HB3 PHE A 992 40.161 14.870 6.367 1.00 1.00 H new ATOM 0 HD1 PHE A 992 37.912 17.846 6.872 1.00 1.00 H new ATOM 0 HD2 PHE A 992 38.160 13.677 5.844 1.00 1.00 H new ATOM 0 HE1 PHE A 992 35.455 17.632 7.112 1.00 1.00 H new ATOM 0 HE2 PHE A 992 35.706 13.478 6.081 1.00 1.00 H new ATOM 0 HZ PHE A 992 34.353 15.450 6.717 1.00 1.00 H new ATOM 589 N PHE A 993 40.369 15.615 9.247 1.00 1.00 N ATOM 590 CA PHE A 993 39.913 15.284 10.594 1.00 1.00 C ATOM 591 C PHE A 993 40.660 16.117 11.629 1.00 1.00 C ATOM 592 O PHE A 993 40.392 16.019 12.828 1.00 1.00 O ATOM 593 CB PHE A 993 40.135 13.796 10.894 1.00 1.00 C ATOM 594 CG PHE A 993 39.619 12.942 9.752 1.00 1.00 C ATOM 595 CD1 PHE A 993 38.309 13.100 9.273 1.00 1.00 C ATOM 596 CD2 PHE A 993 40.459 11.980 9.177 1.00 1.00 C ATOM 597 CE1 PHE A 993 37.847 12.300 8.222 1.00 1.00 C ATOM 598 CE2 PHE A 993 39.994 11.180 8.127 1.00 1.00 C ATOM 599 CZ PHE A 993 38.690 11.341 7.650 1.00 1.00 C ATOM 0 H PHE A 993 41.132 15.037 8.895 1.00 1.00 H new ATOM 0 HA PHE A 993 38.847 15.505 10.648 1.00 1.00 H new ATOM 0 HB2 PHE A 993 41.197 13.604 11.048 1.00 1.00 H new ATOM 0 HB3 PHE A 993 39.625 13.525 11.818 1.00 1.00 H new ATOM 0 HD1 PHE A 993 37.658 13.839 9.716 1.00 1.00 H new ATOM 0 HD2 PHE A 993 41.467 11.855 9.544 1.00 1.00 H new ATOM 0 HE1 PHE A 993 36.840 12.423 7.852 1.00 1.00 H new ATOM 0 HE2 PHE A 993 40.643 10.438 7.685 1.00 1.00 H new ATOM 0 HZ PHE A 993 38.333 10.724 6.839 1.00 1.00 H new ATOM 609 N LYS A 994 41.585 16.946 11.157 1.00 1.00 N ATOM 610 CA LYS A 994 42.358 17.808 12.045 1.00 1.00 C ATOM 611 C LYS A 994 42.012 19.269 11.773 1.00 1.00 C ATOM 612 O LYS A 994 42.010 19.710 10.624 1.00 1.00 O ATOM 613 CB LYS A 994 43.855 17.583 11.827 1.00 1.00 C ATOM 614 CG LYS A 994 44.655 18.420 12.827 1.00 1.00 C ATOM 615 CD LYS A 994 46.149 18.152 12.640 1.00 1.00 C ATOM 616 CE LYS A 994 46.945 18.973 13.653 1.00 1.00 C ATOM 617 NZ LYS A 994 48.400 18.697 13.485 1.00 1.00 N ATOM 0 H LYS A 994 41.817 17.040 10.168 1.00 1.00 H new ATOM 0 HA LYS A 994 42.111 17.564 13.078 1.00 1.00 H new ATOM 0 HB2 LYS A 994 44.095 16.527 11.949 1.00 1.00 H new ATOM 0 HB3 LYS A 994 44.129 17.857 10.808 1.00 1.00 H new ATOM 0 HG2 LYS A 994 44.444 19.479 12.681 1.00 1.00 H new ATOM 0 HG3 LYS A 994 44.355 18.173 13.845 1.00 1.00 H new ATOM 0 HD2 LYS A 994 46.358 17.090 12.772 1.00 1.00 H new ATOM 0 HD3 LYS A 994 46.452 18.413 11.626 1.00 1.00 H new ATOM 0 HE2 LYS A 994 46.747 20.035 13.511 1.00 1.00 H new ATOM 0 HE3 LYS A 994 46.631 18.723 14.666 1.00 1.00 H new ATOM 0 HZ1 LYS A 994 48.941 19.256 14.175 1.00 1.00 H new ATOM 0 HZ2 LYS A 994 48.582 17.685 13.641 1.00 1.00 H new ATOM 0 HZ3 LYS A 994 48.694 18.957 12.522 1.00 1.00 H new ATOM 631 N ARG A 995 41.721 20.014 12.834 1.00 1.00 N ATOM 632 CA ARG A 995 41.379 21.419 12.698 1.00 1.00 C ATOM 633 C ARG A 995 42.153 22.215 13.733 1.00 1.00 C ATOM 634 O ARG A 995 42.513 21.682 14.782 1.00 1.00 O ATOM 635 CB ARG A 995 39.876 21.623 12.908 1.00 1.00 C ATOM 636 CG ARG A 995 39.090 20.894 11.818 1.00 1.00 C ATOM 637 CD ARG A 995 37.597 21.051 12.103 1.00 1.00 C ATOM 638 NE ARG A 995 37.219 22.456 11.984 1.00 1.00 N ATOM 639 CZ ARG A 995 36.011 22.878 12.336 1.00 1.00 C ATOM 640 NH1 ARG A 995 35.152 22.045 12.858 1.00 1.00 N ATOM 641 NH2 ARG A 995 35.689 24.132 12.178 1.00 1.00 N ATOM 0 H ARG A 995 41.716 19.667 13.793 1.00 1.00 H new ATOM 0 HA ARG A 995 41.638 21.759 11.695 1.00 1.00 H new ATOM 0 HB2 ARG A 995 39.584 21.249 13.889 1.00 1.00 H new ATOM 0 HB3 ARG A 995 39.639 22.687 12.888 1.00 1.00 H new ATOM 0 HG2 ARG A 995 39.333 21.305 10.838 1.00 1.00 H new ATOM 0 HG3 ARG A 995 39.362 19.839 11.798 1.00 1.00 H new ATOM 0 HD2 ARG A 995 37.018 20.448 11.404 1.00 1.00 H new ATOM 0 HD3 ARG A 995 37.368 20.686 13.104 1.00 1.00 H new ATOM 0 HE ARG A 995 37.897 23.127 11.623 1.00 1.00 H new ATOM 0 HH11 ARG A 995 35.409 21.068 12.996 1.00 1.00 H new ATOM 0 HH12 ARG A 995 34.224 22.372 13.128 1.00 1.00 H new ATOM 0 HH21 ARG A 995 36.365 24.786 11.784 1.00 1.00 H new ATOM 0 HH22 ARG A 995 34.761 24.458 12.448 1.00 1.00 H new ATOM 808 N ASP B 692 26.852 -16.592 -11.800 1.00 1.00 N ATOM 809 CA ASP B 692 26.248 -15.476 -11.078 1.00 1.00 C ATOM 810 C ASP B 692 27.119 -15.042 -9.901 1.00 1.00 C ATOM 811 O ASP B 692 26.793 -14.086 -9.198 1.00 1.00 O ATOM 812 CB ASP B 692 24.865 -15.881 -10.563 1.00 1.00 C ATOM 813 CG ASP B 692 23.913 -16.081 -11.738 1.00 1.00 C ATOM 814 OD1 ASP B 692 24.250 -15.645 -12.826 1.00 1.00 O ATOM 815 OD2 ASP B 692 22.864 -16.668 -11.531 1.00 1.00 O ATOM 0 HA ASP B 692 26.158 -14.637 -11.768 1.00 1.00 H new ATOM 0 HB2 ASP B 692 24.938 -16.800 -9.982 1.00 1.00 H new ATOM 0 HB3 ASP B 692 24.476 -15.112 -9.895 1.00 1.00 H new ATOM 820 N ILE B 693 28.226 -15.746 -9.691 1.00 1.00 N ATOM 821 CA ILE B 693 29.126 -15.414 -8.592 1.00 1.00 C ATOM 822 C ILE B 693 29.771 -14.053 -8.823 1.00 1.00 C ATOM 823 O ILE B 693 29.938 -13.270 -7.890 1.00 1.00 O ATOM 824 CB ILE B 693 30.211 -16.484 -8.440 1.00 1.00 C ATOM 825 CG1 ILE B 693 30.978 -16.257 -7.133 1.00 1.00 C ATOM 826 CG2 ILE B 693 31.185 -16.399 -9.616 1.00 1.00 C ATOM 827 CD1 ILE B 693 31.869 -17.465 -6.844 1.00 1.00 C ATOM 0 H ILE B 693 28.520 -16.541 -10.259 1.00 1.00 H new ATOM 0 HA ILE B 693 28.539 -15.376 -7.674 1.00 1.00 H new ATOM 0 HB ILE B 693 29.743 -17.468 -8.423 1.00 1.00 H new ATOM 0 HG12 ILE B 693 31.585 -15.355 -7.208 1.00 1.00 H new ATOM 0 HG13 ILE B 693 30.279 -16.104 -6.311 1.00 1.00 H new ATOM 0 HG21 ILE B 693 31.956 -17.161 -9.506 1.00 1.00 H new ATOM 0 HG22 ILE B 693 30.645 -16.562 -10.549 1.00 1.00 H new ATOM 0 HG23 ILE B 693 31.649 -15.413 -9.633 1.00 1.00 H new ATOM 0 HD11 ILE B 693 32.414 -17.301 -5.914 1.00 1.00 H new ATOM 0 HD12 ILE B 693 31.252 -18.358 -6.751 1.00 1.00 H new ATOM 0 HD13 ILE B 693 32.578 -17.598 -7.661 1.00 1.00 H new ATOM 839 N LEU B 694 30.133 -13.777 -10.071 1.00 1.00 N ATOM 840 CA LEU B 694 30.762 -12.506 -10.404 1.00 1.00 C ATOM 841 C LEU B 694 29.811 -11.354 -10.100 1.00 1.00 C ATOM 842 O LEU B 694 30.222 -10.328 -9.556 1.00 1.00 O ATOM 843 CB LEU B 694 31.141 -12.482 -11.887 1.00 1.00 C ATOM 844 CG LEU B 694 32.288 -13.468 -12.143 1.00 1.00 C ATOM 845 CD1 LEU B 694 32.516 -13.600 -13.649 1.00 1.00 C ATOM 846 CD2 LEU B 694 33.577 -12.973 -11.475 1.00 1.00 C ATOM 0 H LEU B 694 30.003 -14.409 -10.861 1.00 1.00 H new ATOM 0 HA LEU B 694 31.663 -12.393 -9.801 1.00 1.00 H new ATOM 0 HB2 LEU B 694 30.278 -12.747 -12.497 1.00 1.00 H new ATOM 0 HB3 LEU B 694 31.441 -11.476 -12.179 1.00 1.00 H new ATOM 0 HG LEU B 694 32.021 -14.437 -11.721 1.00 1.00 H new ATOM 0 HD11 LEU B 694 33.331 -14.300 -13.834 1.00 1.00 H new ATOM 0 HD12 LEU B 694 31.607 -13.968 -14.124 1.00 1.00 H new ATOM 0 HD13 LEU B 694 32.774 -12.626 -14.065 1.00 1.00 H new ATOM 0 HD21 LEU B 694 34.382 -13.683 -11.666 1.00 1.00 H new ATOM 0 HD22 LEU B 694 33.848 -12.000 -11.884 1.00 1.00 H new ATOM 0 HD23 LEU B 694 33.419 -12.884 -10.400 1.00 1.00 H new ATOM 858 N VAL B 695 28.539 -11.533 -10.438 1.00 1.00 N ATOM 859 CA VAL B 695 27.540 -10.502 -10.180 1.00 1.00 C ATOM 860 C VAL B 695 27.415 -10.268 -8.679 1.00 1.00 C ATOM 861 O VAL B 695 27.373 -9.128 -8.216 1.00 1.00 O ATOM 862 CB VAL B 695 26.186 -10.928 -10.751 1.00 1.00 C ATOM 863 CG1 VAL B 695 25.110 -9.938 -10.303 1.00 1.00 C ATOM 864 CG2 VAL B 695 26.258 -10.945 -12.278 1.00 1.00 C ATOM 0 H VAL B 695 28.177 -12.374 -10.887 1.00 1.00 H new ATOM 0 HA VAL B 695 27.854 -9.577 -10.663 1.00 1.00 H new ATOM 0 HB VAL B 695 25.937 -11.925 -10.388 1.00 1.00 H new ATOM 0 HG11 VAL B 695 24.145 -10.241 -10.709 1.00 1.00 H new ATOM 0 HG12 VAL B 695 25.057 -9.926 -9.214 1.00 1.00 H new ATOM 0 HG13 VAL B 695 25.360 -8.941 -10.665 1.00 1.00 H new ATOM 0 HG21 VAL B 695 25.293 -11.249 -12.684 1.00 1.00 H new ATOM 0 HG22 VAL B 695 26.507 -9.948 -12.642 1.00 1.00 H new ATOM 0 HG23 VAL B 695 27.025 -11.650 -12.598 1.00 1.00 H new ATOM 874 N VAL B 696 27.365 -11.361 -7.927 1.00 1.00 N ATOM 875 CA VAL B 696 27.253 -11.283 -6.477 1.00 1.00 C ATOM 876 C VAL B 696 28.485 -10.604 -5.883 1.00 1.00 C ATOM 877 O VAL B 696 28.372 -9.763 -4.991 1.00 1.00 O ATOM 878 CB VAL B 696 27.108 -12.689 -5.890 1.00 1.00 C ATOM 879 CG1 VAL B 696 27.191 -12.617 -4.365 1.00 1.00 C ATOM 880 CG2 VAL B 696 25.754 -13.273 -6.297 1.00 1.00 C ATOM 0 H VAL B 696 27.400 -12.311 -8.298 1.00 1.00 H new ATOM 0 HA VAL B 696 26.371 -10.693 -6.228 1.00 1.00 H new ATOM 0 HB VAL B 696 27.909 -13.324 -6.268 1.00 1.00 H new ATOM 0 HG11 VAL B 696 27.088 -13.618 -3.947 1.00 1.00 H new ATOM 0 HG12 VAL B 696 28.154 -12.199 -4.072 1.00 1.00 H new ATOM 0 HG13 VAL B 696 26.390 -11.982 -3.987 1.00 1.00 H new ATOM 0 HG21 VAL B 696 25.649 -14.274 -5.880 1.00 1.00 H new ATOM 0 HG22 VAL B 696 24.954 -12.637 -5.918 1.00 1.00 H new ATOM 0 HG23 VAL B 696 25.692 -13.325 -7.384 1.00 1.00 H new ATOM 890 N LEU B 697 29.660 -10.984 -6.379 1.00 1.00 N ATOM 891 CA LEU B 697 30.911 -10.414 -5.885 1.00 1.00 C ATOM 892 C LEU B 697 30.946 -8.907 -6.134 1.00 1.00 C ATOM 893 O LEU B 697 31.335 -8.130 -5.261 1.00 1.00 O ATOM 894 CB LEU B 697 32.089 -11.086 -6.607 1.00 1.00 C ATOM 895 CG LEU B 697 33.423 -10.493 -6.137 1.00 1.00 C ATOM 896 CD1 LEU B 697 33.567 -10.662 -4.624 1.00 1.00 C ATOM 897 CD2 LEU B 697 34.571 -11.220 -6.840 1.00 1.00 C ATOM 0 H LEU B 697 29.772 -11.679 -7.117 1.00 1.00 H new ATOM 0 HA LEU B 697 30.985 -10.589 -4.812 1.00 1.00 H new ATOM 0 HB2 LEU B 697 32.075 -12.159 -6.416 1.00 1.00 H new ATOM 0 HB3 LEU B 697 31.986 -10.953 -7.684 1.00 1.00 H new ATOM 0 HG LEU B 697 33.451 -9.431 -6.381 1.00 1.00 H new ATOM 0 HD11 LEU B 697 34.517 -10.238 -4.299 1.00 1.00 H new ATOM 0 HD12 LEU B 697 32.749 -10.147 -4.121 1.00 1.00 H new ATOM 0 HD13 LEU B 697 33.538 -11.722 -4.372 1.00 1.00 H new ATOM 0 HD21 LEU B 697 35.522 -10.803 -6.510 1.00 1.00 H new ATOM 0 HD22 LEU B 697 34.535 -12.281 -6.593 1.00 1.00 H new ATOM 0 HD23 LEU B 697 34.475 -11.095 -7.919 1.00 1.00 H new ATOM 909 N LEU B 698 30.532 -8.500 -7.325 1.00 1.00 N ATOM 910 CA LEU B 698 30.509 -7.085 -7.672 1.00 1.00 C ATOM 911 C LEU B 698 29.524 -6.318 -6.792 1.00 1.00 C ATOM 912 O LEU B 698 29.800 -5.195 -6.368 1.00 1.00 O ATOM 913 CB LEU B 698 30.126 -6.913 -9.144 1.00 1.00 C ATOM 914 CG LEU B 698 31.268 -7.415 -10.038 1.00 1.00 C ATOM 915 CD1 LEU B 698 30.794 -7.464 -11.491 1.00 1.00 C ATOM 916 CD2 LEU B 698 32.480 -6.479 -9.932 1.00 1.00 C ATOM 0 H LEU B 698 30.209 -9.124 -8.064 1.00 1.00 H new ATOM 0 HA LEU B 698 31.507 -6.680 -7.505 1.00 1.00 H new ATOM 0 HB2 LEU B 698 29.212 -7.467 -9.359 1.00 1.00 H new ATOM 0 HB3 LEU B 698 29.920 -5.864 -9.356 1.00 1.00 H new ATOM 0 HG LEU B 698 31.560 -8.412 -9.709 1.00 1.00 H new ATOM 0 HD11 LEU B 698 31.605 -7.820 -12.126 1.00 1.00 H new ATOM 0 HD12 LEU B 698 29.944 -8.141 -11.574 1.00 1.00 H new ATOM 0 HD13 LEU B 698 30.495 -6.466 -11.810 1.00 1.00 H new ATOM 0 HD21 LEU B 698 33.282 -6.848 -10.572 1.00 1.00 H new ATOM 0 HD22 LEU B 698 32.194 -5.476 -10.250 1.00 1.00 H new ATOM 0 HD23 LEU B 698 32.826 -6.447 -8.899 1.00 1.00 H new ATOM 928 N SER B 699 28.363 -6.919 -6.544 1.00 1.00 N ATOM 929 CA SER B 699 27.331 -6.267 -5.742 1.00 1.00 C ATOM 930 C SER B 699 27.818 -5.949 -4.328 1.00 1.00 C ATOM 931 O SER B 699 27.582 -4.851 -3.825 1.00 1.00 O ATOM 932 CB SER B 699 26.098 -7.166 -5.664 1.00 1.00 C ATOM 933 OG SER B 699 25.585 -7.374 -6.973 1.00 1.00 O ATOM 0 H SER B 699 28.114 -7.848 -6.883 1.00 1.00 H new ATOM 0 HA SER B 699 27.082 -5.324 -6.229 1.00 1.00 H new ATOM 0 HB2 SER B 699 26.358 -8.121 -5.207 1.00 1.00 H new ATOM 0 HB3 SER B 699 25.338 -6.707 -5.032 1.00 1.00 H new ATOM 0 HG SER B 699 26.175 -7.984 -7.462 1.00 1.00 H new ATOM 939 N VAL B 700 28.498 -6.896 -3.683 1.00 1.00 N ATOM 940 CA VAL B 700 28.991 -6.651 -2.330 1.00 1.00 C ATOM 941 C VAL B 700 30.054 -5.555 -2.335 1.00 1.00 C ATOM 942 O VAL B 700 30.073 -4.693 -1.456 1.00 1.00 O ATOM 943 CB VAL B 700 29.542 -7.935 -1.697 1.00 1.00 C ATOM 944 CG1 VAL B 700 28.387 -8.902 -1.432 1.00 1.00 C ATOM 945 CG2 VAL B 700 30.540 -8.604 -2.639 1.00 1.00 C ATOM 0 H VAL B 700 28.716 -7.817 -4.064 1.00 1.00 H new ATOM 0 HA VAL B 700 28.150 -6.315 -1.724 1.00 1.00 H new ATOM 0 HB VAL B 700 30.044 -7.681 -0.764 1.00 1.00 H new ATOM 0 HG11 VAL B 700 28.774 -9.816 -0.982 1.00 1.00 H new ATOM 0 HG12 VAL B 700 27.672 -8.438 -0.753 1.00 1.00 H new ATOM 0 HG13 VAL B 700 27.891 -9.142 -2.372 1.00 1.00 H new ATOM 0 HG21 VAL B 700 30.923 -9.514 -2.177 1.00 1.00 H new ATOM 0 HG22 VAL B 700 30.044 -8.854 -3.577 1.00 1.00 H new ATOM 0 HG23 VAL B 700 31.367 -7.922 -2.837 1.00 1.00 H new ATOM 955 N MET B 701 30.933 -5.586 -3.332 1.00 1.00 N ATOM 956 CA MET B 701 31.986 -4.582 -3.435 1.00 1.00 C ATOM 957 C MET B 701 31.382 -3.198 -3.646 1.00 1.00 C ATOM 958 O MET B 701 31.842 -2.212 -3.069 1.00 1.00 O ATOM 959 CB MET B 701 32.916 -4.921 -4.603 1.00 1.00 C ATOM 960 CG MET B 701 33.819 -6.091 -4.213 1.00 1.00 C ATOM 961 SD MET B 701 34.843 -6.565 -5.630 1.00 1.00 S ATOM 962 CE MET B 701 35.892 -5.090 -5.681 1.00 1.00 C ATOM 0 H MET B 701 30.938 -6.287 -4.073 1.00 1.00 H new ATOM 0 HA MET B 701 32.557 -4.580 -2.506 1.00 1.00 H new ATOM 0 HB2 MET B 701 32.330 -5.178 -5.485 1.00 1.00 H new ATOM 0 HB3 MET B 701 33.521 -4.052 -4.864 1.00 1.00 H new ATOM 0 HG2 MET B 701 34.452 -5.810 -3.371 1.00 1.00 H new ATOM 0 HG3 MET B 701 33.214 -6.938 -3.889 1.00 1.00 H new ATOM 0 HE1 MET B 701 36.821 -5.322 -6.202 1.00 1.00 H new ATOM 0 HE2 MET B 701 35.370 -4.291 -6.207 1.00 1.00 H new ATOM 0 HE3 MET B 701 36.117 -4.768 -4.664 1.00 1.00 H new ATOM 972 N GLY B 702 30.347 -3.132 -4.477 1.00 1.00 N ATOM 973 CA GLY B 702 29.685 -1.864 -4.757 1.00 1.00 C ATOM 974 C GLY B 702 29.036 -1.297 -3.499 1.00 1.00 C ATOM 975 O GLY B 702 29.095 -0.093 -3.251 1.00 1.00 O ATOM 0 H GLY B 702 29.951 -3.936 -4.965 1.00 1.00 H new ATOM 0 HA2 GLY B 702 30.409 -1.151 -5.150 1.00 1.00 H new ATOM 0 HA3 GLY B 702 28.928 -2.007 -5.528 1.00 1.00 H new ATOM 979 N ALA B 703 28.419 -2.168 -2.707 1.00 1.00 N ATOM 980 CA ALA B 703 27.763 -1.731 -1.479 1.00 1.00 C ATOM 981 C ALA B 703 28.785 -1.163 -0.500 1.00 1.00 C ATOM 982 O ALA B 703 28.526 -0.164 0.169 1.00 1.00 O ATOM 983 CB ALA B 703 27.031 -2.906 -0.830 1.00 1.00 C ATOM 0 H ALA B 703 28.359 -3.170 -2.890 1.00 1.00 H new ATOM 0 HA ALA B 703 27.044 -0.951 -1.731 1.00 1.00 H new ATOM 0 HB1 ALA B 703 26.544 -2.570 0.086 1.00 1.00 H new ATOM 0 HB2 ALA B 703 26.280 -3.292 -1.519 1.00 1.00 H new ATOM 0 HB3 ALA B 703 27.746 -3.694 -0.593 1.00 1.00 H new ATOM 989 N ILE B 704 29.948 -1.799 -0.428 1.00 1.00 N ATOM 990 CA ILE B 704 31.005 -1.344 0.468 1.00 1.00 C ATOM 991 C ILE B 704 31.487 0.044 0.060 1.00 1.00 C ATOM 992 O ILE B 704 31.692 0.915 0.907 1.00 1.00 O ATOM 993 CB ILE B 704 32.174 -2.329 0.443 1.00 1.00 C ATOM 994 CG1 ILE B 704 31.730 -3.646 1.086 1.00 1.00 C ATOM 995 CG2 ILE B 704 33.350 -1.748 1.230 1.00 1.00 C ATOM 996 CD1 ILE B 704 32.780 -4.728 0.826 1.00 1.00 C ATOM 0 H ILE B 704 30.183 -2.627 -0.976 1.00 1.00 H new ATOM 0 HA ILE B 704 30.604 -1.292 1.480 1.00 1.00 H new ATOM 0 HB ILE B 704 32.484 -2.507 -0.587 1.00 1.00 H new ATOM 0 HG12 ILE B 704 31.593 -3.510 2.159 1.00 1.00 H new ATOM 0 HG13 ILE B 704 30.767 -3.954 0.678 1.00 1.00 H new ATOM 0 HG21 ILE B 704 34.183 -2.451 1.212 1.00 1.00 H new ATOM 0 HG22 ILE B 704 33.660 -0.806 0.778 1.00 1.00 H new ATOM 0 HG23 ILE B 704 33.046 -1.573 2.262 1.00 1.00 H new ATOM 0 HD11 ILE B 704 32.460 -5.663 1.285 1.00 1.00 H new ATOM 0 HD12 ILE B 704 32.896 -4.872 -0.248 1.00 1.00 H new ATOM 0 HD13 ILE B 704 33.733 -4.420 1.256 1.00 1.00 H new ATOM 1008 N LEU B 705 31.665 0.240 -1.241 1.00 1.00 N ATOM 1009 CA LEU B 705 32.123 1.524 -1.759 1.00 1.00 C ATOM 1010 C LEU B 705 31.110 2.619 -1.426 1.00 1.00 C ATOM 1011 O LEU B 705 31.484 3.722 -1.023 1.00 1.00 O ATOM 1012 CB LEU B 705 32.295 1.424 -3.282 1.00 1.00 C ATOM 1013 CG LEU B 705 32.765 2.765 -3.862 1.00 1.00 C ATOM 1014 CD1 LEU B 705 34.088 3.174 -3.218 1.00 1.00 C ATOM 1015 CD2 LEU B 705 32.964 2.617 -5.373 1.00 1.00 C ATOM 0 H LEU B 705 31.500 -0.470 -1.954 1.00 1.00 H new ATOM 0 HA LEU B 705 33.077 1.777 -1.297 1.00 1.00 H new ATOM 0 HB2 LEU B 705 33.019 0.645 -3.521 1.00 1.00 H new ATOM 0 HB3 LEU B 705 31.350 1.134 -3.742 1.00 1.00 H new ATOM 0 HG LEU B 705 32.015 3.529 -3.658 1.00 1.00 H new ATOM 0 HD11 LEU B 705 34.416 4.127 -3.634 1.00 1.00 H new ATOM 0 HD12 LEU B 705 33.952 3.276 -2.141 1.00 1.00 H new ATOM 0 HD13 LEU B 705 34.841 2.412 -3.418 1.00 1.00 H new ATOM 0 HD21 LEU B 705 33.298 3.567 -5.791 1.00 1.00 H new ATOM 0 HD22 LEU B 705 33.715 1.851 -5.568 1.00 1.00 H new ATOM 0 HD23 LEU B 705 32.021 2.328 -5.838 1.00 1.00 H new ATOM 1027 N LEU B 706 29.830 2.305 -1.597 1.00 1.00 N ATOM 1028 CA LEU B 706 28.769 3.268 -1.316 1.00 1.00 C ATOM 1029 C LEU B 706 28.751 3.656 0.162 1.00 1.00 C ATOM 1030 O LEU B 706 28.578 4.827 0.501 1.00 1.00 O ATOM 1031 CB LEU B 706 27.410 2.678 -1.705 1.00 1.00 C ATOM 1032 CG LEU B 706 27.314 2.563 -3.231 1.00 1.00 C ATOM 1033 CD1 LEU B 706 26.064 1.766 -3.604 1.00 1.00 C ATOM 1034 CD2 LEU B 706 27.234 3.958 -3.867 1.00 1.00 C ATOM 0 H LEU B 706 29.503 1.397 -1.927 1.00 1.00 H new ATOM 0 HA LEU B 706 28.964 4.164 -1.906 1.00 1.00 H new ATOM 0 HB2 LEU B 706 27.285 1.696 -1.248 1.00 1.00 H new ATOM 0 HB3 LEU B 706 26.607 3.310 -1.327 1.00 1.00 H new ATOM 0 HG LEU B 706 28.203 2.054 -3.602 1.00 1.00 H new ATOM 0 HD11 LEU B 706 25.995 1.684 -4.689 1.00 1.00 H new ATOM 0 HD12 LEU B 706 26.125 0.769 -3.168 1.00 1.00 H new ATOM 0 HD13 LEU B 706 25.180 2.276 -3.222 1.00 1.00 H new ATOM 0 HD21 LEU B 706 27.166 3.861 -4.951 1.00 1.00 H new ATOM 0 HD22 LEU B 706 26.352 4.478 -3.494 1.00 1.00 H new ATOM 0 HD23 LEU B 706 28.127 4.527 -3.609 1.00 1.00 H new ATOM 1046 N ILE B 707 28.925 2.671 1.039 1.00 1.00 N ATOM 1047 CA ILE B 707 28.919 2.937 2.474 1.00 1.00 C ATOM 1048 C ILE B 707 30.077 3.848 2.865 1.00 1.00 C ATOM 1049 O ILE B 707 29.900 4.787 3.642 1.00 1.00 O ATOM 1050 CB ILE B 707 29.010 1.624 3.254 1.00 1.00 C ATOM 1051 CG1 ILE B 707 27.716 0.830 3.065 1.00 1.00 C ATOM 1052 CG2 ILE B 707 29.212 1.925 4.741 1.00 1.00 C ATOM 1053 CD1 ILE B 707 27.908 -0.594 3.593 1.00 1.00 C ATOM 0 H ILE B 707 29.070 1.694 0.786 1.00 1.00 H new ATOM 0 HA ILE B 707 27.984 3.440 2.720 1.00 1.00 H new ATOM 0 HB ILE B 707 29.853 1.040 2.885 1.00 1.00 H new ATOM 0 HG12 ILE B 707 26.897 1.318 3.594 1.00 1.00 H new ATOM 0 HG13 ILE B 707 27.444 0.804 2.010 1.00 1.00 H new ATOM 0 HG21 ILE B 707 29.277 0.989 5.296 1.00 1.00 H new ATOM 0 HG22 ILE B 707 30.134 2.491 4.876 1.00 1.00 H new ATOM 0 HG23 ILE B 707 28.370 2.509 5.112 1.00 1.00 H new ATOM 0 HD11 ILE B 707 26.986 -1.159 3.458 1.00 1.00 H new ATOM 0 HD12 ILE B 707 28.715 -1.080 3.044 1.00 1.00 H new ATOM 0 HD13 ILE B 707 28.160 -0.558 4.653 1.00 1.00 H new ATOM 1065 N GLY B 708 31.260 3.578 2.324 1.00 1.00 N ATOM 1066 CA GLY B 708 32.423 4.397 2.638 1.00 1.00 C ATOM 1067 C GLY B 708 32.206 5.833 2.173 1.00 1.00 C ATOM 1068 O GLY B 708 32.529 6.784 2.884 1.00 1.00 O ATOM 0 H GLY B 708 31.437 2.811 1.676 1.00 1.00 H new ATOM 0 HA2 GLY B 708 32.608 4.380 3.712 1.00 1.00 H new ATOM 0 HA3 GLY B 708 33.308 3.982 2.156 1.00 1.00 H new ATOM 1072 N LEU B 709 31.644 5.978 0.980 1.00 1.00 N ATOM 1073 CA LEU B 709 31.372 7.299 0.428 1.00 1.00 C ATOM 1074 C LEU B 709 30.362 8.040 1.304 1.00 1.00 C ATOM 1075 O LEU B 709 30.513 9.230 1.573 1.00 1.00 O ATOM 1076 CB LEU B 709 30.824 7.157 -0.999 1.00 1.00 C ATOM 1077 CG LEU B 709 30.512 8.537 -1.597 1.00 1.00 C ATOM 1078 CD1 LEU B 709 31.767 9.411 -1.588 1.00 1.00 C ATOM 1079 CD2 LEU B 709 30.031 8.365 -3.040 1.00 1.00 C ATOM 0 H LEU B 709 31.369 5.202 0.378 1.00 1.00 H new ATOM 0 HA LEU B 709 32.299 7.872 0.403 1.00 1.00 H new ATOM 0 HB2 LEU B 709 31.552 6.640 -1.624 1.00 1.00 H new ATOM 0 HB3 LEU B 709 29.921 6.546 -0.989 1.00 1.00 H new ATOM 0 HG LEU B 709 29.737 9.017 -0.999 1.00 1.00 H new ATOM 0 HD11 LEU B 709 31.534 10.387 -2.014 1.00 1.00 H new ATOM 0 HD12 LEU B 709 32.116 9.537 -0.563 1.00 1.00 H new ATOM 0 HD13 LEU B 709 32.547 8.933 -2.181 1.00 1.00 H new ATOM 0 HD21 LEU B 709 29.808 9.342 -3.468 1.00 1.00 H new ATOM 0 HD22 LEU B 709 30.810 7.880 -3.628 1.00 1.00 H new ATOM 0 HD23 LEU B 709 29.131 7.750 -3.053 1.00 1.00 H new ATOM 1091 N ALA B 710 29.333 7.322 1.741 1.00 1.00 N ATOM 1092 CA ALA B 710 28.299 7.917 2.580 1.00 1.00 C ATOM 1093 C ALA B 710 28.896 8.421 3.890 1.00 1.00 C ATOM 1094 O ALA B 710 28.489 9.461 4.409 1.00 1.00 O ATOM 1095 CB ALA B 710 27.213 6.883 2.878 1.00 1.00 C ATOM 0 H ALA B 710 29.193 6.334 1.530 1.00 1.00 H new ATOM 0 HA ALA B 710 27.863 8.760 2.045 1.00 1.00 H new ATOM 0 HB1 ALA B 710 26.444 7.334 3.505 1.00 1.00 H new ATOM 0 HB2 ALA B 710 26.767 6.544 1.943 1.00 1.00 H new ATOM 0 HB3 ALA B 710 27.653 6.033 3.399 1.00 1.00 H new ATOM 1101 N ALA B 711 29.864 7.682 4.416 1.00 1.00 N ATOM 1102 CA ALA B 711 30.510 8.070 5.661 1.00 1.00 C ATOM 1103 C ALA B 711 31.219 9.409 5.494 1.00 1.00 C ATOM 1104 O ALA B 711 31.236 10.232 6.410 1.00 1.00 O ATOM 1105 CB ALA B 711 31.521 7.002 6.082 1.00 1.00 C ATOM 0 H ALA B 711 30.216 6.818 4.004 1.00 1.00 H new ATOM 0 HA ALA B 711 29.747 8.167 6.433 1.00 1.00 H new ATOM 0 HB1 ALA B 711 31.999 7.301 7.015 1.00 1.00 H new ATOM 0 HB2 ALA B 711 31.007 6.052 6.226 1.00 1.00 H new ATOM 0 HB3 ALA B 711 32.278 6.891 5.305 1.00 1.00 H new ATOM 1111 N LEU B 712 31.808 9.621 4.321 1.00 1.00 N ATOM 1112 CA LEU B 712 32.518 10.868 4.052 1.00 1.00 C ATOM 1113 C LEU B 712 31.567 12.061 4.120 1.00 1.00 C ATOM 1114 O LEU B 712 31.897 13.090 4.712 1.00 1.00 O ATOM 1115 CB LEU B 712 33.170 10.794 2.662 1.00 1.00 C ATOM 1116 CG LEU B 712 33.881 12.113 2.330 1.00 1.00 C ATOM 1117 CD1 LEU B 712 34.910 12.440 3.411 1.00 1.00 C ATOM 1118 CD2 LEU B 712 34.594 11.983 0.982 1.00 1.00 C ATOM 0 H LEU B 712 31.809 8.954 3.549 1.00 1.00 H new ATOM 0 HA LEU B 712 33.288 11.004 4.811 1.00 1.00 H new ATOM 0 HB2 LEU B 712 33.885 9.972 2.633 1.00 1.00 H new ATOM 0 HB3 LEU B 712 32.411 10.584 1.909 1.00 1.00 H new ATOM 0 HG LEU B 712 33.141 12.912 2.283 1.00 1.00 H new ATOM 0 HD11 LEU B 712 35.409 13.378 3.166 1.00 1.00 H new ATOM 0 HD12 LEU B 712 34.408 12.536 4.374 1.00 1.00 H new ATOM 0 HD13 LEU B 712 35.648 11.640 3.465 1.00 1.00 H new ATOM 0 HD21 LEU B 712 35.099 12.920 0.746 1.00 1.00 H new ATOM 0 HD22 LEU B 712 35.327 11.178 1.034 1.00 1.00 H new ATOM 0 HD23 LEU B 712 33.864 11.758 0.204 1.00 1.00 H new ATOM 1130 N LEU B 713 30.388 11.921 3.523 1.00 1.00 N ATOM 1131 CA LEU B 713 29.406 13.004 3.542 1.00 1.00 C ATOM 1132 C LEU B 713 28.953 13.308 4.964 1.00 1.00 C ATOM 1133 O LEU B 713 28.801 14.467 5.340 1.00 1.00 O ATOM 1134 CB LEU B 713 28.185 12.652 2.683 1.00 1.00 C ATOM 1135 CG LEU B 713 28.450 12.979 1.206 1.00 1.00 C ATOM 1136 CD1 LEU B 713 29.576 12.100 0.664 1.00 1.00 C ATOM 1137 CD2 LEU B 713 27.176 12.724 0.399 1.00 1.00 C ATOM 0 H LEU B 713 30.090 11.082 3.026 1.00 1.00 H new ATOM 0 HA LEU B 713 29.890 13.889 3.128 1.00 1.00 H new ATOM 0 HB2 LEU B 713 27.952 11.593 2.790 1.00 1.00 H new ATOM 0 HB3 LEU B 713 27.315 13.207 3.033 1.00 1.00 H new ATOM 0 HG LEU B 713 28.744 14.025 1.119 1.00 1.00 H new ATOM 0 HD11 LEU B 713 29.754 12.342 -0.384 1.00 1.00 H new ATOM 0 HD12 LEU B 713 30.486 12.279 1.237 1.00 1.00 H new ATOM 0 HD13 LEU B 713 29.293 11.051 0.751 1.00 1.00 H new ATOM 0 HD21 LEU B 713 27.358 12.954 -0.651 1.00 1.00 H new ATOM 0 HD22 LEU B 713 26.887 11.677 0.496 1.00 1.00 H new ATOM 0 HD23 LEU B 713 26.374 13.358 0.776 1.00 1.00 H new ATOM 1149 N ILE B 714 28.731 12.262 5.751 1.00 1.00 N ATOM 1150 CA ILE B 714 28.280 12.438 7.128 1.00 1.00 C ATOM 1151 C ILE B 714 29.328 13.180 7.951 1.00 1.00 C ATOM 1152 O ILE B 714 29.000 14.077 8.724 1.00 1.00 O ATOM 1153 CB ILE B 714 28.008 11.072 7.770 1.00 1.00 C ATOM 1154 CG1 ILE B 714 26.795 10.399 7.100 1.00 1.00 C ATOM 1155 CG2 ILE B 714 27.757 11.239 9.271 1.00 1.00 C ATOM 1156 CD1 ILE B 714 25.520 11.244 7.263 1.00 1.00 C ATOM 0 H ILE B 714 28.854 11.291 5.464 1.00 1.00 H new ATOM 0 HA ILE B 714 27.362 13.026 7.111 1.00 1.00 H new ATOM 0 HB ILE B 714 28.882 10.436 7.627 1.00 1.00 H new ATOM 0 HG12 ILE B 714 27.000 10.249 6.040 1.00 1.00 H new ATOM 0 HG13 ILE B 714 26.637 9.413 7.537 1.00 1.00 H new ATOM 0 HG21 ILE B 714 27.565 10.264 9.718 1.00 1.00 H new ATOM 0 HG22 ILE B 714 28.634 11.686 9.739 1.00 1.00 H new ATOM 0 HG23 ILE B 714 26.893 11.886 9.426 1.00 1.00 H new ATOM 0 HD11 ILE B 714 24.684 10.739 6.778 1.00 1.00 H new ATOM 0 HD12 ILE B 714 25.301 11.372 8.323 1.00 1.00 H new ATOM 0 HD13 ILE B 714 25.670 12.221 6.803 1.00 1.00 H new ATOM 1168 N TRP B 715 30.586 12.799 7.785 1.00 1.00 N ATOM 1169 CA TRP B 715 31.669 13.432 8.530 1.00 1.00 C ATOM 1170 C TRP B 715 31.702 14.935 8.217 1.00 1.00 C ATOM 1171 O TRP B 715 31.834 15.770 9.112 1.00 1.00 O ATOM 1172 CB TRP B 715 32.994 12.768 8.139 1.00 1.00 C ATOM 1173 CG TRP B 715 33.968 12.803 9.282 1.00 1.00 C ATOM 1174 CD1 TRP B 715 34.049 13.770 10.227 1.00 1.00 C ATOM 1175 CD2 TRP B 715 34.992 11.821 9.619 1.00 1.00 C ATOM 1176 NE1 TRP B 715 35.061 13.449 11.112 1.00 1.00 N ATOM 1177 CE2 TRP B 715 35.672 12.257 10.780 1.00 1.00 C ATOM 1178 CE3 TRP B 715 35.396 10.608 9.031 1.00 1.00 C ATOM 1179 CZ2 TRP B 715 36.715 11.517 11.339 1.00 1.00 C ATOM 1180 CZ3 TRP B 715 36.444 9.860 9.592 1.00 1.00 C ATOM 1181 CH2 TRP B 715 37.102 10.314 10.744 1.00 1.00 C ATOM 0 H TRP B 715 30.883 12.061 7.147 1.00 1.00 H new ATOM 0 HA TRP B 715 31.510 13.309 9.601 1.00 1.00 H new ATOM 0 HB2 TRP B 715 32.814 11.735 7.841 1.00 1.00 H new ATOM 0 HB3 TRP B 715 33.421 13.279 7.276 1.00 1.00 H new ATOM 0 HD1 TRP B 715 33.424 14.649 10.280 1.00 1.00 H new ATOM 0 HE1 TRP B 715 35.324 14.023 11.913 1.00 1.00 H new ATOM 0 HE3 TRP B 715 34.897 10.250 8.143 1.00 1.00 H new ATOM 0 HZ2 TRP B 715 37.219 11.872 12.226 1.00 1.00 H new ATOM 0 HZ3 TRP B 715 36.745 8.930 9.133 1.00 1.00 H new ATOM 0 HH2 TRP B 715 37.907 9.734 11.171 1.00 1.00 H new ATOM 1192 N LYS B 716 31.561 15.272 6.940 1.00 1.00 N ATOM 1193 CA LYS B 716 31.564 16.674 6.519 1.00 1.00 C ATOM 1194 C LYS B 716 30.389 17.416 7.153 1.00 1.00 C ATOM 1195 O LYS B 716 30.519 18.562 7.587 1.00 1.00 O ATOM 1196 CB LYS B 716 31.447 16.747 4.981 1.00 1.00 C ATOM 1197 CG LYS B 716 32.772 17.203 4.331 1.00 1.00 C ATOM 1198 CD LYS B 716 32.810 18.732 4.160 1.00 1.00 C ATOM 1199 CE LYS B 716 33.035 19.419 5.506 1.00 1.00 C ATOM 1200 NZ LYS B 716 33.310 20.866 5.280 1.00 1.00 N ATOM 0 H LYS B 716 31.444 14.601 6.181 1.00 1.00 H new ATOM 0 HA LYS B 716 32.495 17.141 6.841 1.00 1.00 H new ATOM 0 HB2 LYS B 716 31.167 15.769 4.590 1.00 1.00 H new ATOM 0 HB3 LYS B 716 30.650 17.439 4.709 1.00 1.00 H new ATOM 0 HG2 LYS B 716 33.612 16.882 4.947 1.00 1.00 H new ATOM 0 HG3 LYS B 716 32.888 16.723 3.359 1.00 1.00 H new ATOM 0 HD2 LYS B 716 33.606 19.006 3.468 1.00 1.00 H new ATOM 0 HD3 LYS B 716 31.874 19.078 3.721 1.00 1.00 H new ATOM 0 HE2 LYS B 716 32.157 19.299 6.140 1.00 1.00 H new ATOM 0 HE3 LYS B 716 33.872 18.955 6.029 1.00 1.00 H new ATOM 0 HZ1 LYS B 716 33.464 21.337 6.194 1.00 1.00 H new ATOM 0 HZ2 LYS B 716 34.160 20.970 4.690 1.00 1.00 H new ATOM 0 HZ3 LYS B 716 32.498 21.302 4.798 1.00 1.00 H new ATOM 1214 N LEU B 717 29.236 16.759 7.186 1.00 1.00 N ATOM 1215 CA LEU B 717 28.039 17.368 7.759 1.00 1.00 C ATOM 1216 C LEU B 717 28.220 17.641 9.251 1.00 1.00 C ATOM 1217 O LEU B 717 27.773 18.666 9.757 1.00 1.00 O ATOM 1218 CB LEU B 717 26.817 16.465 7.537 1.00 1.00 C ATOM 1219 CG LEU B 717 26.433 16.455 6.048 1.00 1.00 C ATOM 1220 CD1 LEU B 717 25.395 15.360 5.797 1.00 1.00 C ATOM 1221 CD2 LEU B 717 25.848 17.818 5.633 1.00 1.00 C ATOM 0 H LEU B 717 29.103 15.814 6.827 1.00 1.00 H new ATOM 0 HA LEU B 717 27.875 18.319 7.253 1.00 1.00 H new ATOM 0 HB2 LEU B 717 27.038 15.451 7.871 1.00 1.00 H new ATOM 0 HB3 LEU B 717 25.978 16.821 8.135 1.00 1.00 H new ATOM 0 HG LEU B 717 27.328 16.261 5.456 1.00 1.00 H new ATOM 0 HD11 LEU B 717 25.122 15.352 4.742 1.00 1.00 H new ATOM 0 HD12 LEU B 717 25.814 14.392 6.071 1.00 1.00 H new ATOM 0 HD13 LEU B 717 24.508 15.555 6.400 1.00 1.00 H new ATOM 0 HD21 LEU B 717 25.582 17.793 4.576 1.00 1.00 H new ATOM 0 HD22 LEU B 717 24.958 18.028 6.227 1.00 1.00 H new ATOM 0 HD23 LEU B 717 26.589 18.599 5.802 1.00 1.00 H new ATOM 1233 N LEU B 718 28.860 16.716 9.961 1.00 1.00 N ATOM 1234 CA LEU B 718 29.044 16.893 11.397 1.00 1.00 C ATOM 1235 C LEU B 718 29.877 18.145 11.702 1.00 1.00 C ATOM 1236 O LEU B 718 29.534 18.916 12.596 1.00 1.00 O ATOM 1237 CB LEU B 718 29.741 15.668 11.987 1.00 1.00 C ATOM 1238 CG LEU B 718 28.787 14.469 11.963 1.00 1.00 C ATOM 1239 CD1 LEU B 718 29.554 13.199 12.329 1.00 1.00 C ATOM 1240 CD2 LEU B 718 27.640 14.674 12.964 1.00 1.00 C ATOM 0 H LEU B 718 29.251 15.856 9.577 1.00 1.00 H new ATOM 0 HA LEU B 718 28.059 17.014 11.848 1.00 1.00 H new ATOM 0 HB2 LEU B 718 30.641 15.440 11.416 1.00 1.00 H new ATOM 0 HB3 LEU B 718 30.056 15.874 13.010 1.00 1.00 H new ATOM 0 HG LEU B 718 28.369 14.375 10.961 1.00 1.00 H new ATOM 0 HD11 LEU B 718 28.875 12.346 12.312 1.00 1.00 H new ATOM 0 HD12 LEU B 718 30.357 13.038 11.609 1.00 1.00 H new ATOM 0 HD13 LEU B 718 29.978 13.305 13.327 1.00 1.00 H new ATOM 0 HD21 LEU B 718 26.972 13.813 12.934 1.00 1.00 H new ATOM 0 HD22 LEU B 718 28.049 14.781 13.969 1.00 1.00 H new ATOM 0 HD23 LEU B 718 27.084 15.574 12.701 1.00 1.00 H new ATOM 1252 N ILE B 719 30.941 18.366 10.940 1.00 1.00 N ATOM 1253 CA ILE B 719 31.770 19.554 11.152 1.00 1.00 C ATOM 1254 C ILE B 719 30.960 20.806 10.870 1.00 1.00 C ATOM 1255 O ILE B 719 31.032 21.773 11.608 1.00 1.00 O ATOM 1256 CB ILE B 719 33.028 19.527 10.280 1.00 1.00 C ATOM 1257 CG1 ILE B 719 33.951 18.404 10.774 1.00 1.00 C ATOM 1258 CG2 ILE B 719 33.738 20.875 10.396 1.00 1.00 C ATOM 1259 CD1 ILE B 719 35.118 18.221 9.798 1.00 1.00 C ATOM 0 H ILE B 719 31.249 17.755 10.184 1.00 1.00 H new ATOM 0 HA ILE B 719 32.092 19.559 12.193 1.00 1.00 H new ATOM 0 HB ILE B 719 32.765 19.346 9.238 1.00 1.00 H new ATOM 0 HG12 ILE B 719 34.330 18.644 11.767 1.00 1.00 H new ATOM 0 HG13 ILE B 719 33.391 17.473 10.863 1.00 1.00 H new ATOM 0 HG21 ILE B 719 34.636 20.867 9.779 1.00 1.00 H new ATOM 0 HG22 ILE B 719 33.071 21.668 10.057 1.00 1.00 H new ATOM 0 HG23 ILE B 719 34.014 21.053 11.435 1.00 1.00 H new ATOM 0 HD11 ILE B 719 35.769 17.423 10.155 1.00 1.00 H new ATOM 0 HD12 ILE B 719 34.731 17.961 8.813 1.00 1.00 H new ATOM 0 HD13 ILE B 719 35.685 19.149 9.731 1.00 1.00 H new ATOM 1271 N THR B 720 30.204 20.786 9.789 1.00 1.00 N ATOM 1272 CA THR B 720 29.393 21.942 9.414 1.00 1.00 C ATOM 1273 C THR B 720 28.360 22.264 10.488 1.00 1.00 C ATOM 1274 O THR B 720 28.188 23.433 10.879 1.00 1.00 O ATOM 1275 CB THR B 720 28.680 21.655 8.093 1.00 1.00 C ATOM 1276 OG1 THR B 720 29.616 21.130 7.155 1.00 1.00 O ATOM 1277 CG2 THR B 720 28.082 22.950 7.546 1.00 1.00 C ATOM 0 H THR B 720 30.130 19.990 9.155 1.00 1.00 H new ATOM 0 HA THR B 720 30.053 22.803 9.306 1.00 1.00 H new ATOM 0 HB THR B 720 27.884 20.929 8.258 1.00 1.00 H new ATOM 0 HG1 THR B 720 29.741 20.172 7.319 1.00 1.00 H new ATOM 0 HG21 THR B 720 27.573 22.746 6.604 1.00 1.00 H new ATOM 0 HG22 THR B 720 27.368 23.353 8.264 1.00 1.00 H new ATOM 0 HG23 THR B 720 28.878 23.676 7.379 1.00 1.00 H new ATOM 1285 N ILE B 721 27.687 21.227 10.988 1.00 1.00 N ATOM 1286 CA ILE B 721 26.668 21.463 12.018 1.00 1.00 C ATOM 1287 C ILE B 721 27.299 22.086 13.277 1.00 1.00 C ATOM 1288 O ILE B 721 26.777 23.063 13.840 1.00 1.00 O ATOM 1289 CB ILE B 721 25.969 20.146 12.391 1.00 1.00 C ATOM 1290 CG1 ILE B 721 25.139 19.672 11.192 1.00 1.00 C ATOM 1291 CG2 ILE B 721 25.046 20.391 13.592 1.00 1.00 C ATOM 1292 CD1 ILE B 721 24.667 18.242 11.432 1.00 1.00 C ATOM 0 H ILE B 721 27.818 20.253 10.713 1.00 1.00 H new ATOM 0 HA ILE B 721 25.933 22.158 11.612 1.00 1.00 H new ATOM 0 HB ILE B 721 26.707 19.387 12.651 1.00 1.00 H new ATOM 0 HG12 ILE B 721 24.282 20.329 11.047 1.00 1.00 H new ATOM 0 HG13 ILE B 721 25.736 19.721 10.281 1.00 1.00 H new ATOM 0 HG21 ILE B 721 24.546 19.461 13.863 1.00 1.00 H new ATOM 0 HG22 ILE B 721 25.635 20.746 14.438 1.00 1.00 H new ATOM 0 HG23 ILE B 721 24.300 21.141 13.330 1.00 1.00 H new ATOM 0 HD11 ILE B 721 24.077 17.906 10.579 1.00 1.00 H new ATOM 0 HD12 ILE B 721 25.531 17.589 11.555 1.00 1.00 H new ATOM 0 HD13 ILE B 721 24.055 18.207 12.333 1.00 1.00 H new ATOM 1304 N HIS B 722 28.437 21.540 13.706 1.00 1.00 N ATOM 1305 CA HIS B 722 29.118 22.068 14.896 1.00 1.00 C ATOM 1306 C HIS B 722 29.639 23.488 14.642 1.00 1.00 C ATOM 1307 O HIS B 722 29.578 24.348 15.519 1.00 1.00 O ATOM 1308 CB HIS B 722 30.274 21.157 15.311 1.00 1.00 C ATOM 1309 CG HIS B 722 29.706 19.926 15.975 1.00 1.00 C ATOM 1310 ND1 HIS B 722 29.208 18.853 15.250 1.00 1.00 N ATOM 1311 CD2 HIS B 722 29.549 19.581 17.299 1.00 1.00 C ATOM 1312 CE1 HIS B 722 28.786 17.926 16.124 1.00 1.00 C ATOM 1313 NE2 HIS B 722 28.969 18.317 17.387 1.00 1.00 N ATOM 0 H HIS B 722 28.902 20.749 13.261 1.00 1.00 H new ATOM 0 HA HIS B 722 28.390 22.102 15.707 1.00 1.00 H new ATOM 0 HB2 HIS B 722 30.866 20.877 14.440 1.00 1.00 H new ATOM 0 HB3 HIS B 722 30.941 21.681 15.995 1.00 1.00 H new ATOM 0 HD1 HIS B 722 29.169 18.781 14.233 1.00 1.00 H new ATOM 0 HD2 HIS B 722 29.832 20.196 18.140 1.00 1.00 H new ATOM 0 HE1 HIS B 722 28.351 16.979 15.840 1.00 1.00 H new ATOM 1321 N ASP B 723 30.162 23.722 13.443 1.00 1.00 N ATOM 1322 CA ASP B 723 30.702 25.032 13.099 1.00 1.00 C ATOM 1323 C ASP B 723 29.602 26.085 13.091 1.00 1.00 C ATOM 1324 O ASP B 723 29.825 27.234 13.482 1.00 1.00 O ATOM 1325 CB ASP B 723 31.362 24.968 11.724 1.00 1.00 C ATOM 1326 CG ASP B 723 32.801 24.467 11.841 1.00 1.00 C ATOM 1327 OD1 ASP B 723 33.254 24.248 12.954 1.00 1.00 O ATOM 1328 OD2 ASP B 723 33.414 24.273 10.807 1.00 1.00 O ATOM 0 H ASP B 723 30.223 23.028 12.698 1.00 1.00 H new ATOM 0 HA ASP B 723 31.442 25.311 13.850 1.00 1.00 H new ATOM 0 HB2 ASP B 723 30.793 24.306 11.072 1.00 1.00 H new ATOM 0 HB3 ASP B 723 31.351 25.956 11.263 1.00 1.00 H new