USER MOD reduce.3.24.130724 H: found=0, std=0, add=557, rem=0, adj=7 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 Set 1.1: B 716 LYS NZ :NH3+ -140:sc= 0.0724 (180deg=0) USER MOD Set 1.2: B 720 THR OG1 : rot 97:sc= 1.12 USER MOD Single : A 981 THR OG1 : rot 90:sc= 1.24 USER MOD Single : A 987 MET CE :methyl -139:sc= -0.0835 (180deg=-1.76) 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 74:sc= 1.13 USER MOD Single : B 701 MET CE :methyl 156:sc= -0.112 (180deg=-0.813) USER MOD Single : B 722 HIS : no HE2:sc= 1.2 K(o=1.2,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 136 N ILE A 966 31.968 -19.556 -0.913 1.00 1.00 N ATOM 137 CA ILE A 966 31.765 -18.266 -0.260 1.00 1.00 C ATOM 138 C ILE A 966 33.079 -17.493 -0.162 1.00 1.00 C ATOM 139 O ILE A 966 33.092 -16.307 0.169 1.00 1.00 O ATOM 140 CB ILE A 966 31.185 -18.473 1.141 1.00 1.00 C ATOM 141 CG1 ILE A 966 30.768 -17.120 1.732 1.00 1.00 C ATOM 142 CG2 ILE A 966 32.246 -19.108 2.039 1.00 1.00 C ATOM 143 CD1 ILE A 966 29.917 -17.349 2.981 1.00 1.00 C ATOM 0 HA ILE A 966 31.064 -17.687 -0.861 1.00 1.00 H new ATOM 0 HB ILE A 966 30.315 -19.126 1.079 1.00 1.00 H new ATOM 0 HG12 ILE A 966 31.652 -16.533 1.984 1.00 1.00 H new ATOM 0 HG13 ILE A 966 30.205 -16.548 0.995 1.00 1.00 H new ATOM 0 HG21 ILE A 966 31.836 -19.257 3.038 1.00 1.00 H new ATOM 0 HG22 ILE A 966 32.546 -20.070 1.623 1.00 1.00 H new ATOM 0 HG23 ILE A 966 33.114 -18.451 2.097 1.00 1.00 H new ATOM 0 HD11 ILE A 966 29.621 -16.388 3.401 1.00 1.00 H new ATOM 0 HD12 ILE A 966 29.027 -17.919 2.715 1.00 1.00 H new ATOM 0 HD13 ILE A 966 30.496 -17.904 3.719 1.00 1.00 H new ATOM 155 N TRP A 967 34.185 -18.177 -0.428 1.00 1.00 N ATOM 156 CA TRP A 967 35.502 -17.552 -0.346 1.00 1.00 C ATOM 157 C TRP A 967 35.603 -16.331 -1.262 1.00 1.00 C ATOM 158 O TRP A 967 36.256 -15.345 -0.915 1.00 1.00 O ATOM 159 CB TRP A 967 36.591 -18.562 -0.721 1.00 1.00 C ATOM 160 CG TRP A 967 36.721 -19.585 0.360 1.00 1.00 C ATOM 161 CD1 TRP A 967 36.281 -20.860 0.281 1.00 1.00 C ATOM 162 CD2 TRP A 967 37.326 -19.441 1.678 1.00 1.00 C ATOM 163 NE1 TRP A 967 36.576 -21.509 1.467 1.00 1.00 N ATOM 164 CE2 TRP A 967 37.220 -20.678 2.358 1.00 1.00 C ATOM 165 CE3 TRP A 967 37.950 -18.371 2.345 1.00 1.00 C ATOM 166 CZ2 TRP A 967 37.716 -20.847 3.651 1.00 1.00 C ATOM 167 CZ3 TRP A 967 38.448 -18.536 3.646 1.00 1.00 C ATOM 168 CH2 TRP A 967 38.332 -19.773 4.297 1.00 1.00 C ATOM 0 H TRP A 967 34.198 -19.160 -0.701 1.00 1.00 H new ATOM 0 HA TRP A 967 35.645 -17.221 0.683 1.00 1.00 H new ATOM 0 HB2 TRP A 967 36.342 -19.046 -1.665 1.00 1.00 H new ATOM 0 HB3 TRP A 967 37.542 -18.049 -0.866 1.00 1.00 H new ATOM 0 HD1 TRP A 967 35.781 -21.301 -0.569 1.00 1.00 H new ATOM 0 HE1 TRP A 967 36.345 -22.484 1.658 1.00 1.00 H new ATOM 0 HE3 TRP A 967 38.046 -17.415 1.852 1.00 1.00 H new ATOM 0 HZ2 TRP A 967 37.624 -21.801 4.149 1.00 1.00 H new ATOM 0 HZ3 TRP A 967 38.923 -17.707 4.149 1.00 1.00 H new ATOM 0 HH2 TRP A 967 38.719 -19.895 5.298 1.00 1.00 H new ATOM 179 N TRP A 968 34.969 -16.397 -2.430 1.00 1.00 N ATOM 180 CA TRP A 968 35.021 -15.282 -3.373 1.00 1.00 C ATOM 181 C TRP A 968 34.510 -14.003 -2.713 1.00 1.00 C ATOM 182 O TRP A 968 35.074 -12.927 -2.903 1.00 1.00 O ATOM 183 CB TRP A 968 34.170 -15.603 -4.603 1.00 1.00 C ATOM 184 CG TRP A 968 34.824 -16.692 -5.389 1.00 1.00 C ATOM 185 CD1 TRP A 968 34.423 -17.985 -5.413 1.00 1.00 C ATOM 186 CD2 TRP A 968 35.981 -16.606 -6.270 1.00 1.00 C ATOM 187 NE1 TRP A 968 35.264 -18.698 -6.248 1.00 1.00 N ATOM 188 CE2 TRP A 968 36.239 -17.892 -6.802 1.00 1.00 C ATOM 189 CE3 TRP A 968 36.823 -15.548 -6.654 1.00 1.00 C ATOM 190 CZ2 TRP A 968 37.296 -18.118 -7.685 1.00 1.00 C ATOM 191 CZ3 TRP A 968 37.887 -15.771 -7.542 1.00 1.00 C ATOM 192 CH2 TRP A 968 38.124 -17.054 -8.057 1.00 1.00 C ATOM 0 H TRP A 968 34.421 -17.198 -2.744 1.00 1.00 H new ATOM 0 HA TRP A 968 36.056 -15.131 -3.679 1.00 1.00 H new ATOM 0 HB2 TRP A 968 33.170 -15.911 -4.297 1.00 1.00 H new ATOM 0 HB3 TRP A 968 34.054 -14.713 -5.221 1.00 1.00 H new ATOM 0 HD1 TRP A 968 33.584 -18.393 -4.869 1.00 1.00 H new ATOM 0 HE1 TRP A 968 35.175 -19.697 -6.432 1.00 1.00 H new ATOM 0 HE3 TRP A 968 36.650 -14.556 -6.263 1.00 1.00 H new ATOM 0 HZ2 TRP A 968 37.473 -19.108 -8.078 1.00 1.00 H new ATOM 0 HZ3 TRP A 968 38.527 -14.950 -7.830 1.00 1.00 H new ATOM 0 HH2 TRP A 968 38.944 -17.220 -8.740 1.00 1.00 H new ATOM 203 N VAL A 969 33.453 -14.131 -1.923 1.00 1.00 N ATOM 204 CA VAL A 969 32.890 -12.985 -1.219 1.00 1.00 C ATOM 205 C VAL A 969 33.858 -12.448 -0.165 1.00 1.00 C ATOM 206 O VAL A 969 33.999 -11.238 0.003 1.00 1.00 O ATOM 207 CB VAL A 969 31.562 -13.355 -0.555 1.00 1.00 C ATOM 208 CG1 VAL A 969 31.150 -12.228 0.397 1.00 1.00 C ATOM 209 CG2 VAL A 969 30.483 -13.518 -1.629 1.00 1.00 C ATOM 0 H VAL A 969 32.969 -15.013 -1.753 1.00 1.00 H new ATOM 0 HA VAL A 969 32.715 -12.204 -1.959 1.00 1.00 H new ATOM 0 HB VAL A 969 31.675 -14.289 -0.004 1.00 1.00 H new ATOM 0 HG11 VAL A 969 30.204 -12.483 0.875 1.00 1.00 H new ATOM 0 HG12 VAL A 969 31.918 -12.097 1.159 1.00 1.00 H new ATOM 0 HG13 VAL A 969 31.034 -11.301 -0.165 1.00 1.00 H new ATOM 0 HG21 VAL A 969 29.537 -13.782 -1.157 1.00 1.00 H new ATOM 0 HG22 VAL A 969 30.368 -12.581 -2.174 1.00 1.00 H new ATOM 0 HG23 VAL A 969 30.775 -14.307 -2.322 1.00 1.00 H new ATOM 219 N LEU A 970 34.489 -13.355 0.575 1.00 1.00 N ATOM 220 CA LEU A 970 35.401 -12.959 1.646 1.00 1.00 C ATOM 221 C LEU A 970 36.584 -12.152 1.115 1.00 1.00 C ATOM 222 O LEU A 970 36.964 -11.148 1.718 1.00 1.00 O ATOM 223 CB LEU A 970 35.923 -14.203 2.367 1.00 1.00 C ATOM 224 CG LEU A 970 34.781 -14.860 3.154 1.00 1.00 C ATOM 225 CD1 LEU A 970 35.242 -16.218 3.679 1.00 1.00 C ATOM 226 CD2 LEU A 970 34.361 -13.967 4.335 1.00 1.00 C ATOM 0 H LEU A 970 34.388 -14.363 0.455 1.00 1.00 H new ATOM 0 HA LEU A 970 34.843 -12.328 2.338 1.00 1.00 H new ATOM 0 HB2 LEU A 970 36.333 -14.909 1.645 1.00 1.00 H new ATOM 0 HB3 LEU A 970 36.734 -13.931 3.043 1.00 1.00 H new ATOM 0 HG LEU A 970 33.925 -14.992 2.492 1.00 1.00 H new ATOM 0 HD11 LEU A 970 34.432 -16.686 4.238 1.00 1.00 H new ATOM 0 HD12 LEU A 970 35.520 -16.857 2.841 1.00 1.00 H new ATOM 0 HD13 LEU A 970 36.103 -16.082 4.333 1.00 1.00 H new ATOM 0 HD21 LEU A 970 33.550 -14.447 4.883 1.00 1.00 H new ATOM 0 HD22 LEU A 970 35.212 -13.820 5.000 1.00 1.00 H new ATOM 0 HD23 LEU A 970 34.023 -13.001 3.959 1.00 1.00 H new ATOM 238 N VAL A 971 37.163 -12.569 -0.008 1.00 1.00 N ATOM 239 CA VAL A 971 38.291 -11.824 -0.564 1.00 1.00 C ATOM 240 C VAL A 971 37.844 -10.427 -0.982 1.00 1.00 C ATOM 241 O VAL A 971 38.547 -9.444 -0.745 1.00 1.00 O ATOM 242 CB VAL A 971 38.915 -12.564 -1.755 1.00 1.00 C ATOM 243 CG1 VAL A 971 39.625 -13.824 -1.258 1.00 1.00 C ATOM 244 CG2 VAL A 971 37.830 -12.974 -2.749 1.00 1.00 C ATOM 0 H VAL A 971 36.882 -13.394 -0.538 1.00 1.00 H new ATOM 0 HA VAL A 971 39.053 -11.736 0.211 1.00 1.00 H new ATOM 0 HB VAL A 971 39.626 -11.899 -2.246 1.00 1.00 H new ATOM 0 HG11 VAL A 971 40.068 -14.350 -2.104 1.00 1.00 H new ATOM 0 HG12 VAL A 971 40.408 -13.546 -0.553 1.00 1.00 H new ATOM 0 HG13 VAL A 971 38.905 -14.476 -0.763 1.00 1.00 H new ATOM 0 HG21 VAL A 971 38.286 -13.498 -3.589 1.00 1.00 H new ATOM 0 HG22 VAL A 971 37.115 -13.632 -2.256 1.00 1.00 H new ATOM 0 HG23 VAL A 971 37.315 -12.085 -3.112 1.00 1.00 H new ATOM 254 N GLY A 972 36.662 -10.342 -1.588 1.00 1.00 N ATOM 255 CA GLY A 972 36.122 -9.057 -2.016 1.00 1.00 C ATOM 256 C GLY A 972 35.858 -8.166 -0.807 1.00 1.00 C ATOM 257 O GLY A 972 36.093 -6.960 -0.847 1.00 1.00 O ATOM 0 H GLY A 972 36.064 -11.143 -1.792 1.00 1.00 H new ATOM 0 HA2 GLY A 972 36.823 -8.567 -2.692 1.00 1.00 H new ATOM 0 HA3 GLY A 972 35.197 -9.210 -2.572 1.00 1.00 H new ATOM 261 N VAL A 973 35.374 -8.778 0.271 1.00 1.00 N ATOM 262 CA VAL A 973 35.085 -8.044 1.498 1.00 1.00 C ATOM 263 C VAL A 973 36.364 -7.438 2.064 1.00 1.00 C ATOM 264 O VAL A 973 36.390 -6.274 2.465 1.00 1.00 O ATOM 265 CB VAL A 973 34.460 -8.982 2.533 1.00 1.00 C ATOM 266 CG1 VAL A 973 34.378 -8.270 3.883 1.00 1.00 C ATOM 267 CG2 VAL A 973 33.050 -9.371 2.084 1.00 1.00 C ATOM 0 H VAL A 973 35.175 -9.777 0.319 1.00 1.00 H new ATOM 0 HA VAL A 973 34.383 -7.242 1.268 1.00 1.00 H new ATOM 0 HB VAL A 973 35.075 -9.877 2.627 1.00 1.00 H new ATOM 0 HG11 VAL A 973 33.933 -8.938 4.620 1.00 1.00 H new ATOM 0 HG12 VAL A 973 35.380 -7.988 4.207 1.00 1.00 H new ATOM 0 HG13 VAL A 973 33.763 -7.375 3.786 1.00 1.00 H new ATOM 0 HG21 VAL A 973 32.605 -10.039 2.821 1.00 1.00 H new ATOM 0 HG22 VAL A 973 32.438 -8.474 1.990 1.00 1.00 H new ATOM 0 HG23 VAL A 973 33.102 -9.877 1.120 1.00 1.00 H new ATOM 277 N LEU A 974 37.427 -8.231 2.086 1.00 1.00 N ATOM 278 CA LEU A 974 38.704 -7.759 2.600 1.00 1.00 C ATOM 279 C LEU A 974 39.210 -6.594 1.752 1.00 1.00 C ATOM 280 O LEU A 974 39.696 -5.591 2.279 1.00 1.00 O ATOM 281 CB LEU A 974 39.724 -8.902 2.582 1.00 1.00 C ATOM 282 CG LEU A 974 41.084 -8.416 3.097 1.00 1.00 C ATOM 283 CD1 LEU A 974 40.942 -7.840 4.510 1.00 1.00 C ATOM 284 CD2 LEU A 974 42.057 -9.594 3.131 1.00 1.00 C ATOM 0 H LEU A 974 37.430 -9.196 1.757 1.00 1.00 H new ATOM 0 HA LEU A 974 38.571 -7.416 3.626 1.00 1.00 H new ATOM 0 HB2 LEU A 974 39.367 -9.725 3.201 1.00 1.00 H new ATOM 0 HB3 LEU A 974 39.829 -9.288 1.568 1.00 1.00 H new ATOM 0 HG LEU A 974 41.459 -7.638 2.432 1.00 1.00 H new ATOM 0 HD11 LEU A 974 41.915 -7.499 4.863 1.00 1.00 H new ATOM 0 HD12 LEU A 974 40.247 -7.000 4.492 1.00 1.00 H new ATOM 0 HD13 LEU A 974 40.562 -8.611 5.181 1.00 1.00 H new ATOM 0 HD21 LEU A 974 43.026 -9.255 3.496 1.00 1.00 H new ATOM 0 HD22 LEU A 974 41.669 -10.367 3.794 1.00 1.00 H new ATOM 0 HD23 LEU A 974 42.170 -10.001 2.126 1.00 1.00 H new ATOM 296 N GLY A 975 39.076 -6.726 0.438 1.00 1.00 N ATOM 297 CA GLY A 975 39.507 -5.669 -0.469 1.00 1.00 C ATOM 298 C GLY A 975 38.688 -4.406 -0.234 1.00 1.00 C ATOM 299 O GLY A 975 39.208 -3.293 -0.297 1.00 1.00 O ATOM 0 H GLY A 975 38.677 -7.545 -0.020 1.00 1.00 H new ATOM 0 HA2 GLY A 975 40.565 -5.458 -0.316 1.00 1.00 H new ATOM 0 HA3 GLY A 975 39.393 -5.998 -1.502 1.00 1.00 H new ATOM 303 N GLY A 976 37.402 -4.590 0.046 1.00 1.00 N ATOM 304 CA GLY A 976 36.516 -3.463 0.297 1.00 1.00 C ATOM 305 C GLY A 976 36.947 -2.698 1.547 1.00 1.00 C ATOM 306 O GLY A 976 36.874 -1.472 1.591 1.00 1.00 O ATOM 0 H GLY A 976 36.953 -5.504 0.104 1.00 1.00 H new ATOM 0 HA2 GLY A 976 36.520 -2.794 -0.563 1.00 1.00 H new ATOM 0 HA3 GLY A 976 35.493 -3.820 0.419 1.00 1.00 H new ATOM 310 N LEU A 977 37.408 -3.432 2.555 1.00 1.00 N ATOM 311 CA LEU A 977 37.865 -2.814 3.797 1.00 1.00 C ATOM 312 C LEU A 977 39.066 -1.921 3.509 1.00 1.00 C ATOM 313 O LEU A 977 39.184 -0.818 4.040 1.00 1.00 O ATOM 314 CB LEU A 977 38.255 -3.889 4.815 1.00 1.00 C ATOM 315 CG LEU A 977 37.003 -4.631 5.289 1.00 1.00 C ATOM 316 CD1 LEU A 977 37.414 -5.837 6.134 1.00 1.00 C ATOM 317 CD2 LEU A 977 36.112 -3.702 6.125 1.00 1.00 C ATOM 0 H LEU A 977 37.475 -4.450 2.538 1.00 1.00 H new ATOM 0 HA LEU A 977 37.055 -2.215 4.213 1.00 1.00 H new ATOM 0 HB2 LEU A 977 38.957 -4.591 4.365 1.00 1.00 H new ATOM 0 HB3 LEU A 977 38.762 -3.432 5.665 1.00 1.00 H new ATOM 0 HG LEU A 977 36.442 -4.965 4.416 1.00 1.00 H new ATOM 0 HD11 LEU A 977 36.522 -6.365 6.472 1.00 1.00 H new ATOM 0 HD12 LEU A 977 38.029 -6.509 5.535 1.00 1.00 H new ATOM 0 HD13 LEU A 977 37.984 -5.498 6.999 1.00 1.00 H new ATOM 0 HD21 LEU A 977 35.226 -4.246 6.454 1.00 1.00 H new ATOM 0 HD22 LEU A 977 36.667 -3.352 6.996 1.00 1.00 H new ATOM 0 HD23 LEU A 977 35.809 -2.847 5.520 1.00 1.00 H new ATOM 329 N LEU A 978 39.945 -2.415 2.650 1.00 1.00 N ATOM 330 CA LEU A 978 41.141 -1.673 2.263 1.00 1.00 C ATOM 331 C LEU A 978 40.744 -0.377 1.558 1.00 1.00 C ATOM 332 O LEU A 978 41.364 0.666 1.767 1.00 1.00 O ATOM 333 CB LEU A 978 42.005 -2.522 1.324 1.00 1.00 C ATOM 334 CG LEU A 978 42.603 -3.699 2.104 1.00 1.00 C ATOM 335 CD1 LEU A 978 43.285 -4.663 1.133 1.00 1.00 C ATOM 336 CD2 LEU A 978 43.631 -3.194 3.125 1.00 1.00 C ATOM 0 H LEU A 978 39.854 -3.329 2.205 1.00 1.00 H new ATOM 0 HA LEU A 978 41.713 -1.436 3.160 1.00 1.00 H new ATOM 0 HB2 LEU A 978 41.404 -2.891 0.493 1.00 1.00 H new ATOM 0 HB3 LEU A 978 42.801 -1.913 0.896 1.00 1.00 H new ATOM 0 HG LEU A 978 41.801 -4.214 2.633 1.00 1.00 H new ATOM 0 HD11 LEU A 978 43.710 -5.499 1.689 1.00 1.00 H new ATOM 0 HD12 LEU A 978 42.553 -5.037 0.417 1.00 1.00 H new ATOM 0 HD13 LEU A 978 44.079 -4.141 0.600 1.00 1.00 H new ATOM 0 HD21 LEU A 978 44.047 -4.040 3.671 1.00 1.00 H new ATOM 0 HD22 LEU A 978 44.432 -2.668 2.605 1.00 1.00 H new ATOM 0 HD23 LEU A 978 43.145 -2.514 3.825 1.00 1.00 H new ATOM 348 N LEU A 979 39.714 -0.460 0.718 1.00 1.00 N ATOM 349 CA LEU A 979 39.238 0.704 -0.026 1.00 1.00 C ATOM 350 C LEU A 979 38.764 1.802 0.923 1.00 1.00 C ATOM 351 O LEU A 979 39.097 2.973 0.740 1.00 1.00 O ATOM 352 CB LEU A 979 38.086 0.272 -0.945 1.00 1.00 C ATOM 353 CG LEU A 979 37.478 1.486 -1.662 1.00 1.00 C ATOM 354 CD1 LEU A 979 38.560 2.234 -2.435 1.00 1.00 C ATOM 355 CD2 LEU A 979 36.396 1.011 -2.642 1.00 1.00 C ATOM 0 H LEU A 979 39.194 -1.319 0.536 1.00 1.00 H new ATOM 0 HA LEU A 979 40.059 1.105 -0.621 1.00 1.00 H new ATOM 0 HB2 LEU A 979 38.450 -0.446 -1.680 1.00 1.00 H new ATOM 0 HB3 LEU A 979 37.318 -0.233 -0.360 1.00 1.00 H new ATOM 0 HG LEU A 979 37.040 2.153 -0.920 1.00 1.00 H new ATOM 0 HD11 LEU A 979 38.118 3.093 -2.940 1.00 1.00 H new ATOM 0 HD12 LEU A 979 39.330 2.576 -1.744 1.00 1.00 H new ATOM 0 HD13 LEU A 979 39.005 1.568 -3.174 1.00 1.00 H new ATOM 0 HD21 LEU A 979 35.963 1.872 -3.152 1.00 1.00 H new ATOM 0 HD22 LEU A 979 36.840 0.340 -3.377 1.00 1.00 H new ATOM 0 HD23 LEU A 979 35.615 0.484 -2.094 1.00 1.00 H new ATOM 367 N LEU A 980 37.994 1.422 1.934 1.00 1.00 N ATOM 368 CA LEU A 980 37.495 2.392 2.903 1.00 1.00 C ATOM 369 C LEU A 980 38.648 3.008 3.698 1.00 1.00 C ATOM 370 O LEU A 980 38.661 4.208 3.969 1.00 1.00 O ATOM 371 CB LEU A 980 36.507 1.708 3.856 1.00 1.00 C ATOM 372 CG LEU A 980 35.961 2.713 4.883 1.00 1.00 C ATOM 373 CD1 LEU A 980 35.261 3.868 4.159 1.00 1.00 C ATOM 374 CD2 LEU A 980 34.956 2.005 5.795 1.00 1.00 C ATOM 0 H LEU A 980 37.703 0.459 2.105 1.00 1.00 H new ATOM 0 HA LEU A 980 36.986 3.191 2.365 1.00 1.00 H new ATOM 0 HB2 LEU A 980 35.683 1.278 3.287 1.00 1.00 H new ATOM 0 HB3 LEU A 980 37.002 0.885 4.372 1.00 1.00 H new ATOM 0 HG LEU A 980 36.786 3.108 5.476 1.00 1.00 H new ATOM 0 HD11 LEU A 980 34.876 4.577 4.892 1.00 1.00 H new ATOM 0 HD12 LEU A 980 35.973 4.372 3.505 1.00 1.00 H new ATOM 0 HD13 LEU A 980 34.436 3.477 3.564 1.00 1.00 H new ATOM 0 HD21 LEU A 980 34.566 2.714 6.526 1.00 1.00 H new ATOM 0 HD22 LEU A 980 34.135 1.612 5.196 1.00 1.00 H new ATOM 0 HD23 LEU A 980 35.451 1.184 6.314 1.00 1.00 H new ATOM 386 N THR A 981 39.595 2.160 4.096 1.00 1.00 N ATOM 387 CA THR A 981 40.735 2.601 4.898 1.00 1.00 C ATOM 388 C THR A 981 41.608 3.627 4.168 1.00 1.00 C ATOM 389 O THR A 981 42.018 4.628 4.755 1.00 1.00 O ATOM 390 CB THR A 981 41.594 1.389 5.266 1.00 1.00 C ATOM 391 OG1 THR A 981 40.760 0.364 5.790 1.00 1.00 O ATOM 392 CG2 THR A 981 42.624 1.795 6.325 1.00 1.00 C ATOM 0 H THR A 981 39.595 1.164 3.876 1.00 1.00 H new ATOM 0 HA THR A 981 40.336 3.083 5.790 1.00 1.00 H new ATOM 0 HB THR A 981 42.110 1.025 4.378 1.00 1.00 H new ATOM 0 HG1 THR A 981 40.447 -0.208 5.059 1.00 1.00 H new ATOM 0 HG21 THR A 981 43.236 0.932 6.587 1.00 1.00 H new ATOM 0 HG22 THR A 981 43.262 2.585 5.928 1.00 1.00 H new ATOM 0 HG23 THR A 981 42.108 2.158 7.214 1.00 1.00 H new ATOM 400 N ILE A 982 41.921 3.368 2.903 1.00 1.00 N ATOM 401 CA ILE A 982 42.780 4.283 2.148 1.00 1.00 C ATOM 402 C ILE A 982 42.102 5.640 1.947 1.00 1.00 C ATOM 403 O ILE A 982 42.748 6.680 2.069 1.00 1.00 O ATOM 404 CB ILE A 982 43.198 3.665 0.805 1.00 1.00 C ATOM 405 CG1 ILE A 982 41.968 3.356 -0.045 1.00 1.00 C ATOM 406 CG2 ILE A 982 43.961 2.367 1.058 1.00 1.00 C ATOM 407 CD1 ILE A 982 42.417 2.861 -1.422 1.00 1.00 C ATOM 0 H ILE A 982 41.602 2.550 2.384 1.00 1.00 H new ATOM 0 HA ILE A 982 43.684 4.450 2.733 1.00 1.00 H new ATOM 0 HB ILE A 982 43.831 4.377 0.276 1.00 1.00 H new ATOM 0 HG12 ILE A 982 41.354 2.599 0.444 1.00 1.00 H new ATOM 0 HG13 ILE A 982 41.351 4.248 -0.150 1.00 1.00 H new ATOM 0 HG21 ILE A 982 44.258 1.928 0.106 1.00 1.00 H new ATOM 0 HG22 ILE A 982 44.850 2.577 1.653 1.00 1.00 H new ATOM 0 HG23 ILE A 982 43.321 1.668 1.596 1.00 1.00 H new ATOM 0 HD11 ILE A 982 41.541 2.639 -2.032 1.00 1.00 H new ATOM 0 HD12 ILE A 982 43.013 3.633 -1.909 1.00 1.00 H new ATOM 0 HD13 ILE A 982 43.017 1.958 -1.306 1.00 1.00 H new ATOM 419 N LEU A 983 40.804 5.638 1.639 1.00 1.00 N ATOM 420 CA LEU A 983 40.090 6.896 1.438 1.00 1.00 C ATOM 421 C LEU A 983 40.097 7.716 2.722 1.00 1.00 C ATOM 422 O LEU A 983 40.305 8.928 2.693 1.00 1.00 O ATOM 423 CB LEU A 983 38.641 6.627 1.020 1.00 1.00 C ATOM 424 CG LEU A 983 38.608 6.042 -0.397 1.00 1.00 C ATOM 425 CD1 LEU A 983 37.188 5.577 -0.723 1.00 1.00 C ATOM 426 CD2 LEU A 983 39.045 7.097 -1.421 1.00 1.00 C ATOM 0 H LEU A 983 40.237 4.798 1.526 1.00 1.00 H new ATOM 0 HA LEU A 983 40.595 7.453 0.648 1.00 1.00 H new ATOM 0 HB2 LEU A 983 38.174 5.934 1.720 1.00 1.00 H new ATOM 0 HB3 LEU A 983 38.065 7.552 1.055 1.00 1.00 H new ATOM 0 HG LEU A 983 39.295 5.197 -0.445 1.00 1.00 H new ATOM 0 HD11 LEU A 983 37.164 5.161 -1.730 1.00 1.00 H new ATOM 0 HD12 LEU A 983 36.882 4.814 -0.008 1.00 1.00 H new ATOM 0 HD13 LEU A 983 36.505 6.424 -0.664 1.00 1.00 H new ATOM 0 HD21 LEU A 983 39.016 6.666 -2.422 1.00 1.00 H new ATOM 0 HD22 LEU A 983 38.370 7.951 -1.374 1.00 1.00 H new ATOM 0 HD23 LEU A 983 40.060 7.424 -1.196 1.00 1.00 H new ATOM 438 N VAL A 984 39.872 7.047 3.845 1.00 1.00 N ATOM 439 CA VAL A 984 39.861 7.724 5.137 1.00 1.00 C ATOM 440 C VAL A 984 41.242 8.287 5.454 1.00 1.00 C ATOM 441 O VAL A 984 41.374 9.413 5.924 1.00 1.00 O ATOM 442 CB VAL A 984 39.439 6.743 6.230 1.00 1.00 C ATOM 443 CG1 VAL A 984 39.646 7.383 7.601 1.00 1.00 C ATOM 444 CG2 VAL A 984 37.960 6.386 6.052 1.00 1.00 C ATOM 0 H VAL A 984 39.696 6.043 3.889 1.00 1.00 H new ATOM 0 HA VAL A 984 39.149 8.548 5.095 1.00 1.00 H new ATOM 0 HB VAL A 984 40.044 5.839 6.158 1.00 1.00 H new ATOM 0 HG11 VAL A 984 39.344 6.682 8.379 1.00 1.00 H new ATOM 0 HG12 VAL A 984 40.698 7.637 7.729 1.00 1.00 H new ATOM 0 HG13 VAL A 984 39.043 8.288 7.675 1.00 1.00 H new ATOM 0 HG21 VAL A 984 37.658 5.686 6.831 1.00 1.00 H new ATOM 0 HG22 VAL A 984 37.356 7.291 6.123 1.00 1.00 H new ATOM 0 HG23 VAL A 984 37.812 5.927 5.075 1.00 1.00 H new ATOM 454 N LEU A 985 42.263 7.481 5.203 1.00 1.00 N ATOM 455 CA LEU A 985 43.643 7.879 5.469 1.00 1.00 C ATOM 456 C LEU A 985 44.048 9.088 4.627 1.00 1.00 C ATOM 457 O LEU A 985 44.703 10.005 5.120 1.00 1.00 O ATOM 458 CB LEU A 985 44.575 6.699 5.169 1.00 1.00 C ATOM 459 CG LEU A 985 46.040 7.093 5.401 1.00 1.00 C ATOM 460 CD1 LEU A 985 46.226 7.593 6.834 1.00 1.00 C ATOM 461 CD2 LEU A 985 46.929 5.871 5.175 1.00 1.00 C ATOM 0 H LEU A 985 42.164 6.543 4.814 1.00 1.00 H new ATOM 0 HA LEU A 985 43.724 8.162 6.518 1.00 1.00 H new ATOM 0 HB2 LEU A 985 44.315 5.853 5.806 1.00 1.00 H new ATOM 0 HB3 LEU A 985 44.439 6.375 4.137 1.00 1.00 H new ATOM 0 HG LEU A 985 46.313 7.887 4.706 1.00 1.00 H new ATOM 0 HD11 LEU A 985 47.268 7.870 6.990 1.00 1.00 H new ATOM 0 HD12 LEU A 985 45.590 8.462 7.001 1.00 1.00 H new ATOM 0 HD13 LEU A 985 45.952 6.803 7.533 1.00 1.00 H new ATOM 0 HD21 LEU A 985 47.971 6.144 5.338 1.00 1.00 H new ATOM 0 HD22 LEU A 985 46.647 5.082 5.872 1.00 1.00 H new ATOM 0 HD23 LEU A 985 46.803 5.514 4.153 1.00 1.00 H new ATOM 473 N ALA A 986 43.669 9.089 3.356 1.00 1.00 N ATOM 474 CA ALA A 986 44.025 10.201 2.485 1.00 1.00 C ATOM 475 C ALA A 986 43.404 11.503 2.979 1.00 1.00 C ATOM 476 O ALA A 986 44.049 12.546 2.968 1.00 1.00 O ATOM 477 CB ALA A 986 43.547 9.929 1.057 1.00 1.00 C ATOM 0 H ALA A 986 43.126 8.349 2.912 1.00 1.00 H new ATOM 0 HA ALA A 986 45.110 10.299 2.498 1.00 1.00 H new ATOM 0 HB1 ALA A 986 43.819 10.768 0.416 1.00 1.00 H new ATOM 0 HB2 ALA A 986 44.017 9.019 0.683 1.00 1.00 H new ATOM 0 HB3 ALA A 986 42.464 9.806 1.053 1.00 1.00 H new ATOM 483 N MET A 987 42.155 11.445 3.413 1.00 1.00 N ATOM 484 CA MET A 987 41.484 12.652 3.909 1.00 1.00 C ATOM 485 C MET A 987 42.149 13.156 5.183 1.00 1.00 C ATOM 486 O MET A 987 42.329 14.361 5.371 1.00 1.00 O ATOM 487 CB MET A 987 39.988 12.371 4.169 1.00 1.00 C ATOM 488 CG MET A 987 39.261 12.045 2.851 1.00 1.00 C ATOM 489 SD MET A 987 39.358 13.453 1.706 1.00 1.00 S ATOM 490 CE MET A 987 38.262 14.594 2.603 1.00 1.00 C ATOM 0 H MET A 987 41.589 10.597 3.435 1.00 1.00 H new ATOM 0 HA MET A 987 41.570 13.424 3.145 1.00 1.00 H new ATOM 0 HB2 MET A 987 39.884 11.537 4.864 1.00 1.00 H new ATOM 0 HB3 MET A 987 39.526 13.238 4.641 1.00 1.00 H new ATOM 0 HG2 MET A 987 39.707 11.163 2.391 1.00 1.00 H new ATOM 0 HG3 MET A 987 38.217 11.805 3.054 1.00 1.00 H new ATOM 0 HE1 MET A 987 37.623 15.118 1.893 1.00 1.00 H new ATOM 0 HE2 MET A 987 37.643 14.031 3.301 1.00 1.00 H new ATOM 0 HE3 MET A 987 38.863 15.318 3.153 1.00 1.00 H new ATOM 500 N TRP A 988 42.517 12.225 6.054 1.00 1.00 N ATOM 501 CA TRP A 988 43.172 12.579 7.312 1.00 1.00 C ATOM 502 C TRP A 988 44.533 13.228 7.043 1.00 1.00 C ATOM 503 O TRP A 988 44.935 14.181 7.712 1.00 1.00 O ATOM 504 CB TRP A 988 43.352 11.324 8.166 1.00 1.00 C ATOM 505 CG TRP A 988 44.262 11.605 9.317 1.00 1.00 C ATOM 506 CD1 TRP A 988 44.380 12.790 9.950 1.00 1.00 C ATOM 507 CD2 TRP A 988 45.197 10.695 9.973 1.00 1.00 C ATOM 508 NE1 TRP A 988 45.313 12.662 10.959 1.00 1.00 N ATOM 509 CE2 TRP A 988 45.848 11.394 11.010 1.00 1.00 C ATOM 510 CE3 TRP A 988 45.536 9.344 9.772 1.00 1.00 C ATOM 511 CZ2 TRP A 988 46.803 10.782 11.823 1.00 1.00 C ATOM 512 CZ3 TRP A 988 46.498 8.722 10.588 1.00 1.00 C ATOM 513 CH2 TRP A 988 47.129 9.443 11.611 1.00 1.00 C ATOM 0 H TRP A 988 42.375 11.224 5.916 1.00 1.00 H new ATOM 0 HA TRP A 988 42.547 13.295 7.846 1.00 1.00 H new ATOM 0 HB2 TRP A 988 42.384 10.984 8.534 1.00 1.00 H new ATOM 0 HB3 TRP A 988 43.762 10.518 7.558 1.00 1.00 H new ATOM 0 HD1 TRP A 988 43.835 13.690 9.708 1.00 1.00 H new ATOM 0 HE1 TRP A 988 45.575 13.417 11.592 1.00 1.00 H new ATOM 0 HE3 TRP A 988 45.054 8.781 8.986 1.00 1.00 H new ATOM 0 HZ2 TRP A 988 47.286 11.341 12.611 1.00 1.00 H new ATOM 0 HZ3 TRP A 988 46.751 7.685 10.426 1.00 1.00 H new ATOM 0 HH2 TRP A 988 47.868 8.962 12.235 1.00 1.00 H new ATOM 524 N LYS A 989 45.241 12.689 6.056 1.00 1.00 N ATOM 525 CA LYS A 989 46.564 13.196 5.698 1.00 1.00 C ATOM 526 C LYS A 989 46.448 14.601 5.097 1.00 1.00 C ATOM 527 O LYS A 989 47.446 15.313 4.947 1.00 1.00 O ATOM 528 CB LYS A 989 47.215 12.262 4.670 1.00 1.00 C ATOM 529 CG LYS A 989 48.451 11.544 5.258 1.00 1.00 C ATOM 530 CD LYS A 989 49.735 12.393 5.115 1.00 1.00 C ATOM 531 CE LYS A 989 49.850 13.414 6.250 1.00 1.00 C ATOM 532 NZ LYS A 989 51.245 13.936 6.292 1.00 1.00 N ATOM 0 H LYS A 989 44.923 11.903 5.490 1.00 1.00 H new ATOM 0 HA LYS A 989 47.177 13.239 6.598 1.00 1.00 H new ATOM 0 HB2 LYS A 989 46.487 11.522 4.338 1.00 1.00 H new ATOM 0 HB3 LYS A 989 47.510 12.836 3.792 1.00 1.00 H new ATOM 0 HG2 LYS A 989 48.276 11.325 6.311 1.00 1.00 H new ATOM 0 HG3 LYS A 989 48.590 10.588 4.753 1.00 1.00 H new ATOM 0 HD2 LYS A 989 50.608 11.741 5.119 1.00 1.00 H new ATOM 0 HD3 LYS A 989 49.728 12.910 4.156 1.00 1.00 H new ATOM 0 HE2 LYS A 989 49.146 14.232 6.094 1.00 1.00 H new ATOM 0 HE3 LYS A 989 49.593 12.950 7.202 1.00 1.00 H new ATOM 0 HZ1 LYS A 989 51.333 14.631 7.061 1.00 1.00 H new ATOM 0 HZ2 LYS A 989 51.905 13.150 6.459 1.00 1.00 H new ATOM 0 HZ3 LYS A 989 51.472 14.392 5.385 1.00 1.00 H new ATOM 546 N VAL A 990 45.225 15.000 4.746 1.00 1.00 N ATOM 547 CA VAL A 990 45.019 16.314 4.160 1.00 1.00 C ATOM 548 C VAL A 990 44.820 17.350 5.258 1.00 1.00 C ATOM 549 O VAL A 990 44.912 18.551 5.017 1.00 1.00 O ATOM 550 CB VAL A 990 43.795 16.296 3.240 1.00 1.00 C ATOM 551 CG1 VAL A 990 43.549 17.695 2.677 1.00 1.00 C ATOM 552 CG2 VAL A 990 44.037 15.324 2.083 1.00 1.00 C ATOM 0 H VAL A 990 44.380 14.440 4.856 1.00 1.00 H new ATOM 0 HA VAL A 990 45.900 16.577 3.575 1.00 1.00 H new ATOM 0 HB VAL A 990 42.924 15.977 3.813 1.00 1.00 H new ATOM 0 HG11 VAL A 990 42.677 17.676 2.023 1.00 1.00 H new ATOM 0 HG12 VAL A 990 43.373 18.391 3.497 1.00 1.00 H new ATOM 0 HG13 VAL A 990 44.422 18.017 2.109 1.00 1.00 H new ATOM 0 HG21 VAL A 990 43.165 15.312 1.429 1.00 1.00 H new ATOM 0 HG22 VAL A 990 44.911 15.644 1.516 1.00 1.00 H new ATOM 0 HG23 VAL A 990 44.207 14.323 2.479 1.00 1.00 H new ATOM 562 N GLY A 991 44.552 16.876 6.465 1.00 1.00 N ATOM 563 CA GLY A 991 44.349 17.780 7.590 1.00 1.00 C ATOM 564 C GLY A 991 42.888 18.203 7.697 1.00 1.00 C ATOM 565 O GLY A 991 42.541 19.082 8.487 1.00 1.00 O ATOM 0 H GLY A 991 44.470 15.885 6.691 1.00 1.00 H new ATOM 0 HA2 GLY A 991 44.658 17.291 8.514 1.00 1.00 H new ATOM 0 HA3 GLY A 991 44.978 18.662 7.470 1.00 1.00 H new ATOM 569 N PHE A 992 42.041 17.568 6.902 1.00 1.00 N ATOM 570 CA PHE A 992 40.615 17.876 6.915 1.00 1.00 C ATOM 571 C PHE A 992 39.996 17.597 8.277 1.00 1.00 C ATOM 572 O PHE A 992 39.181 18.376 8.769 1.00 1.00 O ATOM 573 CB PHE A 992 39.886 17.049 5.846 1.00 1.00 C ATOM 574 CG PHE A 992 38.375 17.144 6.007 1.00 1.00 C ATOM 575 CD1 PHE A 992 37.747 18.312 6.487 1.00 1.00 C ATOM 576 CD2 PHE A 992 37.595 16.028 5.683 1.00 1.00 C ATOM 577 CE1 PHE A 992 36.352 18.347 6.629 1.00 1.00 C ATOM 578 CE2 PHE A 992 36.203 16.070 5.826 1.00 1.00 C ATOM 579 CZ PHE A 992 35.584 17.228 6.296 1.00 1.00 C ATOM 0 H PHE A 992 42.312 16.839 6.242 1.00 1.00 H new ATOM 0 HA PHE A 992 40.506 18.939 6.699 1.00 1.00 H new ATOM 0 HB2 PHE A 992 40.171 17.401 4.854 1.00 1.00 H new ATOM 0 HB3 PHE A 992 40.196 16.006 5.916 1.00 1.00 H new ATOM 0 HD1 PHE A 992 38.339 19.178 6.745 1.00 1.00 H new ATOM 0 HD2 PHE A 992 38.070 15.128 5.320 1.00 1.00 H new ATOM 0 HE1 PHE A 992 35.870 19.241 6.997 1.00 1.00 H new ATOM 0 HE2 PHE A 992 35.608 15.205 5.572 1.00 1.00 H new ATOM 0 HZ PHE A 992 34.510 17.260 6.403 1.00 1.00 H new ATOM 589 N PHE A 993 40.369 16.473 8.876 1.00 1.00 N ATOM 590 CA PHE A 993 39.809 16.104 10.173 1.00 1.00 C ATOM 591 C PHE A 993 40.724 16.524 11.318 1.00 1.00 C ATOM 592 O PHE A 993 40.447 16.222 12.478 1.00 1.00 O ATOM 593 CB PHE A 993 39.571 14.592 10.245 1.00 1.00 C ATOM 594 CG PHE A 993 38.572 14.178 9.188 1.00 1.00 C ATOM 595 CD1 PHE A 993 37.253 14.649 9.241 1.00 1.00 C ATOM 596 CD2 PHE A 993 38.962 13.313 8.157 1.00 1.00 C ATOM 597 CE1 PHE A 993 36.333 14.255 8.266 1.00 1.00 C ATOM 598 CE2 PHE A 993 38.037 12.921 7.182 1.00 1.00 C ATOM 599 CZ PHE A 993 36.723 13.391 7.238 1.00 1.00 C ATOM 0 H PHE A 993 41.044 15.811 8.494 1.00 1.00 H new ATOM 0 HA PHE A 993 38.860 16.630 10.277 1.00 1.00 H new ATOM 0 HB2 PHE A 993 40.511 14.060 10.098 1.00 1.00 H new ATOM 0 HB3 PHE A 993 39.202 14.320 11.234 1.00 1.00 H new ATOM 0 HD1 PHE A 993 36.948 15.315 10.034 1.00 1.00 H new ATOM 0 HD2 PHE A 993 39.978 12.948 8.114 1.00 1.00 H new ATOM 0 HE1 PHE A 993 35.317 14.619 8.306 1.00 1.00 H new ATOM 0 HE2 PHE A 993 38.339 12.256 6.387 1.00 1.00 H new ATOM 0 HZ PHE A 993 36.008 13.087 6.487 1.00 1.00 H new ATOM 609 N LYS A 994 41.807 17.223 10.995 1.00 1.00 N ATOM 610 CA LYS A 994 42.741 17.679 12.023 1.00 1.00 C ATOM 611 C LYS A 994 42.639 19.192 12.181 1.00 1.00 C ATOM 612 O LYS A 994 42.776 19.938 11.211 1.00 1.00 O ATOM 613 CB LYS A 994 44.172 17.302 11.637 1.00 1.00 C ATOM 614 CG LYS A 994 45.134 17.701 12.757 1.00 1.00 C ATOM 615 CD LYS A 994 46.557 17.280 12.385 1.00 1.00 C ATOM 616 CE LYS A 994 47.509 17.665 13.519 1.00 1.00 C ATOM 617 NZ LYS A 994 48.896 17.238 13.181 1.00 1.00 N ATOM 0 H LYS A 994 42.060 17.485 10.042 1.00 1.00 H new ATOM 0 HA LYS A 994 42.486 17.198 12.967 1.00 1.00 H new ATOM 0 HB2 LYS A 994 44.238 16.230 11.453 1.00 1.00 H new ATOM 0 HB3 LYS A 994 44.452 17.802 10.710 1.00 1.00 H new ATOM 0 HG2 LYS A 994 45.093 18.778 12.919 1.00 1.00 H new ATOM 0 HG3 LYS A 994 44.836 17.227 13.692 1.00 1.00 H new ATOM 0 HD2 LYS A 994 46.597 16.205 12.210 1.00 1.00 H new ATOM 0 HD3 LYS A 994 46.862 17.765 11.458 1.00 1.00 H new ATOM 0 HE2 LYS A 994 47.480 18.743 13.681 1.00 1.00 H new ATOM 0 HE3 LYS A 994 47.190 17.194 14.449 1.00 1.00 H new ATOM 0 HZ1 LYS A 994 49.539 17.502 13.955 1.00 1.00 H new ATOM 0 HZ2 LYS A 994 48.919 16.207 13.048 1.00 1.00 H new ATOM 0 HZ3 LYS A 994 49.199 17.707 12.304 1.00 1.00 H new ATOM 631 N ARG A 995 42.400 19.640 13.409 1.00 1.00 N ATOM 632 CA ARG A 995 42.286 21.063 13.681 1.00 1.00 C ATOM 633 C ARG A 995 43.013 21.371 14.977 1.00 1.00 C ATOM 634 O ARG A 995 43.008 20.557 15.900 1.00 1.00 O ATOM 635 CB ARG A 995 40.811 21.461 13.790 1.00 1.00 C ATOM 636 CG ARG A 995 40.695 22.974 13.979 1.00 1.00 C ATOM 637 CD ARG A 995 39.219 23.355 14.098 1.00 1.00 C ATOM 638 NE ARG A 995 38.534 23.113 12.835 1.00 1.00 N ATOM 639 CZ ARG A 995 37.231 23.347 12.702 1.00 1.00 C ATOM 640 NH1 ARG A 995 36.538 23.794 13.715 1.00 1.00 N ATOM 641 NH2 ARG A 995 36.644 23.125 11.560 1.00 1.00 N ATOM 0 H ARG A 995 42.282 19.040 14.226 1.00 1.00 H new ATOM 0 HA ARG A 995 42.733 21.633 12.867 1.00 1.00 H new ATOM 0 HB2 ARG A 995 40.275 21.155 12.891 1.00 1.00 H new ATOM 0 HB3 ARG A 995 40.346 20.944 14.630 1.00 1.00 H new ATOM 0 HG2 ARG A 995 41.236 23.283 14.873 1.00 1.00 H new ATOM 0 HG3 ARG A 995 41.150 23.494 13.136 1.00 1.00 H new ATOM 0 HD2 ARG A 995 38.749 22.775 14.892 1.00 1.00 H new ATOM 0 HD3 ARG A 995 39.128 24.406 14.374 1.00 1.00 H new ATOM 0 HE ARG A 995 39.063 22.758 12.038 1.00 1.00 H new ATOM 0 HH11 ARG A 995 36.996 23.964 14.610 1.00 1.00 H new ATOM 0 HH12 ARG A 995 35.539 23.973 13.611 1.00 1.00 H new ATOM 0 HH21 ARG A 995 37.183 22.772 10.769 1.00 1.00 H new ATOM 0 HH22 ARG A 995 35.645 23.304 11.457 1.00 1.00 H new ATOM 808 N ASP B 692 27.101 -16.896 -10.597 1.00 1.00 N ATOM 809 CA ASP B 692 26.537 -15.787 -9.833 1.00 1.00 C ATOM 810 C ASP B 692 27.614 -15.120 -8.977 1.00 1.00 C ATOM 811 O ASP B 692 27.387 -14.070 -8.379 1.00 1.00 O ATOM 812 CB ASP B 692 25.408 -16.290 -8.933 1.00 1.00 C ATOM 813 CG ASP B 692 24.207 -16.702 -9.776 1.00 1.00 C ATOM 814 OD1 ASP B 692 24.174 -16.338 -10.940 1.00 1.00 O ATOM 815 OD2 ASP B 692 23.336 -17.374 -9.245 1.00 1.00 O ATOM 0 HA ASP B 692 26.141 -15.054 -10.536 1.00 1.00 H new ATOM 0 HB2 ASP B 692 25.755 -17.138 -8.342 1.00 1.00 H new ATOM 0 HB3 ASP B 692 25.118 -15.509 -8.230 1.00 1.00 H new ATOM 820 N ILE B 693 28.786 -15.743 -8.922 1.00 1.00 N ATOM 821 CA ILE B 693 29.891 -15.209 -8.133 1.00 1.00 C ATOM 822 C ILE B 693 30.342 -13.855 -8.671 1.00 1.00 C ATOM 823 O ILE B 693 30.597 -12.931 -7.901 1.00 1.00 O ATOM 824 CB ILE B 693 31.065 -16.187 -8.141 1.00 1.00 C ATOM 825 CG1 ILE B 693 30.679 -17.448 -7.364 1.00 1.00 C ATOM 826 CG2 ILE B 693 32.281 -15.529 -7.483 1.00 1.00 C ATOM 827 CD1 ILE B 693 31.745 -18.524 -7.575 1.00 1.00 C ATOM 0 H ILE B 693 28.995 -16.613 -9.411 1.00 1.00 H new ATOM 0 HA ILE B 693 29.542 -15.074 -7.109 1.00 1.00 H new ATOM 0 HB ILE B 693 31.312 -16.455 -9.168 1.00 1.00 H new ATOM 0 HG12 ILE B 693 30.584 -17.219 -6.303 1.00 1.00 H new ATOM 0 HG13 ILE B 693 29.708 -17.812 -7.700 1.00 1.00 H new ATOM 0 HG21 ILE B 693 33.119 -16.226 -7.488 1.00 1.00 H new ATOM 0 HG22 ILE B 693 32.553 -14.631 -8.037 1.00 1.00 H new ATOM 0 HG23 ILE B 693 32.038 -15.262 -6.455 1.00 1.00 H new ATOM 0 HD11 ILE B 693 31.470 -19.422 -7.022 1.00 1.00 H new ATOM 0 HD12 ILE B 693 31.818 -18.760 -8.637 1.00 1.00 H new ATOM 0 HD13 ILE B 693 32.707 -18.158 -7.217 1.00 1.00 H new ATOM 839 N LEU B 694 30.446 -13.739 -9.993 1.00 1.00 N ATOM 840 CA LEU B 694 30.879 -12.482 -10.594 1.00 1.00 C ATOM 841 C LEU B 694 29.886 -11.379 -10.253 1.00 1.00 C ATOM 842 O LEU B 694 30.279 -10.268 -9.902 1.00 1.00 O ATOM 843 CB LEU B 694 30.980 -12.636 -12.116 1.00 1.00 C ATOM 844 CG LEU B 694 32.150 -13.567 -12.464 1.00 1.00 C ATOM 845 CD1 LEU B 694 32.121 -13.890 -13.959 1.00 1.00 C ATOM 846 CD2 LEU B 694 33.486 -12.894 -12.119 1.00 1.00 C ATOM 0 H LEU B 694 30.241 -14.485 -10.657 1.00 1.00 H new ATOM 0 HA LEU B 694 31.859 -12.218 -10.198 1.00 1.00 H new ATOM 0 HB2 LEU B 694 30.049 -13.041 -12.513 1.00 1.00 H new ATOM 0 HB3 LEU B 694 31.127 -11.661 -12.581 1.00 1.00 H new ATOM 0 HG LEU B 694 32.052 -14.485 -11.885 1.00 1.00 H new ATOM 0 HD11 LEU B 694 32.952 -14.551 -14.205 1.00 1.00 H new ATOM 0 HD12 LEU B 694 31.181 -14.382 -14.207 1.00 1.00 H new ATOM 0 HD13 LEU B 694 32.210 -12.967 -14.532 1.00 1.00 H new ATOM 0 HD21 LEU B 694 34.307 -13.565 -12.371 1.00 1.00 H new ATOM 0 HD22 LEU B 694 33.585 -11.970 -12.688 1.00 1.00 H new ATOM 0 HD23 LEU B 694 33.515 -12.669 -11.053 1.00 1.00 H new ATOM 858 N VAL B 695 28.597 -11.700 -10.327 1.00 1.00 N ATOM 859 CA VAL B 695 27.567 -10.727 -9.996 1.00 1.00 C ATOM 860 C VAL B 695 27.679 -10.351 -8.523 1.00 1.00 C ATOM 861 O VAL B 695 27.608 -9.179 -8.155 1.00 1.00 O ATOM 862 CB VAL B 695 26.183 -11.312 -10.279 1.00 1.00 C ATOM 863 CG1 VAL B 695 25.110 -10.364 -9.746 1.00 1.00 C ATOM 864 CG2 VAL B 695 26.000 -11.487 -11.790 1.00 1.00 C ATOM 0 H VAL B 695 28.246 -12.615 -10.610 1.00 1.00 H new ATOM 0 HA VAL B 695 27.704 -9.836 -10.609 1.00 1.00 H new ATOM 0 HB VAL B 695 26.092 -12.280 -9.786 1.00 1.00 H new ATOM 0 HG11 VAL B 695 24.123 -10.781 -9.948 1.00 1.00 H new ATOM 0 HG12 VAL B 695 25.238 -10.238 -8.671 1.00 1.00 H new ATOM 0 HG13 VAL B 695 25.202 -9.396 -10.239 1.00 1.00 H new ATOM 0 HG21 VAL B 695 25.013 -11.904 -11.991 1.00 1.00 H new ATOM 0 HG22 VAL B 695 26.092 -10.519 -12.282 1.00 1.00 H new ATOM 0 HG23 VAL B 695 26.765 -12.163 -12.173 1.00 1.00 H new ATOM 874 N VAL B 696 27.859 -11.369 -7.686 1.00 1.00 N ATOM 875 CA VAL B 696 27.987 -11.168 -6.248 1.00 1.00 C ATOM 876 C VAL B 696 29.232 -10.347 -5.925 1.00 1.00 C ATOM 877 O VAL B 696 29.187 -9.437 -5.098 1.00 1.00 O ATOM 878 CB VAL B 696 28.060 -12.521 -5.536 1.00 1.00 C ATOM 879 CG1 VAL B 696 28.397 -12.305 -4.059 1.00 1.00 C ATOM 880 CG2 VAL B 696 26.705 -13.221 -5.650 1.00 1.00 C ATOM 0 H VAL B 696 27.919 -12.344 -7.981 1.00 1.00 H new ATOM 0 HA VAL B 696 27.111 -10.622 -5.898 1.00 1.00 H new ATOM 0 HB VAL B 696 28.833 -13.136 -5.997 1.00 1.00 H new ATOM 0 HG11 VAL B 696 28.449 -13.269 -3.553 1.00 1.00 H new ATOM 0 HG12 VAL B 696 29.359 -11.799 -3.975 1.00 1.00 H new ATOM 0 HG13 VAL B 696 27.624 -11.693 -3.595 1.00 1.00 H new ATOM 0 HG21 VAL B 696 26.750 -14.186 -5.145 1.00 1.00 H new ATOM 0 HG22 VAL B 696 25.936 -12.604 -5.185 1.00 1.00 H new ATOM 0 HG23 VAL B 696 26.461 -13.373 -6.701 1.00 1.00 H new ATOM 890 N LEU B 697 30.343 -10.674 -6.573 1.00 1.00 N ATOM 891 CA LEU B 697 31.589 -9.957 -6.327 1.00 1.00 C ATOM 892 C LEU B 697 31.426 -8.485 -6.689 1.00 1.00 C ATOM 893 O LEU B 697 31.856 -7.610 -5.940 1.00 1.00 O ATOM 894 CB LEU B 697 32.725 -10.580 -7.153 1.00 1.00 C ATOM 895 CG LEU B 697 34.039 -9.823 -6.916 1.00 1.00 C ATOM 896 CD1 LEU B 697 34.394 -9.828 -5.428 1.00 1.00 C ATOM 897 CD2 LEU B 697 35.161 -10.500 -7.704 1.00 1.00 C ATOM 0 H LEU B 697 30.408 -11.421 -7.264 1.00 1.00 H new ATOM 0 HA LEU B 697 31.838 -10.034 -5.269 1.00 1.00 H new ATOM 0 HB2 LEU B 697 32.848 -11.628 -6.881 1.00 1.00 H new ATOM 0 HB3 LEU B 697 32.469 -10.554 -8.212 1.00 1.00 H new ATOM 0 HG LEU B 697 33.919 -8.792 -7.249 1.00 1.00 H new ATOM 0 HD11 LEU B 697 35.328 -9.288 -5.275 1.00 1.00 H new ATOM 0 HD12 LEU B 697 33.598 -9.344 -4.862 1.00 1.00 H new ATOM 0 HD13 LEU B 697 34.509 -10.856 -5.085 1.00 1.00 H new ATOM 0 HD21 LEU B 697 36.096 -9.965 -7.538 1.00 1.00 H new ATOM 0 HD22 LEU B 697 35.269 -11.532 -7.370 1.00 1.00 H new ATOM 0 HD23 LEU B 697 34.919 -10.486 -8.767 1.00 1.00 H new ATOM 909 N LEU B 698 30.787 -8.213 -7.823 1.00 1.00 N ATOM 910 CA LEU B 698 30.564 -6.835 -8.236 1.00 1.00 C ATOM 911 C LEU B 698 29.672 -6.140 -7.213 1.00 1.00 C ATOM 912 O LEU B 698 29.916 -4.995 -6.833 1.00 1.00 O ATOM 913 CB LEU B 698 29.903 -6.799 -9.617 1.00 1.00 C ATOM 914 CG LEU B 698 30.904 -7.268 -10.682 1.00 1.00 C ATOM 915 CD1 LEU B 698 30.179 -7.456 -12.018 1.00 1.00 C ATOM 916 CD2 LEU B 698 32.030 -6.235 -10.853 1.00 1.00 C ATOM 0 H LEU B 698 30.420 -8.918 -8.463 1.00 1.00 H new ATOM 0 HA LEU B 698 31.521 -6.317 -8.295 1.00 1.00 H new ATOM 0 HB2 LEU B 698 29.021 -7.440 -9.626 1.00 1.00 H new ATOM 0 HB3 LEU B 698 29.564 -5.788 -9.843 1.00 1.00 H new ATOM 0 HG LEU B 698 31.339 -8.214 -10.361 1.00 1.00 H new ATOM 0 HD11 LEU B 698 30.890 -7.789 -12.774 1.00 1.00 H new ATOM 0 HD12 LEU B 698 29.394 -8.203 -11.904 1.00 1.00 H new ATOM 0 HD13 LEU B 698 29.736 -6.509 -12.328 1.00 1.00 H new ATOM 0 HD21 LEU B 698 32.731 -6.583 -11.612 1.00 1.00 H new ATOM 0 HD22 LEU B 698 31.604 -5.281 -11.163 1.00 1.00 H new ATOM 0 HD23 LEU B 698 32.554 -6.108 -9.906 1.00 1.00 H new ATOM 928 N SER B 699 28.641 -6.854 -6.762 1.00 1.00 N ATOM 929 CA SER B 699 27.718 -6.314 -5.769 1.00 1.00 C ATOM 930 C SER B 699 28.456 -5.976 -4.480 1.00 1.00 C ATOM 931 O SER B 699 28.202 -4.941 -3.863 1.00 1.00 O ATOM 932 CB SER B 699 26.608 -7.327 -5.471 1.00 1.00 C ATOM 933 OG SER B 699 25.881 -7.592 -6.661 1.00 1.00 O ATOM 0 H SER B 699 28.426 -7.803 -7.068 1.00 1.00 H new ATOM 0 HA SER B 699 27.277 -5.404 -6.174 1.00 1.00 H new ATOM 0 HB2 SER B 699 27.037 -8.250 -5.081 1.00 1.00 H new ATOM 0 HB3 SER B 699 25.940 -6.936 -4.703 1.00 1.00 H new ATOM 0 HG SER B 699 26.421 -8.152 -7.257 1.00 1.00 H new ATOM 939 N VAL B 700 29.366 -6.862 -4.074 1.00 1.00 N ATOM 940 CA VAL B 700 30.131 -6.649 -2.849 1.00 1.00 C ATOM 941 C VAL B 700 30.973 -5.386 -2.960 1.00 1.00 C ATOM 942 O VAL B 700 31.001 -4.563 -2.044 1.00 1.00 O ATOM 943 CB VAL B 700 31.056 -7.839 -2.585 1.00 1.00 C ATOM 944 CG1 VAL B 700 32.014 -7.490 -1.448 1.00 1.00 C ATOM 945 CG2 VAL B 700 30.224 -9.059 -2.184 1.00 1.00 C ATOM 0 H VAL B 700 29.589 -7.725 -4.571 1.00 1.00 H new ATOM 0 HA VAL B 700 29.425 -6.545 -2.025 1.00 1.00 H new ATOM 0 HB VAL B 700 31.621 -8.066 -3.489 1.00 1.00 H new ATOM 0 HG11 VAL B 700 32.675 -8.335 -1.257 1.00 1.00 H new ATOM 0 HG12 VAL B 700 32.609 -6.620 -1.727 1.00 1.00 H new ATOM 0 HG13 VAL B 700 31.443 -7.265 -0.547 1.00 1.00 H new ATOM 0 HG21 VAL B 700 30.885 -9.905 -1.997 1.00 1.00 H new ATOM 0 HG22 VAL B 700 29.659 -8.833 -1.280 1.00 1.00 H new ATOM 0 HG23 VAL B 700 29.534 -9.310 -2.990 1.00 1.00 H new ATOM 955 N MET B 701 31.661 -5.243 -4.087 1.00 1.00 N ATOM 956 CA MET B 701 32.507 -4.078 -4.314 1.00 1.00 C ATOM 957 C MET B 701 31.675 -2.804 -4.363 1.00 1.00 C ATOM 958 O MET B 701 32.076 -1.773 -3.832 1.00 1.00 O ATOM 959 CB MET B 701 33.275 -4.241 -5.627 1.00 1.00 C ATOM 960 CG MET B 701 34.407 -5.248 -5.436 1.00 1.00 C ATOM 961 SD MET B 701 35.247 -5.521 -7.020 1.00 1.00 S ATOM 962 CE MET B 701 36.030 -3.892 -7.166 1.00 1.00 C ATOM 0 H MET B 701 31.650 -5.915 -4.854 1.00 1.00 H new ATOM 0 HA MET B 701 33.211 -4.000 -3.486 1.00 1.00 H new ATOM 0 HB2 MET B 701 32.602 -4.580 -6.414 1.00 1.00 H new ATOM 0 HB3 MET B 701 33.679 -3.280 -5.945 1.00 1.00 H new ATOM 0 HG2 MET B 701 35.116 -4.878 -4.695 1.00 1.00 H new ATOM 0 HG3 MET B 701 34.010 -6.189 -5.056 1.00 1.00 H new ATOM 0 HE1 MET B 701 36.907 -3.966 -7.809 1.00 1.00 H new ATOM 0 HE2 MET B 701 35.322 -3.185 -7.598 1.00 1.00 H new ATOM 0 HE3 MET B 701 36.333 -3.544 -6.178 1.00 1.00 H new ATOM 972 N GLY B 702 30.522 -2.874 -5.015 1.00 1.00 N ATOM 973 CA GLY B 702 29.649 -1.713 -5.131 1.00 1.00 C ATOM 974 C GLY B 702 29.076 -1.296 -3.777 1.00 1.00 C ATOM 975 O GLY B 702 28.970 -0.106 -3.479 1.00 1.00 O ATOM 0 H GLY B 702 30.171 -3.717 -5.469 1.00 1.00 H new ATOM 0 HA2 GLY B 702 30.206 -0.881 -5.562 1.00 1.00 H new ATOM 0 HA3 GLY B 702 28.833 -1.939 -5.817 1.00 1.00 H new ATOM 979 N ALA B 703 28.677 -2.284 -2.979 1.00 1.00 N ATOM 980 CA ALA B 703 28.077 -2.008 -1.673 1.00 1.00 C ATOM 981 C ALA B 703 29.053 -1.330 -0.711 1.00 1.00 C ATOM 982 O ALA B 703 28.675 -0.409 0.010 1.00 1.00 O ATOM 983 CB ALA B 703 27.584 -3.314 -1.051 1.00 1.00 C ATOM 0 H ALA B 703 28.757 -3.274 -3.209 1.00 1.00 H new ATOM 0 HA ALA B 703 27.246 -1.322 -1.838 1.00 1.00 H new ATOM 0 HB1 ALA B 703 27.137 -3.108 -0.078 1.00 1.00 H new ATOM 0 HB2 ALA B 703 26.839 -3.769 -1.703 1.00 1.00 H new ATOM 0 HB3 ALA B 703 28.424 -3.998 -0.927 1.00 1.00 H new ATOM 989 N ILE B 704 30.303 -1.785 -0.688 1.00 1.00 N ATOM 990 CA ILE B 704 31.286 -1.193 0.216 1.00 1.00 C ATOM 991 C ILE B 704 31.621 0.235 -0.202 1.00 1.00 C ATOM 992 O ILE B 704 31.782 1.111 0.645 1.00 1.00 O ATOM 993 CB ILE B 704 32.561 -2.048 0.281 1.00 1.00 C ATOM 994 CG1 ILE B 704 33.246 -1.842 1.638 1.00 1.00 C ATOM 995 CG2 ILE B 704 33.532 -1.633 -0.826 1.00 1.00 C ATOM 996 CD1 ILE B 704 32.426 -2.492 2.762 1.00 1.00 C ATOM 0 H ILE B 704 30.654 -2.545 -1.271 1.00 1.00 H new ATOM 0 HA ILE B 704 30.845 -1.163 1.212 1.00 1.00 H new ATOM 0 HB ILE B 704 32.287 -3.095 0.152 1.00 1.00 H new ATOM 0 HG12 ILE B 704 34.247 -2.273 1.615 1.00 1.00 H new ATOM 0 HG13 ILE B 704 33.362 -0.776 1.835 1.00 1.00 H new ATOM 0 HG21 ILE B 704 34.432 -2.246 -0.770 1.00 1.00 H new ATOM 0 HG22 ILE B 704 33.058 -1.773 -1.797 1.00 1.00 H new ATOM 0 HG23 ILE B 704 33.799 -0.584 -0.701 1.00 1.00 H new ATOM 0 HD11 ILE B 704 32.928 -2.335 3.716 1.00 1.00 H new ATOM 0 HD12 ILE B 704 31.434 -2.042 2.796 1.00 1.00 H new ATOM 0 HD13 ILE B 704 32.333 -3.561 2.573 1.00 1.00 H new ATOM 1008 N LEU B 705 31.730 0.468 -1.506 1.00 1.00 N ATOM 1009 CA LEU B 705 32.053 1.800 -2.004 1.00 1.00 C ATOM 1010 C LEU B 705 30.954 2.790 -1.625 1.00 1.00 C ATOM 1011 O LEU B 705 31.234 3.917 -1.216 1.00 1.00 O ATOM 1012 CB LEU B 705 32.237 1.765 -3.529 1.00 1.00 C ATOM 1013 CG LEU B 705 32.553 3.174 -4.065 1.00 1.00 C ATOM 1014 CD1 LEU B 705 33.799 3.738 -3.375 1.00 1.00 C ATOM 1015 CD2 LEU B 705 32.803 3.095 -5.574 1.00 1.00 C ATOM 0 H LEU B 705 31.601 -0.239 -2.230 1.00 1.00 H new ATOM 0 HA LEU B 705 32.987 2.127 -1.546 1.00 1.00 H new ATOM 0 HB2 LEU B 705 33.045 1.081 -3.788 1.00 1.00 H new ATOM 0 HB3 LEU B 705 31.332 1.384 -4.002 1.00 1.00 H new ATOM 0 HG LEU B 705 31.707 3.830 -3.860 1.00 1.00 H new ATOM 0 HD11 LEU B 705 34.011 4.734 -3.764 1.00 1.00 H new ATOM 0 HD12 LEU B 705 33.625 3.797 -2.301 1.00 1.00 H new ATOM 0 HD13 LEU B 705 34.650 3.085 -3.569 1.00 1.00 H new ATOM 0 HD21 LEU B 705 33.027 4.090 -5.958 1.00 1.00 H new ATOM 0 HD22 LEU B 705 33.646 2.432 -5.769 1.00 1.00 H new ATOM 0 HD23 LEU B 705 31.914 2.706 -6.070 1.00 1.00 H new ATOM 1027 N LEU B 706 29.703 2.362 -1.761 1.00 1.00 N ATOM 1028 CA LEU B 706 28.577 3.225 -1.423 1.00 1.00 C ATOM 1029 C LEU B 706 28.619 3.574 0.063 1.00 1.00 C ATOM 1030 O LEU B 706 28.398 4.722 0.447 1.00 1.00 O ATOM 1031 CB LEU B 706 27.255 2.516 -1.753 1.00 1.00 C ATOM 1032 CG LEU B 706 26.060 3.406 -1.386 1.00 1.00 C ATOM 1033 CD1 LEU B 706 26.147 4.742 -2.131 1.00 1.00 C ATOM 1034 CD2 LEU B 706 24.765 2.690 -1.782 1.00 1.00 C ATOM 0 H LEU B 706 29.445 1.435 -2.099 1.00 1.00 H new ATOM 0 HA LEU B 706 28.645 4.142 -2.008 1.00 1.00 H new ATOM 0 HB2 LEU B 706 27.222 2.272 -2.815 1.00 1.00 H new ATOM 0 HB3 LEU B 706 27.195 1.574 -1.208 1.00 1.00 H new ATOM 0 HG LEU B 706 26.071 3.597 -0.313 1.00 1.00 H new ATOM 0 HD11 LEU B 706 25.294 5.365 -1.862 1.00 1.00 H new ATOM 0 HD12 LEU B 706 27.070 5.253 -1.856 1.00 1.00 H new ATOM 0 HD13 LEU B 706 26.140 4.560 -3.206 1.00 1.00 H new ATOM 0 HD21 LEU B 706 23.910 3.315 -1.525 1.00 1.00 H new ATOM 0 HD22 LEU B 706 24.767 2.502 -2.856 1.00 1.00 H new ATOM 0 HD23 LEU B 706 24.695 1.742 -1.248 1.00 1.00 H new ATOM 1046 N ILE B 707 28.913 2.574 0.892 1.00 1.00 N ATOM 1047 CA ILE B 707 28.987 2.794 2.331 1.00 1.00 C ATOM 1048 C ILE B 707 30.117 3.762 2.655 1.00 1.00 C ATOM 1049 O ILE B 707 29.952 4.672 3.466 1.00 1.00 O ATOM 1050 CB ILE B 707 29.217 1.468 3.061 1.00 1.00 C ATOM 1051 CG1 ILE B 707 27.970 0.592 2.923 1.00 1.00 C ATOM 1052 CG2 ILE B 707 29.490 1.736 4.543 1.00 1.00 C ATOM 1053 CD1 ILE B 707 28.283 -0.829 3.394 1.00 1.00 C ATOM 0 H ILE B 707 29.101 1.616 0.595 1.00 1.00 H new ATOM 0 HA ILE B 707 28.042 3.222 2.665 1.00 1.00 H new ATOM 0 HB ILE B 707 30.075 0.957 2.624 1.00 1.00 H new ATOM 0 HG12 ILE B 707 27.154 1.009 3.513 1.00 1.00 H new ATOM 0 HG13 ILE B 707 27.638 0.576 1.885 1.00 1.00 H new ATOM 0 HG21 ILE B 707 29.653 0.790 5.060 1.00 1.00 H new ATOM 0 HG22 ILE B 707 30.377 2.362 4.642 1.00 1.00 H new ATOM 0 HG23 ILE B 707 28.634 2.247 4.984 1.00 1.00 H new ATOM 0 HD11 ILE B 707 27.393 -1.450 3.294 1.00 1.00 H new ATOM 0 HD12 ILE B 707 29.086 -1.245 2.786 1.00 1.00 H new ATOM 0 HD13 ILE B 707 28.594 -0.806 4.438 1.00 1.00 H new ATOM 1065 N GLY B 708 31.265 3.563 2.013 1.00 1.00 N ATOM 1066 CA GLY B 708 32.409 4.433 2.247 1.00 1.00 C ATOM 1067 C GLY B 708 32.075 5.864 1.855 1.00 1.00 C ATOM 1068 O GLY B 708 32.404 6.811 2.568 1.00 1.00 O ATOM 0 H GLY B 708 31.425 2.817 1.336 1.00 1.00 H new ATOM 0 HA2 GLY B 708 32.695 4.394 3.298 1.00 1.00 H new ATOM 0 HA3 GLY B 708 33.265 4.082 1.671 1.00 1.00 H new ATOM 1072 N LEU B 709 31.412 6.008 0.715 1.00 1.00 N ATOM 1073 CA LEU B 709 31.021 7.323 0.227 1.00 1.00 C ATOM 1074 C LEU B 709 30.044 7.981 1.196 1.00 1.00 C ATOM 1075 O LEU B 709 30.142 9.172 1.483 1.00 1.00 O ATOM 1076 CB LEU B 709 30.378 7.181 -1.156 1.00 1.00 C ATOM 1077 CG LEU B 709 29.931 8.553 -1.684 1.00 1.00 C ATOM 1078 CD1 LEU B 709 31.122 9.511 -1.742 1.00 1.00 C ATOM 1079 CD2 LEU B 709 29.348 8.390 -3.090 1.00 1.00 C ATOM 0 H LEU B 709 31.135 5.233 0.113 1.00 1.00 H new ATOM 0 HA LEU B 709 31.906 7.954 0.151 1.00 1.00 H new ATOM 0 HB2 LEU B 709 31.089 6.732 -1.850 1.00 1.00 H new ATOM 0 HB3 LEU B 709 29.521 6.510 -1.098 1.00 1.00 H new ATOM 0 HG LEU B 709 29.176 8.962 -1.012 1.00 1.00 H new ATOM 0 HD11 LEU B 709 30.792 10.479 -2.118 1.00 1.00 H new ATOM 0 HD12 LEU B 709 31.540 9.633 -0.743 1.00 1.00 H new ATOM 0 HD13 LEU B 709 31.884 9.104 -2.407 1.00 1.00 H new ATOM 0 HD21 LEU B 709 29.030 9.362 -3.467 1.00 1.00 H new ATOM 0 HD22 LEU B 709 30.107 7.974 -3.753 1.00 1.00 H new ATOM 0 HD23 LEU B 709 28.491 7.717 -3.053 1.00 1.00 H new ATOM 1091 N ALA B 710 29.096 7.197 1.693 1.00 1.00 N ATOM 1092 CA ALA B 710 28.100 7.718 2.620 1.00 1.00 C ATOM 1093 C ALA B 710 28.765 8.202 3.905 1.00 1.00 C ATOM 1094 O ALA B 710 28.354 9.203 4.492 1.00 1.00 O ATOM 1095 CB ALA B 710 27.078 6.631 2.952 1.00 1.00 C ATOM 0 H ALA B 710 28.996 6.206 1.472 1.00 1.00 H new ATOM 0 HA ALA B 710 27.595 8.560 2.146 1.00 1.00 H new ATOM 0 HB1 ALA B 710 26.337 7.028 3.646 1.00 1.00 H new ATOM 0 HB2 ALA B 710 26.582 6.306 2.037 1.00 1.00 H new ATOM 0 HB3 ALA B 710 27.586 5.782 3.410 1.00 1.00 H new ATOM 1101 N ALA B 711 29.791 7.488 4.340 1.00 1.00 N ATOM 1102 CA ALA B 711 30.496 7.855 5.558 1.00 1.00 C ATOM 1103 C ALA B 711 31.151 9.227 5.416 1.00 1.00 C ATOM 1104 O ALA B 711 31.167 10.015 6.365 1.00 1.00 O ATOM 1105 CB ALA B 711 31.563 6.808 5.880 1.00 1.00 C ATOM 0 H ALA B 711 30.152 6.657 3.872 1.00 1.00 H new ATOM 0 HA ALA B 711 29.771 7.898 6.371 1.00 1.00 H new ATOM 0 HB1 ALA B 711 32.086 7.091 6.794 1.00 1.00 H new ATOM 0 HB2 ALA B 711 31.089 5.836 6.019 1.00 1.00 H new ATOM 0 HB3 ALA B 711 32.276 6.750 5.057 1.00 1.00 H new ATOM 1111 N LEU B 712 31.685 9.508 4.232 1.00 1.00 N ATOM 1112 CA LEU B 712 32.337 10.792 3.991 1.00 1.00 C ATOM 1113 C LEU B 712 31.335 11.936 4.148 1.00 1.00 C ATOM 1114 O LEU B 712 31.638 12.953 4.771 1.00 1.00 O ATOM 1115 CB LEU B 712 32.933 10.816 2.578 1.00 1.00 C ATOM 1116 CG LEU B 712 33.602 12.174 2.296 1.00 1.00 C ATOM 1117 CD1 LEU B 712 34.685 12.457 3.341 1.00 1.00 C ATOM 1118 CD2 LEU B 712 34.236 12.138 0.904 1.00 1.00 C ATOM 0 H LEU B 712 31.680 8.874 3.433 1.00 1.00 H new ATOM 0 HA LEU B 712 33.135 10.921 4.722 1.00 1.00 H new ATOM 0 HB2 LEU B 712 33.665 10.015 2.472 1.00 1.00 H new ATOM 0 HB3 LEU B 712 32.149 10.631 1.843 1.00 1.00 H new ATOM 0 HG LEU B 712 32.851 12.962 2.344 1.00 1.00 H new ATOM 0 HD11 LEU B 712 35.151 13.420 3.131 1.00 1.00 H new ATOM 0 HD12 LEU B 712 34.235 12.480 4.334 1.00 1.00 H new ATOM 0 HD13 LEU B 712 35.441 11.673 3.303 1.00 1.00 H new ATOM 0 HD21 LEU B 712 34.712 13.096 0.696 1.00 1.00 H new ATOM 0 HD22 LEU B 712 34.983 11.345 0.865 1.00 1.00 H new ATOM 0 HD23 LEU B 712 33.465 11.947 0.158 1.00 1.00 H new ATOM 1130 N LEU B 713 30.139 11.757 3.591 1.00 1.00 N ATOM 1131 CA LEU B 713 29.099 12.776 3.691 1.00 1.00 C ATOM 1132 C LEU B 713 28.692 12.987 5.145 1.00 1.00 C ATOM 1133 O LEU B 713 28.495 14.119 5.585 1.00 1.00 O ATOM 1134 CB LEU B 713 27.868 12.383 2.859 1.00 1.00 C ATOM 1135 CG LEU B 713 28.042 12.787 1.381 1.00 1.00 C ATOM 1136 CD1 LEU B 713 27.839 14.297 1.217 1.00 1.00 C ATOM 1137 CD2 LEU B 713 29.437 12.406 0.874 1.00 1.00 C ATOM 0 H LEU B 713 29.868 10.923 3.070 1.00 1.00 H new ATOM 0 HA LEU B 713 29.505 13.708 3.298 1.00 1.00 H new ATOM 0 HB2 LEU B 713 27.707 11.307 2.928 1.00 1.00 H new ATOM 0 HB3 LEU B 713 26.980 12.865 3.268 1.00 1.00 H new ATOM 0 HG LEU B 713 27.294 12.253 0.795 1.00 1.00 H new ATOM 0 HD11 LEU B 713 27.965 14.569 0.169 1.00 1.00 H new ATOM 0 HD12 LEU B 713 26.835 14.567 1.544 1.00 1.00 H new ATOM 0 HD13 LEU B 713 28.573 14.831 1.821 1.00 1.00 H new ATOM 0 HD21 LEU B 713 29.537 12.700 -0.171 1.00 1.00 H new ATOM 0 HD22 LEU B 713 30.193 12.918 1.469 1.00 1.00 H new ATOM 0 HD23 LEU B 713 29.574 11.328 0.962 1.00 1.00 H new ATOM 1149 N ILE B 714 28.566 11.895 5.889 1.00 1.00 N ATOM 1150 CA ILE B 714 28.180 11.991 7.292 1.00 1.00 C ATOM 1151 C ILE B 714 29.237 12.748 8.080 1.00 1.00 C ATOM 1152 O ILE B 714 28.914 13.605 8.899 1.00 1.00 O ATOM 1153 CB ILE B 714 28.008 10.591 7.887 1.00 1.00 C ATOM 1154 CG1 ILE B 714 26.787 9.915 7.251 1.00 1.00 C ATOM 1155 CG2 ILE B 714 27.805 10.701 9.398 1.00 1.00 C ATOM 1156 CD1 ILE B 714 26.754 8.434 7.638 1.00 1.00 C ATOM 0 H ILE B 714 28.723 10.945 5.551 1.00 1.00 H new ATOM 0 HA ILE B 714 27.234 12.529 7.353 1.00 1.00 H new ATOM 0 HB ILE B 714 28.899 9.996 7.685 1.00 1.00 H new ATOM 0 HG12 ILE B 714 25.873 10.408 7.583 1.00 1.00 H new ATOM 0 HG13 ILE B 714 26.828 10.016 6.166 1.00 1.00 H new ATOM 0 HG21 ILE B 714 27.682 9.704 9.822 1.00 1.00 H new ATOM 0 HG22 ILE B 714 28.673 11.183 9.848 1.00 1.00 H new ATOM 0 HG23 ILE B 714 26.914 11.295 9.603 1.00 1.00 H new ATOM 0 HD11 ILE B 714 25.885 7.958 7.184 1.00 1.00 H new ATOM 0 HD12 ILE B 714 27.662 7.945 7.284 1.00 1.00 H new ATOM 0 HD13 ILE B 714 26.692 8.343 8.722 1.00 1.00 H new ATOM 1168 N TRP B 715 30.495 12.429 7.826 1.00 1.00 N ATOM 1169 CA TRP B 715 31.590 13.092 8.523 1.00 1.00 C ATOM 1170 C TRP B 715 31.552 14.593 8.207 1.00 1.00 C ATOM 1171 O TRP B 715 31.700 15.440 9.095 1.00 1.00 O ATOM 1172 CB TRP B 715 32.924 12.486 8.065 1.00 1.00 C ATOM 1173 CG TRP B 715 33.949 12.562 9.159 1.00 1.00 C ATOM 1174 CD1 TRP B 715 33.961 13.449 10.184 1.00 1.00 C ATOM 1175 CD2 TRP B 715 35.119 11.712 9.343 1.00 1.00 C ATOM 1176 NE1 TRP B 715 35.064 13.190 10.984 1.00 1.00 N ATOM 1177 CE2 TRP B 715 35.807 12.129 10.506 1.00 1.00 C ATOM 1178 CE3 TRP B 715 35.643 10.624 8.617 1.00 1.00 C ATOM 1179 CZ2 TRP B 715 36.975 11.490 10.934 1.00 1.00 C ATOM 1180 CZ3 TRP B 715 36.815 9.978 9.044 1.00 1.00 C ATOM 1181 CH2 TRP B 715 37.480 10.410 10.202 1.00 1.00 C ATOM 0 H TRP B 715 30.784 11.722 7.150 1.00 1.00 H new ATOM 0 HA TRP B 715 31.488 12.951 9.599 1.00 1.00 H new ATOM 0 HB2 TRP B 715 32.775 11.447 7.772 1.00 1.00 H new ATOM 0 HB3 TRP B 715 33.286 13.016 7.184 1.00 1.00 H new ATOM 0 HD1 TRP B 715 33.232 14.228 10.350 1.00 1.00 H new ATOM 0 HE1 TRP B 715 35.298 13.719 11.824 1.00 1.00 H new ATOM 0 HE3 TRP B 715 35.139 10.284 7.724 1.00 1.00 H new ATOM 0 HZ2 TRP B 715 37.484 11.828 11.824 1.00 1.00 H new ATOM 0 HZ3 TRP B 715 37.206 9.145 8.479 1.00 1.00 H new ATOM 0 HH2 TRP B 715 38.380 9.910 10.527 1.00 1.00 H new ATOM 1192 N LYS B 716 31.343 14.909 6.928 1.00 1.00 N ATOM 1193 CA LYS B 716 31.280 16.301 6.488 1.00 1.00 C ATOM 1194 C LYS B 716 30.147 17.016 7.225 1.00 1.00 C ATOM 1195 O LYS B 716 30.262 18.184 7.640 1.00 1.00 O ATOM 1196 CB LYS B 716 30.973 16.328 4.983 1.00 1.00 C ATOM 1197 CG LYS B 716 32.034 17.118 4.171 1.00 1.00 C ATOM 1198 CD LYS B 716 31.740 18.635 4.166 1.00 1.00 C ATOM 1199 CE LYS B 716 32.426 19.328 5.345 1.00 1.00 C ATOM 1200 NZ LYS B 716 32.300 20.804 5.180 1.00 1.00 N ATOM 0 H LYS B 716 31.215 14.224 6.184 1.00 1.00 H new ATOM 0 HA LYS B 716 32.229 16.795 6.696 1.00 1.00 H new ATOM 0 HB2 LYS B 716 30.921 15.306 4.608 1.00 1.00 H new ATOM 0 HB3 LYS B 716 29.992 16.776 4.824 1.00 1.00 H new ATOM 0 HG2 LYS B 716 33.022 16.941 4.595 1.00 1.00 H new ATOM 0 HG3 LYS B 716 32.056 16.749 3.146 1.00 1.00 H new ATOM 0 HD2 LYS B 716 32.086 19.073 3.230 1.00 1.00 H new ATOM 0 HD3 LYS B 716 30.664 18.801 4.217 1.00 1.00 H new ATOM 0 HE2 LYS B 716 31.970 19.014 6.284 1.00 1.00 H new ATOM 0 HE3 LYS B 716 33.477 19.042 5.390 1.00 1.00 H new ATOM 0 HZ1 LYS B 716 33.191 21.262 5.461 1.00 1.00 H new ATOM 0 HZ2 LYS B 716 32.095 21.026 4.185 1.00 1.00 H new ATOM 0 HZ3 LYS B 716 31.526 21.156 5.779 1.00 1.00 H new ATOM 1214 N LEU B 717 29.027 16.314 7.396 1.00 1.00 N ATOM 1215 CA LEU B 717 27.900 16.937 8.095 1.00 1.00 C ATOM 1216 C LEU B 717 28.261 17.231 9.549 1.00 1.00 C ATOM 1217 O LEU B 717 27.920 18.290 10.087 1.00 1.00 O ATOM 1218 CB LEU B 717 26.676 16.032 8.047 1.00 1.00 C ATOM 1219 CG LEU B 717 25.470 16.695 8.748 1.00 1.00 C ATOM 1220 CD1 LEU B 717 25.124 18.015 8.061 1.00 1.00 C ATOM 1221 CD2 LEU B 717 24.261 15.759 8.668 1.00 1.00 C ATOM 0 H LEU B 717 28.876 15.357 7.077 1.00 1.00 H new ATOM 0 HA LEU B 717 27.671 17.876 7.591 1.00 1.00 H new ATOM 0 HB2 LEU B 717 26.423 15.812 7.010 1.00 1.00 H new ATOM 0 HB3 LEU B 717 26.903 15.081 8.528 1.00 1.00 H new ATOM 0 HG LEU B 717 25.726 16.887 9.790 1.00 1.00 H new ATOM 0 HD11 LEU B 717 24.272 18.474 8.563 1.00 1.00 H new ATOM 0 HD12 LEU B 717 25.981 18.687 8.112 1.00 1.00 H new ATOM 0 HD13 LEU B 717 24.872 17.827 7.017 1.00 1.00 H new ATOM 0 HD21 LEU B 717 23.408 16.224 9.162 1.00 1.00 H new ATOM 0 HD22 LEU B 717 24.016 15.569 7.623 1.00 1.00 H new ATOM 0 HD23 LEU B 717 24.497 14.817 9.162 1.00 1.00 H new ATOM 1233 N LEU B 718 28.920 16.269 10.191 1.00 1.00 N ATOM 1234 CA LEU B 718 29.275 16.421 11.612 1.00 1.00 C ATOM 1235 C LEU B 718 30.248 17.591 11.861 1.00 1.00 C ATOM 1236 O LEU B 718 30.107 18.354 12.838 1.00 1.00 O ATOM 1237 CB LEU B 718 29.909 15.122 12.127 1.00 1.00 C ATOM 1238 CG LEU B 718 28.871 14.007 12.155 1.00 1.00 C ATOM 1239 CD1 LEU B 718 29.582 12.686 12.437 1.00 1.00 C ATOM 1240 CD2 LEU B 718 27.828 14.267 13.254 1.00 1.00 C ATOM 0 H LEU B 718 29.217 15.390 9.766 1.00 1.00 H new ATOM 0 HA LEU B 718 28.352 16.640 12.149 1.00 1.00 H new ATOM 0 HB2 LEU B 718 30.743 14.837 11.486 1.00 1.00 H new ATOM 0 HB3 LEU B 718 30.314 15.278 13.127 1.00 1.00 H new ATOM 0 HG LEU B 718 28.360 13.968 11.193 1.00 1.00 H new ATOM 0 HD11 LEU B 718 28.851 11.877 12.460 1.00 1.00 H new ATOM 0 HD12 LEU B 718 30.314 12.492 11.653 1.00 1.00 H new ATOM 0 HD13 LEU B 718 30.089 12.744 13.400 1.00 1.00 H new ATOM 0 HD21 LEU B 718 27.095 13.460 13.258 1.00 1.00 H new ATOM 0 HD22 LEU B 718 28.324 14.312 14.223 1.00 1.00 H new ATOM 0 HD23 LEU B 718 27.324 15.214 13.061 1.00 1.00 H new ATOM 1252 N ILE B 719 31.258 17.719 11.006 1.00 1.00 N ATOM 1253 CA ILE B 719 32.234 18.793 11.214 1.00 1.00 C ATOM 1254 C ILE B 719 31.577 20.143 10.942 1.00 1.00 C ATOM 1255 O ILE B 719 31.803 21.109 11.647 1.00 1.00 O ATOM 1256 CB ILE B 719 33.484 18.618 10.332 1.00 1.00 C ATOM 1257 CG1 ILE B 719 34.542 19.670 10.700 1.00 1.00 C ATOM 1258 CG2 ILE B 719 33.121 18.762 8.863 1.00 1.00 C ATOM 1259 CD1 ILE B 719 35.882 19.301 10.051 1.00 1.00 C ATOM 0 H ILE B 719 31.423 17.123 10.195 1.00 1.00 H new ATOM 0 HA ILE B 719 32.565 18.748 12.252 1.00 1.00 H new ATOM 0 HB ILE B 719 33.888 17.621 10.504 1.00 1.00 H new ATOM 0 HG12 ILE B 719 34.222 20.656 10.362 1.00 1.00 H new ATOM 0 HG13 ILE B 719 34.654 19.725 11.783 1.00 1.00 H new ATOM 0 HG21 ILE B 719 34.016 18.636 8.253 1.00 1.00 H new ATOM 0 HG22 ILE B 719 32.388 18.002 8.593 1.00 1.00 H new ATOM 0 HG23 ILE B 719 32.699 19.752 8.688 1.00 1.00 H new ATOM 0 HD11 ILE B 719 36.631 20.048 10.313 1.00 1.00 H new ATOM 0 HD12 ILE B 719 36.203 18.323 10.410 1.00 1.00 H new ATOM 0 HD13 ILE B 719 35.765 19.269 8.968 1.00 1.00 H new ATOM 1271 N THR B 720 30.731 20.189 9.927 1.00 1.00 N ATOM 1272 CA THR B 720 30.035 21.420 9.573 1.00 1.00 C ATOM 1273 C THR B 720 29.150 21.921 10.733 1.00 1.00 C ATOM 1274 O THR B 720 29.135 23.103 11.056 1.00 1.00 O ATOM 1275 CB THR B 720 29.179 21.202 8.321 1.00 1.00 C ATOM 1276 OG1 THR B 720 29.987 20.585 7.323 1.00 1.00 O ATOM 1277 CG2 THR B 720 28.632 22.555 7.837 1.00 1.00 C ATOM 0 H THR B 720 30.508 19.391 9.333 1.00 1.00 H new ATOM 0 HA THR B 720 30.788 22.181 9.369 1.00 1.00 H new ATOM 0 HB THR B 720 28.331 20.553 8.539 1.00 1.00 H new ATOM 0 HG1 THR B 720 29.844 19.616 7.340 1.00 1.00 H new ATOM 0 HG21 THR B 720 28.022 22.403 6.946 1.00 1.00 H new ATOM 0 HG22 THR B 720 28.022 23.003 8.622 1.00 1.00 H new ATOM 0 HG23 THR B 720 29.463 23.219 7.599 1.00 1.00 H new ATOM 1285 N ILE B 721 28.445 21.010 11.385 1.00 1.00 N ATOM 1286 CA ILE B 721 27.600 21.390 12.540 1.00 1.00 C ATOM 1287 C ILE B 721 28.466 21.973 13.680 1.00 1.00 C ATOM 1288 O ILE B 721 28.064 22.927 14.332 1.00 1.00 O ATOM 1289 CB ILE B 721 26.798 20.187 13.044 1.00 1.00 C ATOM 1290 CG1 ILE B 721 25.771 19.776 11.982 1.00 1.00 C ATOM 1291 CG2 ILE B 721 26.072 20.580 14.340 1.00 1.00 C ATOM 1292 CD1 ILE B 721 25.185 18.421 12.369 1.00 1.00 C ATOM 0 H ILE B 721 28.430 20.017 11.152 1.00 1.00 H new ATOM 0 HA ILE B 721 26.900 22.157 12.209 1.00 1.00 H new ATOM 0 HB ILE B 721 27.468 19.349 13.237 1.00 1.00 H new ATOM 0 HG12 ILE B 721 24.981 20.523 11.911 1.00 1.00 H new ATOM 0 HG13 ILE B 721 26.244 19.718 11.002 1.00 1.00 H new ATOM 0 HG21 ILE B 721 25.498 19.730 14.707 1.00 1.00 H new ATOM 0 HG22 ILE B 721 26.804 20.876 15.092 1.00 1.00 H new ATOM 0 HG23 ILE B 721 25.399 21.414 14.141 1.00 1.00 H new ATOM 0 HD11 ILE B 721 24.452 18.115 11.622 1.00 1.00 H new ATOM 0 HD12 ILE B 721 25.983 17.680 12.419 1.00 1.00 H new ATOM 0 HD13 ILE B 721 24.701 18.499 13.342 1.00 1.00 H new ATOM 1304 N HIS B 722 29.616 21.373 13.963 1.00 1.00 N ATOM 1305 CA HIS B 722 30.478 21.876 15.066 1.00 1.00 C ATOM 1306 C HIS B 722 31.044 23.241 14.708 1.00 1.00 C ATOM 1307 O HIS B 722 31.158 24.113 15.566 1.00 1.00 O ATOM 1308 CB HIS B 722 31.632 20.914 15.355 1.00 1.00 C ATOM 1309 CG HIS B 722 31.123 19.734 16.121 1.00 1.00 C ATOM 1310 ND1 HIS B 722 30.532 18.649 15.499 1.00 1.00 N ATOM 1311 CD2 HIS B 722 31.131 19.450 17.454 1.00 1.00 C ATOM 1312 CE1 HIS B 722 30.210 17.768 16.463 1.00 1.00 C ATOM 1313 NE2 HIS B 722 30.555 18.213 17.677 1.00 1.00 N ATOM 0 H HIS B 722 29.981 20.558 13.469 1.00 1.00 H new ATOM 0 HA HIS B 722 29.858 21.954 15.959 1.00 1.00 H new ATOM 0 HB2 HIS B 722 32.087 20.585 14.421 1.00 1.00 H new ATOM 0 HB3 HIS B 722 32.409 21.423 15.926 1.00 1.00 H new ATOM 0 HD1 HIS B 722 30.371 18.538 14.498 1.00 1.00 H new ATOM 0 HD2 HIS B 722 31.529 20.096 18.223 1.00 1.00 H new ATOM 0 HE1 HIS B 722 29.731 16.817 16.280 1.00 1.00 H new ATOM 1321 N ASP B 723 31.393 23.432 13.434 1.00 1.00 N ATOM 1322 CA ASP B 723 31.938 24.725 12.992 1.00 1.00 C ATOM 1323 C ASP B 723 30.913 25.854 13.159 1.00 1.00 C ATOM 1324 O ASP B 723 31.261 26.977 13.535 1.00 1.00 O ATOM 1325 CB ASP B 723 32.337 24.638 11.526 1.00 1.00 C ATOM 1326 CG ASP B 723 33.742 24.063 11.391 1.00 1.00 C ATOM 1327 OD1 ASP B 723 34.395 23.862 12.405 1.00 1.00 O ATOM 1328 OD2 ASP B 723 34.144 23.830 10.265 1.00 1.00 O ATOM 0 H ASP B 723 31.312 22.727 12.701 1.00 1.00 H new ATOM 0 HA ASP B 723 32.806 24.949 13.612 1.00 1.00 H new ATOM 0 HB2 ASP B 723 31.627 24.011 10.986 1.00 1.00 H new ATOM 0 HB3 ASP B 723 32.297 25.628 11.072 1.00 1.00 H new