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 78:sc= 0.843 USER MOD Single : A 987 MET CE :methyl -133:sc= 0 (180deg=-0.406) 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= 1.02 USER MOD Single : B 701 MET CE :methyl 155:sc= -0.151 (180deg=-0.91) USER MOD Single : B 716 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 720 THR OG1 : rot 79:sc= 0.935 USER MOD Single : B 722 HIS : no HE2:sc= 1.04 K(o=1,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 136 N ILE A 966 32.844 -19.185 -1.296 1.00 1.00 N ATOM 137 CA ILE A 966 32.606 -17.994 -0.488 1.00 1.00 C ATOM 138 C ILE A 966 33.847 -17.107 -0.458 1.00 1.00 C ATOM 139 O ILE A 966 33.772 -15.918 -0.142 1.00 1.00 O ATOM 140 CB ILE A 966 32.232 -18.397 0.940 1.00 1.00 C ATOM 141 CG1 ILE A 966 30.894 -19.140 0.925 1.00 1.00 C ATOM 142 CG2 ILE A 966 32.112 -17.141 1.805 1.00 1.00 C ATOM 143 CD1 ILE A 966 30.650 -19.789 2.290 1.00 1.00 C ATOM 0 HA ILE A 966 31.784 -17.435 -0.936 1.00 1.00 H new ATOM 0 HB ILE A 966 33.003 -19.049 1.351 1.00 1.00 H new ATOM 0 HG12 ILE A 966 30.085 -18.448 0.691 1.00 1.00 H new ATOM 0 HG13 ILE A 966 30.898 -19.901 0.145 1.00 1.00 H new ATOM 0 HG21 ILE A 966 31.846 -17.425 2.823 1.00 1.00 H new ATOM 0 HG22 ILE A 966 33.065 -16.612 1.813 1.00 1.00 H new ATOM 0 HG23 ILE A 966 31.340 -16.490 1.396 1.00 1.00 H new ATOM 0 HD11 ILE A 966 29.697 -20.317 2.276 1.00 1.00 H new ATOM 0 HD12 ILE A 966 31.453 -20.494 2.506 1.00 1.00 H new ATOM 0 HD13 ILE A 966 30.627 -19.018 3.060 1.00 1.00 H new ATOM 155 N TRP A 967 34.992 -17.705 -0.760 1.00 1.00 N ATOM 156 CA TRP A 967 36.258 -16.984 -0.742 1.00 1.00 C ATOM 157 C TRP A 967 36.225 -15.772 -1.671 1.00 1.00 C ATOM 158 O TRP A 967 36.811 -14.737 -1.354 1.00 1.00 O ATOM 159 CB TRP A 967 37.393 -17.918 -1.165 1.00 1.00 C ATOM 160 CG TRP A 967 37.611 -18.950 -0.106 1.00 1.00 C ATOM 161 CD1 TRP A 967 37.200 -20.237 -0.179 1.00 1.00 C ATOM 162 CD2 TRP A 967 38.284 -18.807 1.178 1.00 1.00 C ATOM 163 NE1 TRP A 967 37.578 -20.892 0.979 1.00 1.00 N ATOM 164 CE2 TRP A 967 38.248 -20.054 1.847 1.00 1.00 C ATOM 165 CE3 TRP A 967 38.915 -17.727 1.821 1.00 1.00 C ATOM 166 CZ2 TRP A 967 38.819 -20.222 3.108 1.00 1.00 C ATOM 167 CZ3 TRP A 967 39.490 -17.894 3.092 1.00 1.00 C ATOM 168 CH2 TRP A 967 39.442 -19.139 3.734 1.00 1.00 C ATOM 0 H TRP A 967 35.070 -18.688 -1.021 1.00 1.00 H new ATOM 0 HA TRP A 967 36.426 -16.630 0.275 1.00 1.00 H new ATOM 0 HB2 TRP A 967 37.148 -18.399 -2.112 1.00 1.00 H new ATOM 0 HB3 TRP A 967 38.308 -17.347 -1.325 1.00 1.00 H new ATOM 0 HD1 TRP A 967 36.665 -20.680 -1.006 1.00 1.00 H new ATOM 0 HE1 TRP A 967 37.385 -21.875 1.169 1.00 1.00 H new ATOM 0 HE3 TRP A 967 38.958 -16.764 1.335 1.00 1.00 H new ATOM 0 HZ2 TRP A 967 38.780 -21.184 3.598 1.00 1.00 H new ATOM 0 HZ3 TRP A 967 39.972 -17.058 3.577 1.00 1.00 H new ATOM 0 HH2 TRP A 967 39.886 -19.261 4.711 1.00 1.00 H new ATOM 179 N TRP A 968 35.554 -15.898 -2.815 1.00 1.00 N ATOM 180 CA TRP A 968 35.486 -14.787 -3.767 1.00 1.00 C ATOM 181 C TRP A 968 34.881 -13.546 -3.109 1.00 1.00 C ATOM 182 O TRP A 968 35.350 -12.427 -3.322 1.00 1.00 O ATOM 183 CB TRP A 968 34.642 -15.191 -4.973 1.00 1.00 C ATOM 184 CG TRP A 968 35.387 -16.204 -5.778 1.00 1.00 C ATOM 185 CD1 TRP A 968 35.209 -17.540 -5.694 1.00 1.00 C ATOM 186 CD2 TRP A 968 36.418 -15.990 -6.785 1.00 1.00 C ATOM 187 NE1 TRP A 968 36.066 -18.162 -6.583 1.00 1.00 N ATOM 188 CE2 TRP A 968 36.831 -17.249 -7.280 1.00 1.00 C ATOM 189 CE3 TRP A 968 37.028 -14.837 -7.311 1.00 1.00 C ATOM 190 CZ2 TRP A 968 37.816 -17.361 -8.262 1.00 1.00 C ATOM 191 CZ3 TRP A 968 38.019 -14.946 -8.301 1.00 1.00 C ATOM 192 CH2 TRP A 968 38.411 -16.205 -8.775 1.00 1.00 C ATOM 0 H TRP A 968 35.058 -16.741 -3.103 1.00 1.00 H new ATOM 0 HA TRP A 968 36.499 -14.549 -4.093 1.00 1.00 H new ATOM 0 HB2 TRP A 968 33.688 -15.602 -4.643 1.00 1.00 H new ATOM 0 HB3 TRP A 968 34.418 -14.317 -5.584 1.00 1.00 H new ATOM 0 HD1 TRP A 968 34.511 -18.041 -5.039 1.00 1.00 H new ATOM 0 HE1 TRP A 968 36.126 -19.173 -6.708 1.00 1.00 H new ATOM 0 HE3 TRP A 968 36.733 -13.862 -6.952 1.00 1.00 H new ATOM 0 HZ2 TRP A 968 38.116 -18.334 -8.623 1.00 1.00 H new ATOM 0 HZ3 TRP A 968 38.481 -14.055 -8.699 1.00 1.00 H new ATOM 0 HH2 TRP A 968 39.173 -16.282 -9.537 1.00 1.00 H new ATOM 203 N VAL A 969 33.851 -13.752 -2.302 1.00 1.00 N ATOM 204 CA VAL A 969 33.205 -12.648 -1.601 1.00 1.00 C ATOM 205 C VAL A 969 34.151 -12.022 -0.579 1.00 1.00 C ATOM 206 O VAL A 969 34.205 -10.801 -0.432 1.00 1.00 O ATOM 207 CB VAL A 969 31.933 -13.126 -0.899 1.00 1.00 C ATOM 208 CG1 VAL A 969 31.425 -12.027 0.035 1.00 1.00 C ATOM 209 CG2 VAL A 969 30.857 -13.423 -1.947 1.00 1.00 C ATOM 0 H VAL A 969 33.445 -14.669 -2.116 1.00 1.00 H new ATOM 0 HA VAL A 969 32.941 -11.894 -2.342 1.00 1.00 H new ATOM 0 HB VAL A 969 32.152 -14.027 -0.326 1.00 1.00 H new ATOM 0 HG11 VAL A 969 30.518 -12.366 0.536 1.00 1.00 H new ATOM 0 HG12 VAL A 969 32.188 -11.801 0.779 1.00 1.00 H new ATOM 0 HG13 VAL A 969 31.206 -11.130 -0.544 1.00 1.00 H new ATOM 0 HG21 VAL A 969 29.949 -13.764 -1.450 1.00 1.00 H new ATOM 0 HG22 VAL A 969 30.642 -12.517 -2.514 1.00 1.00 H new ATOM 0 HG23 VAL A 969 31.213 -14.199 -2.624 1.00 1.00 H new ATOM 219 N LEU A 970 34.865 -12.871 0.153 1.00 1.00 N ATOM 220 CA LEU A 970 35.774 -12.397 1.196 1.00 1.00 C ATOM 221 C LEU A 970 36.893 -11.518 0.636 1.00 1.00 C ATOM 222 O LEU A 970 37.218 -10.486 1.224 1.00 1.00 O ATOM 223 CB LEU A 970 36.390 -13.593 1.925 1.00 1.00 C ATOM 224 CG LEU A 970 35.314 -14.307 2.754 1.00 1.00 C ATOM 225 CD1 LEU A 970 35.880 -15.620 3.296 1.00 1.00 C ATOM 226 CD2 LEU A 970 34.867 -13.423 3.928 1.00 1.00 C ATOM 0 H LEU A 970 34.834 -13.885 0.046 1.00 1.00 H new ATOM 0 HA LEU A 970 35.188 -11.790 1.886 1.00 1.00 H new ATOM 0 HB2 LEU A 970 36.825 -14.285 1.204 1.00 1.00 H new ATOM 0 HB3 LEU A 970 37.199 -13.258 2.574 1.00 1.00 H new ATOM 0 HG LEU A 970 34.453 -14.508 2.116 1.00 1.00 H new ATOM 0 HD11 LEU A 970 35.117 -16.129 3.885 1.00 1.00 H new ATOM 0 HD12 LEU A 970 36.181 -16.257 2.464 1.00 1.00 H new ATOM 0 HD13 LEU A 970 36.745 -15.411 3.925 1.00 1.00 H new ATOM 0 HD21 LEU A 970 34.104 -13.944 4.506 1.00 1.00 H new ATOM 0 HD22 LEU A 970 35.723 -13.208 4.568 1.00 1.00 H new ATOM 0 HD23 LEU A 970 34.457 -12.489 3.544 1.00 1.00 H new ATOM 238 N VAL A 971 37.484 -11.905 -0.491 1.00 1.00 N ATOM 239 CA VAL A 971 38.557 -11.096 -1.067 1.00 1.00 C ATOM 240 C VAL A 971 38.019 -9.735 -1.497 1.00 1.00 C ATOM 241 O VAL A 971 38.660 -8.708 -1.275 1.00 1.00 O ATOM 242 CB VAL A 971 39.218 -11.811 -2.251 1.00 1.00 C ATOM 243 CG1 VAL A 971 40.000 -13.022 -1.739 1.00 1.00 C ATOM 244 CG2 VAL A 971 38.151 -12.290 -3.232 1.00 1.00 C ATOM 0 H VAL A 971 37.248 -12.749 -1.013 1.00 1.00 H new ATOM 0 HA VAL A 971 39.318 -10.948 -0.301 1.00 1.00 H new ATOM 0 HB VAL A 971 39.890 -11.117 -2.755 1.00 1.00 H new ATOM 0 HG11 VAL A 971 40.471 -13.532 -2.579 1.00 1.00 H new ATOM 0 HG12 VAL A 971 40.767 -12.690 -1.039 1.00 1.00 H new ATOM 0 HG13 VAL A 971 39.320 -13.707 -1.233 1.00 1.00 H new ATOM 0 HG21 VAL A 971 38.629 -12.797 -4.070 1.00 1.00 H new ATOM 0 HG22 VAL A 971 37.476 -12.981 -2.727 1.00 1.00 H new ATOM 0 HG23 VAL A 971 37.585 -11.434 -3.600 1.00 1.00 H new ATOM 254 N GLY A 972 36.832 -9.729 -2.097 1.00 1.00 N ATOM 255 CA GLY A 972 36.220 -8.480 -2.532 1.00 1.00 C ATOM 256 C GLY A 972 35.914 -7.598 -1.327 1.00 1.00 C ATOM 257 O GLY A 972 36.073 -6.377 -1.376 1.00 1.00 O ATOM 0 H GLY A 972 36.281 -10.565 -2.291 1.00 1.00 H new ATOM 0 HA2 GLY A 972 36.889 -7.957 -3.215 1.00 1.00 H new ATOM 0 HA3 GLY A 972 35.302 -8.688 -3.082 1.00 1.00 H new ATOM 261 N VAL A 973 35.479 -8.230 -0.243 1.00 1.00 N ATOM 262 CA VAL A 973 35.156 -7.509 0.981 1.00 1.00 C ATOM 263 C VAL A 973 36.400 -6.836 1.548 1.00 1.00 C ATOM 264 O VAL A 973 36.361 -5.676 1.961 1.00 1.00 O ATOM 265 CB VAL A 973 34.572 -8.471 2.017 1.00 1.00 C ATOM 266 CG1 VAL A 973 34.433 -7.752 3.361 1.00 1.00 C ATOM 267 CG2 VAL A 973 33.196 -8.948 1.550 1.00 1.00 C ATOM 0 H VAL A 973 35.342 -9.239 -0.187 1.00 1.00 H new ATOM 0 HA VAL A 973 34.418 -6.742 0.746 1.00 1.00 H new ATOM 0 HB VAL A 973 35.235 -9.328 2.131 1.00 1.00 H new ATOM 0 HG11 VAL A 973 34.017 -8.438 4.099 1.00 1.00 H new ATOM 0 HG12 VAL A 973 35.413 -7.411 3.694 1.00 1.00 H new ATOM 0 HG13 VAL A 973 33.770 -6.894 3.248 1.00 1.00 H new ATOM 0 HG21 VAL A 973 32.779 -9.634 2.288 1.00 1.00 H new ATOM 0 HG22 VAL A 973 32.533 -8.090 1.436 1.00 1.00 H new ATOM 0 HG23 VAL A 973 33.294 -9.460 0.593 1.00 1.00 H new ATOM 277 N LEU A 974 37.503 -7.573 1.567 1.00 1.00 N ATOM 278 CA LEU A 974 38.756 -7.041 2.087 1.00 1.00 C ATOM 279 C LEU A 974 39.219 -5.852 1.250 1.00 1.00 C ATOM 280 O LEU A 974 39.690 -4.852 1.787 1.00 1.00 O ATOM 281 CB LEU A 974 39.831 -8.130 2.072 1.00 1.00 C ATOM 282 CG LEU A 974 39.498 -9.199 3.119 1.00 1.00 C ATOM 283 CD1 LEU A 974 40.443 -10.389 2.948 1.00 1.00 C ATOM 284 CD2 LEU A 974 39.651 -8.627 4.536 1.00 1.00 C ATOM 0 H LEU A 974 37.556 -8.535 1.231 1.00 1.00 H new ATOM 0 HA LEU A 974 38.592 -6.708 3.112 1.00 1.00 H new ATOM 0 HB2 LEU A 974 39.890 -8.583 1.082 1.00 1.00 H new ATOM 0 HB3 LEU A 974 40.808 -7.693 2.282 1.00 1.00 H new ATOM 0 HG LEU A 974 38.466 -9.521 2.978 1.00 1.00 H new ATOM 0 HD11 LEU A 974 40.208 -11.150 3.692 1.00 1.00 H new ATOM 0 HD12 LEU A 974 40.323 -10.808 1.949 1.00 1.00 H new ATOM 0 HD13 LEU A 974 41.473 -10.058 3.081 1.00 1.00 H new ATOM 0 HD21 LEU A 974 39.411 -9.398 5.268 1.00 1.00 H new ATOM 0 HD22 LEU A 974 40.678 -8.293 4.685 1.00 1.00 H new ATOM 0 HD23 LEU A 974 38.973 -7.783 4.663 1.00 1.00 H new ATOM 296 N GLY A 975 39.084 -5.969 -0.068 1.00 1.00 N ATOM 297 CA GLY A 975 39.503 -4.896 -0.963 1.00 1.00 C ATOM 298 C GLY A 975 38.715 -3.619 -0.685 1.00 1.00 C ATOM 299 O GLY A 975 39.266 -2.520 -0.730 1.00 1.00 O ATOM 0 H GLY A 975 38.692 -6.787 -0.536 1.00 1.00 H new ATOM 0 HA2 GLY A 975 40.569 -4.706 -0.836 1.00 1.00 H new ATOM 0 HA3 GLY A 975 39.355 -5.202 -1.999 1.00 1.00 H new ATOM 303 N GLY A 976 37.429 -3.769 -0.390 1.00 1.00 N ATOM 304 CA GLY A 976 36.592 -2.612 -0.097 1.00 1.00 C ATOM 305 C GLY A 976 37.092 -1.904 1.159 1.00 1.00 C ATOM 306 O GLY A 976 37.081 -0.675 1.239 1.00 1.00 O ATOM 0 H GLY A 976 36.948 -4.668 -0.348 1.00 1.00 H new ATOM 0 HA2 GLY A 976 36.604 -1.922 -0.941 1.00 1.00 H new ATOM 0 HA3 GLY A 976 35.558 -2.928 0.042 1.00 1.00 H new ATOM 310 N LEU A 977 37.534 -2.695 2.133 1.00 1.00 N ATOM 311 CA LEU A 977 38.046 -2.147 3.386 1.00 1.00 C ATOM 312 C LEU A 977 39.291 -1.300 3.126 1.00 1.00 C ATOM 313 O LEU A 977 39.451 -0.223 3.698 1.00 1.00 O ATOM 314 CB LEU A 977 38.384 -3.290 4.353 1.00 1.00 C ATOM 315 CG LEU A 977 38.946 -2.735 5.670 1.00 1.00 C ATOM 316 CD1 LEU A 977 37.940 -1.771 6.304 1.00 1.00 C ATOM 317 CD2 LEU A 977 39.208 -3.895 6.634 1.00 1.00 C ATOM 0 H LEU A 977 37.548 -3.714 2.080 1.00 1.00 H new ATOM 0 HA LEU A 977 37.279 -1.513 3.832 1.00 1.00 H new ATOM 0 HB2 LEU A 977 37.490 -3.881 4.553 1.00 1.00 H new ATOM 0 HB3 LEU A 977 39.112 -3.959 3.894 1.00 1.00 H new ATOM 0 HG LEU A 977 39.875 -2.202 5.467 1.00 1.00 H new ATOM 0 HD11 LEU A 977 38.347 -1.382 7.237 1.00 1.00 H new ATOM 0 HD12 LEU A 977 37.747 -0.944 5.620 1.00 1.00 H new ATOM 0 HD13 LEU A 977 37.008 -2.299 6.506 1.00 1.00 H new ATOM 0 HD21 LEU A 977 39.607 -3.506 7.571 1.00 1.00 H new ATOM 0 HD22 LEU A 977 38.275 -4.424 6.829 1.00 1.00 H new ATOM 0 HD23 LEU A 977 39.929 -4.582 6.190 1.00 1.00 H new ATOM 329 N LEU A 978 40.169 -1.798 2.260 1.00 1.00 N ATOM 330 CA LEU A 978 41.398 -1.080 1.932 1.00 1.00 C ATOM 331 C LEU A 978 41.079 0.257 1.272 1.00 1.00 C ATOM 332 O LEU A 978 41.734 1.261 1.548 1.00 1.00 O ATOM 333 CB LEU A 978 42.295 -1.905 0.993 1.00 1.00 C ATOM 334 CG LEU A 978 43.160 -2.908 1.781 1.00 1.00 C ATOM 335 CD1 LEU A 978 42.308 -4.071 2.292 1.00 1.00 C ATOM 336 CD2 LEU A 978 44.250 -3.457 0.858 1.00 1.00 C ATOM 0 H LEU A 978 40.055 -2.688 1.776 1.00 1.00 H new ATOM 0 HA LEU A 978 41.932 -0.908 2.867 1.00 1.00 H new ATOM 0 HB2 LEU A 978 41.676 -2.442 0.274 1.00 1.00 H new ATOM 0 HB3 LEU A 978 42.939 -1.236 0.422 1.00 1.00 H new ATOM 0 HG LEU A 978 43.604 -2.396 2.635 1.00 1.00 H new ATOM 0 HD11 LEU A 978 42.938 -4.768 2.846 1.00 1.00 H new ATOM 0 HD12 LEU A 978 41.526 -3.688 2.948 1.00 1.00 H new ATOM 0 HD13 LEU A 978 41.852 -4.587 1.447 1.00 1.00 H new ATOM 0 HD21 LEU A 978 44.868 -4.168 1.407 1.00 1.00 H new ATOM 0 HD22 LEU A 978 43.788 -3.959 0.008 1.00 1.00 H new ATOM 0 HD23 LEU A 978 44.872 -2.636 0.501 1.00 1.00 H new ATOM 348 N LEU A 979 40.084 0.269 0.393 1.00 1.00 N ATOM 349 CA LEU A 979 39.718 1.498 -0.301 1.00 1.00 C ATOM 350 C LEU A 979 39.286 2.566 0.698 1.00 1.00 C ATOM 351 O LEU A 979 39.712 3.719 0.606 1.00 1.00 O ATOM 352 CB LEU A 979 38.563 1.203 -1.270 1.00 1.00 C ATOM 353 CG LEU A 979 38.119 2.487 -1.996 1.00 1.00 C ATOM 354 CD1 LEU A 979 37.314 2.111 -3.239 1.00 1.00 C ATOM 355 CD2 LEU A 979 37.241 3.369 -1.090 1.00 1.00 C ATOM 0 H LEU A 979 39.523 -0.546 0.146 1.00 1.00 H new ATOM 0 HA LEU A 979 40.583 1.867 -0.853 1.00 1.00 H new ATOM 0 HB2 LEU A 979 38.876 0.456 -2.000 1.00 1.00 H new ATOM 0 HB3 LEU A 979 37.721 0.780 -0.722 1.00 1.00 H new ATOM 0 HG LEU A 979 39.013 3.047 -2.268 1.00 1.00 H new ATOM 0 HD11 LEU A 979 36.998 3.017 -3.756 1.00 1.00 H new ATOM 0 HD12 LEU A 979 37.933 1.511 -3.906 1.00 1.00 H new ATOM 0 HD13 LEU A 979 36.436 1.537 -2.944 1.00 1.00 H new ATOM 0 HD21 LEU A 979 36.945 4.267 -1.633 1.00 1.00 H new ATOM 0 HD22 LEU A 979 36.351 2.814 -0.794 1.00 1.00 H new ATOM 0 HD23 LEU A 979 37.805 3.652 -0.201 1.00 1.00 H new ATOM 367 N LEU A 980 38.455 2.178 1.656 1.00 1.00 N ATOM 368 CA LEU A 980 37.991 3.116 2.671 1.00 1.00 C ATOM 369 C LEU A 980 39.169 3.602 3.515 1.00 1.00 C ATOM 370 O LEU A 980 39.268 4.783 3.849 1.00 1.00 O ATOM 371 CB LEU A 980 36.946 2.438 3.566 1.00 1.00 C ATOM 372 CG LEU A 980 36.405 3.431 4.604 1.00 1.00 C ATOM 373 CD1 LEU A 980 35.733 4.612 3.898 1.00 1.00 C ATOM 374 CD2 LEU A 980 35.377 2.723 5.489 1.00 1.00 C ATOM 0 H LEU A 980 38.091 1.230 1.752 1.00 1.00 H new ATOM 0 HA LEU A 980 37.535 3.975 2.179 1.00 1.00 H new ATOM 0 HB2 LEU A 980 36.127 2.058 2.956 1.00 1.00 H new ATOM 0 HB3 LEU A 980 37.392 1.581 4.071 1.00 1.00 H new ATOM 0 HG LEU A 980 37.231 3.799 5.213 1.00 1.00 H new ATOM 0 HD11 LEU A 980 35.352 5.312 4.642 1.00 1.00 H new ATOM 0 HD12 LEU A 980 36.460 5.118 3.263 1.00 1.00 H new ATOM 0 HD13 LEU A 980 34.908 4.248 3.286 1.00 1.00 H new ATOM 0 HD21 LEU A 980 34.989 3.424 6.228 1.00 1.00 H new ATOM 0 HD22 LEU A 980 34.557 2.356 4.872 1.00 1.00 H new ATOM 0 HD23 LEU A 980 35.851 1.884 5.998 1.00 1.00 H new ATOM 386 N THR A 981 40.044 2.667 3.865 1.00 1.00 N ATOM 387 CA THR A 981 41.211 2.968 4.688 1.00 1.00 C ATOM 388 C THR A 981 42.160 3.953 4.007 1.00 1.00 C ATOM 389 O THR A 981 42.665 4.874 4.647 1.00 1.00 O ATOM 390 CB THR A 981 41.967 1.674 5.003 1.00 1.00 C ATOM 391 OG1 THR A 981 41.130 0.812 5.760 1.00 1.00 O ATOM 392 CG2 THR A 981 43.228 1.999 5.807 1.00 1.00 C ATOM 0 H THR A 981 39.967 1.688 3.590 1.00 1.00 H new ATOM 0 HA THR A 981 40.851 3.432 5.606 1.00 1.00 H new ATOM 0 HB THR A 981 42.250 1.182 4.072 1.00 1.00 H new ATOM 0 HG1 THR A 981 40.484 0.378 5.165 1.00 1.00 H new ATOM 0 HG21 THR A 981 43.765 1.077 6.030 1.00 1.00 H new ATOM 0 HG22 THR A 981 43.870 2.661 5.225 1.00 1.00 H new ATOM 0 HG23 THR A 981 42.949 2.491 6.739 1.00 1.00 H new ATOM 400 N ILE A 982 42.428 3.743 2.721 1.00 1.00 N ATOM 401 CA ILE A 982 43.352 4.616 2.001 1.00 1.00 C ATOM 402 C ILE A 982 42.838 6.051 1.936 1.00 1.00 C ATOM 403 O ILE A 982 43.602 6.992 2.161 1.00 1.00 O ATOM 404 CB ILE A 982 43.575 4.088 0.582 1.00 1.00 C ATOM 405 CG1 ILE A 982 44.354 2.772 0.647 1.00 1.00 C ATOM 406 CG2 ILE A 982 44.373 5.114 -0.223 1.00 1.00 C ATOM 407 CD1 ILE A 982 44.329 2.095 -0.724 1.00 1.00 C ATOM 0 H ILE A 982 42.027 2.989 2.163 1.00 1.00 H new ATOM 0 HA ILE A 982 44.295 4.618 2.547 1.00 1.00 H new ATOM 0 HB ILE A 982 42.612 3.918 0.100 1.00 1.00 H new ATOM 0 HG12 ILE A 982 45.383 2.961 0.952 1.00 1.00 H new ATOM 0 HG13 ILE A 982 43.915 2.114 1.397 1.00 1.00 H new ATOM 0 HG21 ILE A 982 44.532 4.739 -1.234 1.00 1.00 H new ATOM 0 HG22 ILE A 982 43.820 6.052 -0.267 1.00 1.00 H new ATOM 0 HG23 ILE A 982 45.337 5.283 0.257 1.00 1.00 H new ATOM 0 HD11 ILE A 982 44.884 1.158 -0.677 1.00 1.00 H new ATOM 0 HD12 ILE A 982 43.297 1.892 -1.011 1.00 1.00 H new ATOM 0 HD13 ILE A 982 44.788 2.752 -1.463 1.00 1.00 H new ATOM 419 N LEU A 983 41.554 6.229 1.641 1.00 1.00 N ATOM 420 CA LEU A 983 40.998 7.576 1.573 1.00 1.00 C ATOM 421 C LEU A 983 41.080 8.247 2.938 1.00 1.00 C ATOM 422 O LEU A 983 41.423 9.424 3.047 1.00 1.00 O ATOM 423 CB LEU A 983 39.537 7.535 1.114 1.00 1.00 C ATOM 424 CG LEU A 983 39.460 7.110 -0.360 1.00 1.00 C ATOM 425 CD1 LEU A 983 37.996 6.907 -0.758 1.00 1.00 C ATOM 426 CD2 LEU A 983 40.085 8.186 -1.258 1.00 1.00 C ATOM 0 H LEU A 983 40.892 5.477 1.449 1.00 1.00 H new ATOM 0 HA LEU A 983 41.580 8.148 0.851 1.00 1.00 H new ATOM 0 HB2 LEU A 983 38.973 6.837 1.732 1.00 1.00 H new ATOM 0 HB3 LEU A 983 39.079 8.516 1.242 1.00 1.00 H new ATOM 0 HG LEU A 983 40.010 6.178 -0.486 1.00 1.00 H new ATOM 0 HD11 LEU A 983 37.942 6.605 -1.804 1.00 1.00 H new ATOM 0 HD12 LEU A 983 37.553 6.131 -0.133 1.00 1.00 H new ATOM 0 HD13 LEU A 983 37.449 7.840 -0.620 1.00 1.00 H new ATOM 0 HD21 LEU A 983 40.023 7.871 -2.300 1.00 1.00 H new ATOM 0 HD22 LEU A 983 39.546 9.125 -1.130 1.00 1.00 H new ATOM 0 HD23 LEU A 983 41.130 8.327 -0.983 1.00 1.00 H new ATOM 438 N VAL A 984 40.766 7.482 3.978 1.00 1.00 N ATOM 439 CA VAL A 984 40.806 7.997 5.341 1.00 1.00 C ATOM 440 C VAL A 984 42.226 8.377 5.745 1.00 1.00 C ATOM 441 O VAL A 984 42.450 9.424 6.353 1.00 1.00 O ATOM 442 CB VAL A 984 40.262 6.944 6.309 1.00 1.00 C ATOM 443 CG1 VAL A 984 40.487 7.409 7.749 1.00 1.00 C ATOM 444 CG2 VAL A 984 38.762 6.754 6.066 1.00 1.00 C ATOM 0 H VAL A 984 40.482 6.505 3.903 1.00 1.00 H new ATOM 0 HA VAL A 984 40.186 8.892 5.383 1.00 1.00 H new ATOM 0 HB VAL A 984 40.781 5.999 6.146 1.00 1.00 H new ATOM 0 HG11 VAL A 984 40.099 6.659 8.438 1.00 1.00 H new ATOM 0 HG12 VAL A 984 41.554 7.546 7.924 1.00 1.00 H new ATOM 0 HG13 VAL A 984 39.968 8.354 7.912 1.00 1.00 H new ATOM 0 HG21 VAL A 984 38.374 6.004 6.755 1.00 1.00 H new ATOM 0 HG22 VAL A 984 38.244 7.699 6.229 1.00 1.00 H new ATOM 0 HG23 VAL A 984 38.599 6.423 5.040 1.00 1.00 H new ATOM 454 N LEU A 985 43.183 7.513 5.423 1.00 1.00 N ATOM 455 CA LEU A 985 44.573 7.765 5.783 1.00 1.00 C ATOM 456 C LEU A 985 45.100 9.032 5.116 1.00 1.00 C ATOM 457 O LEU A 985 45.774 9.839 5.759 1.00 1.00 O ATOM 458 CB LEU A 985 45.432 6.562 5.367 1.00 1.00 C ATOM 459 CG LEU A 985 46.911 6.809 5.706 1.00 1.00 C ATOM 460 CD1 LEU A 985 47.067 7.098 7.201 1.00 1.00 C ATOM 461 CD2 LEU A 985 47.724 5.564 5.347 1.00 1.00 C ATOM 0 H LEU A 985 43.024 6.641 4.919 1.00 1.00 H new ATOM 0 HA LEU A 985 44.628 7.907 6.862 1.00 1.00 H new ATOM 0 HB2 LEU A 985 45.082 5.665 5.877 1.00 1.00 H new ATOM 0 HB3 LEU A 985 45.324 6.384 4.297 1.00 1.00 H new ATOM 0 HG LEU A 985 47.270 7.667 5.137 1.00 1.00 H new ATOM 0 HD11 LEU A 985 48.118 7.271 7.430 1.00 1.00 H new ATOM 0 HD12 LEU A 985 46.488 7.983 7.463 1.00 1.00 H new ATOM 0 HD13 LEU A 985 46.706 6.245 7.776 1.00 1.00 H new ATOM 0 HD21 LEU A 985 48.774 5.734 5.585 1.00 1.00 H new ATOM 0 HD22 LEU A 985 47.355 4.712 5.918 1.00 1.00 H new ATOM 0 HD23 LEU A 985 47.623 5.358 4.281 1.00 1.00 H new ATOM 473 N ALA A 986 44.798 9.212 3.834 1.00 1.00 N ATOM 474 CA ALA A 986 45.268 10.399 3.131 1.00 1.00 C ATOM 475 C ALA A 986 44.629 11.653 3.716 1.00 1.00 C ATOM 476 O ALA A 986 45.293 12.670 3.920 1.00 1.00 O ATOM 477 CB ALA A 986 44.926 10.293 1.645 1.00 1.00 C ATOM 0 H ALA A 986 44.243 8.567 3.272 1.00 1.00 H new ATOM 0 HA ALA A 986 46.349 10.467 3.250 1.00 1.00 H new ATOM 0 HB1 ALA A 986 45.280 11.184 1.126 1.00 1.00 H new ATOM 0 HB2 ALA A 986 45.408 9.411 1.223 1.00 1.00 H new ATOM 0 HB3 ALA A 986 43.846 10.209 1.525 1.00 1.00 H new ATOM 483 N MET A 987 43.335 11.563 3.996 1.00 1.00 N ATOM 484 CA MET A 987 42.608 12.688 4.567 1.00 1.00 C ATOM 485 C MET A 987 43.128 13.016 5.962 1.00 1.00 C ATOM 486 O MET A 987 43.278 14.184 6.324 1.00 1.00 O ATOM 487 CB MET A 987 41.119 12.356 4.626 1.00 1.00 C ATOM 488 CG MET A 987 40.532 12.423 3.215 1.00 1.00 C ATOM 489 SD MET A 987 38.770 12.012 3.267 1.00 1.00 S ATOM 490 CE MET A 987 38.519 11.874 1.479 1.00 1.00 C ATOM 0 H MET A 987 42.771 10.728 3.838 1.00 1.00 H new ATOM 0 HA MET A 987 42.760 13.562 3.934 1.00 1.00 H new ATOM 0 HB2 MET A 987 40.972 11.361 5.047 1.00 1.00 H new ATOM 0 HB3 MET A 987 40.603 13.058 5.281 1.00 1.00 H new ATOM 0 HG2 MET A 987 40.670 13.421 2.800 1.00 1.00 H new ATOM 0 HG3 MET A 987 41.058 11.730 2.559 1.00 1.00 H new ATOM 0 HE1 MET A 987 37.622 12.424 1.194 1.00 1.00 H new ATOM 0 HE2 MET A 987 39.381 12.291 0.957 1.00 1.00 H new ATOM 0 HE3 MET A 987 38.403 10.825 1.208 1.00 1.00 H new ATOM 500 N TRP A 988 43.405 11.976 6.736 1.00 1.00 N ATOM 501 CA TRP A 988 43.913 12.154 8.091 1.00 1.00 C ATOM 502 C TRP A 988 45.257 12.877 8.065 1.00 1.00 C ATOM 503 O TRP A 988 45.524 13.749 8.891 1.00 1.00 O ATOM 504 CB TRP A 988 44.068 10.792 8.771 1.00 1.00 C ATOM 505 CG TRP A 988 44.850 10.932 10.040 1.00 1.00 C ATOM 506 CD1 TRP A 988 44.853 12.020 10.848 1.00 1.00 C ATOM 507 CD2 TRP A 988 45.746 9.964 10.660 1.00 1.00 C ATOM 508 NE1 TRP A 988 45.691 11.781 11.919 1.00 1.00 N ATOM 509 CE2 TRP A 988 46.267 10.527 11.848 1.00 1.00 C ATOM 510 CE3 TRP A 988 46.153 8.664 10.308 1.00 1.00 C ATOM 511 CZ2 TRP A 988 47.161 9.826 12.660 1.00 1.00 C ATOM 512 CZ3 TRP A 988 47.051 7.955 11.121 1.00 1.00 C ATOM 513 CH2 TRP A 988 47.554 8.535 12.295 1.00 1.00 C ATOM 0 H TRP A 988 43.288 11.004 6.451 1.00 1.00 H new ATOM 0 HA TRP A 988 43.202 12.758 8.654 1.00 1.00 H new ATOM 0 HB2 TRP A 988 43.086 10.371 8.985 1.00 1.00 H new ATOM 0 HB3 TRP A 988 44.573 10.098 8.099 1.00 1.00 H new ATOM 0 HD1 TRP A 988 44.291 12.927 10.681 1.00 1.00 H new ATOM 0 HE1 TRP A 988 45.864 12.448 12.671 1.00 1.00 H new ATOM 0 HE3 TRP A 988 45.772 8.209 9.406 1.00 1.00 H new ATOM 0 HZ2 TRP A 988 47.546 10.277 13.563 1.00 1.00 H new ATOM 0 HZ3 TRP A 988 47.356 6.958 10.841 1.00 1.00 H new ATOM 0 HH2 TRP A 988 48.245 7.984 12.917 1.00 1.00 H new ATOM 524 N LYS A 989 46.104 12.505 7.111 1.00 1.00 N ATOM 525 CA LYS A 989 47.424 13.117 6.989 1.00 1.00 C ATOM 526 C LYS A 989 47.298 14.521 6.401 1.00 1.00 C ATOM 527 O LYS A 989 48.236 15.314 6.449 1.00 1.00 O ATOM 528 CB LYS A 989 48.307 12.256 6.070 1.00 1.00 C ATOM 529 CG LYS A 989 49.450 11.570 6.857 1.00 1.00 C ATOM 530 CD LYS A 989 50.706 12.464 6.945 1.00 1.00 C ATOM 531 CE LYS A 989 50.555 13.516 8.052 1.00 1.00 C ATOM 532 NZ LYS A 989 51.882 14.136 8.328 1.00 1.00 N ATOM 0 H LYS A 989 45.903 11.787 6.415 1.00 1.00 H new ATOM 0 HA LYS A 989 47.878 13.183 7.978 1.00 1.00 H new ATOM 0 HB2 LYS A 989 47.695 11.498 5.582 1.00 1.00 H new ATOM 0 HB3 LYS A 989 48.730 12.880 5.282 1.00 1.00 H new ATOM 0 HG2 LYS A 989 49.105 11.329 7.862 1.00 1.00 H new ATOM 0 HG3 LYS A 989 49.708 10.627 6.374 1.00 1.00 H new ATOM 0 HD2 LYS A 989 51.583 11.847 7.142 1.00 1.00 H new ATOM 0 HD3 LYS A 989 50.872 12.959 5.988 1.00 1.00 H new ATOM 0 HE2 LYS A 989 49.840 14.280 7.748 1.00 1.00 H new ATOM 0 HE3 LYS A 989 50.162 13.054 8.957 1.00 1.00 H new ATOM 0 HZ1 LYS A 989 51.783 14.850 9.078 1.00 1.00 H new ATOM 0 HZ2 LYS A 989 52.551 13.402 8.635 1.00 1.00 H new ATOM 0 HZ3 LYS A 989 52.240 14.590 7.463 1.00 1.00 H new ATOM 546 N VAL A 990 46.127 14.825 5.852 1.00 1.00 N ATOM 547 CA VAL A 990 45.889 16.139 5.270 1.00 1.00 C ATOM 548 C VAL A 990 45.319 17.088 6.318 1.00 1.00 C ATOM 549 O VAL A 990 45.337 18.306 6.143 1.00 1.00 O ATOM 550 CB VAL A 990 44.912 16.030 4.098 1.00 1.00 C ATOM 551 CG1 VAL A 990 44.399 17.423 3.735 1.00 1.00 C ATOM 552 CG2 VAL A 990 45.626 15.422 2.887 1.00 1.00 C ATOM 0 H VAL A 990 45.335 14.185 5.798 1.00 1.00 H new ATOM 0 HA VAL A 990 46.840 16.532 4.911 1.00 1.00 H new ATOM 0 HB VAL A 990 44.075 15.393 4.383 1.00 1.00 H new ATOM 0 HG11 VAL A 990 43.702 17.348 2.900 1.00 1.00 H new ATOM 0 HG12 VAL A 990 43.889 17.858 4.595 1.00 1.00 H new ATOM 0 HG13 VAL A 990 45.239 18.057 3.451 1.00 1.00 H new ATOM 0 HG21 VAL A 990 44.928 15.345 2.054 1.00 1.00 H new ATOM 0 HG22 VAL A 990 46.464 16.058 2.601 1.00 1.00 H new ATOM 0 HG23 VAL A 990 45.995 14.429 3.143 1.00 1.00 H new ATOM 562 N GLY A 991 44.808 16.520 7.406 1.00 1.00 N ATOM 563 CA GLY A 991 44.229 17.322 8.476 1.00 1.00 C ATOM 564 C GLY A 991 42.760 17.620 8.191 1.00 1.00 C ATOM 565 O GLY A 991 42.126 18.407 8.896 1.00 1.00 O ATOM 0 H GLY A 991 44.783 15.513 7.569 1.00 1.00 H new ATOM 0 HA2 GLY A 991 44.321 16.793 9.424 1.00 1.00 H new ATOM 0 HA3 GLY A 991 44.782 18.256 8.577 1.00 1.00 H new ATOM 569 N PHE A 992 42.225 16.982 7.155 1.00 1.00 N ATOM 570 CA PHE A 992 40.829 17.181 6.785 1.00 1.00 C ATOM 571 C PHE A 992 39.908 16.742 7.917 1.00 1.00 C ATOM 572 O PHE A 992 38.931 17.420 8.233 1.00 1.00 O ATOM 573 CB PHE A 992 40.517 16.393 5.508 1.00 1.00 C ATOM 574 CG PHE A 992 39.050 16.479 5.109 1.00 1.00 C ATOM 575 CD1 PHE A 992 38.265 17.622 5.370 1.00 1.00 C ATOM 576 CD2 PHE A 992 38.476 15.386 4.448 1.00 1.00 C ATOM 577 CE1 PHE A 992 36.925 17.655 4.963 1.00 1.00 C ATOM 578 CE2 PHE A 992 37.139 15.423 4.048 1.00 1.00 C ATOM 579 CZ PHE A 992 36.364 16.556 4.304 1.00 1.00 C ATOM 0 H PHE A 992 42.733 16.327 6.561 1.00 1.00 H new ATOM 0 HA PHE A 992 40.660 18.242 6.600 1.00 1.00 H new ATOM 0 HB2 PHE A 992 41.134 16.771 4.693 1.00 1.00 H new ATOM 0 HB3 PHE A 992 40.789 15.348 5.655 1.00 1.00 H new ATOM 0 HD1 PHE A 992 38.696 18.469 5.882 1.00 1.00 H new ATOM 0 HD2 PHE A 992 39.072 14.508 4.246 1.00 1.00 H new ATOM 0 HE1 PHE A 992 36.324 18.531 5.158 1.00 1.00 H new ATOM 0 HE2 PHE A 992 36.704 14.575 3.540 1.00 1.00 H new ATOM 0 HZ PHE A 992 35.330 16.584 3.993 1.00 1.00 H new ATOM 589 N PHE A 993 40.231 15.605 8.528 1.00 1.00 N ATOM 590 CA PHE A 993 39.420 15.094 9.629 1.00 1.00 C ATOM 591 C PHE A 993 39.899 15.673 10.955 1.00 1.00 C ATOM 592 O PHE A 993 39.309 15.412 12.004 1.00 1.00 O ATOM 593 CB PHE A 993 39.484 13.563 9.693 1.00 1.00 C ATOM 594 CG PHE A 993 38.615 12.964 8.608 1.00 1.00 C ATOM 595 CD1 PHE A 993 37.228 13.156 8.639 1.00 1.00 C ATOM 596 CD2 PHE A 993 39.194 12.215 7.575 1.00 1.00 C ATOM 597 CE1 PHE A 993 36.423 12.604 7.637 1.00 1.00 C ATOM 598 CE2 PHE A 993 38.384 11.661 6.575 1.00 1.00 C ATOM 599 CZ PHE A 993 36.999 11.856 6.607 1.00 1.00 C ATOM 0 H PHE A 993 41.036 15.028 8.284 1.00 1.00 H new ATOM 0 HA PHE A 993 38.388 15.398 9.451 1.00 1.00 H new ATOM 0 HB2 PHE A 993 40.514 13.228 9.572 1.00 1.00 H new ATOM 0 HB3 PHE A 993 39.149 13.217 10.671 1.00 1.00 H new ATOM 0 HD1 PHE A 993 36.780 13.730 9.436 1.00 1.00 H new ATOM 0 HD2 PHE A 993 40.263 12.065 7.550 1.00 1.00 H new ATOM 0 HE1 PHE A 993 35.354 12.756 7.660 1.00 1.00 H new ATOM 0 HE2 PHE A 993 38.829 11.083 5.779 1.00 1.00 H new ATOM 0 HZ PHE A 993 36.375 11.429 5.836 1.00 1.00 H new ATOM 609 N LYS A 994 40.962 16.469 10.903 1.00 1.00 N ATOM 610 CA LYS A 994 41.494 17.083 12.112 1.00 1.00 C ATOM 611 C LYS A 994 40.796 18.415 12.363 1.00 1.00 C ATOM 612 O LYS A 994 40.705 19.258 11.471 1.00 1.00 O ATOM 613 CB LYS A 994 43.002 17.307 11.966 1.00 1.00 C ATOM 614 CG LYS A 994 43.569 17.871 13.270 1.00 1.00 C ATOM 615 CD LYS A 994 45.083 18.049 13.133 1.00 1.00 C ATOM 616 CE LYS A 994 45.659 18.597 14.440 1.00 1.00 C ATOM 617 NZ LYS A 994 47.134 18.756 14.302 1.00 1.00 N ATOM 0 H LYS A 994 41.466 16.701 10.047 1.00 1.00 H new ATOM 0 HA LYS A 994 41.315 16.418 12.957 1.00 1.00 H new ATOM 0 HB2 LYS A 994 43.497 16.367 11.720 1.00 1.00 H new ATOM 0 HB3 LYS A 994 43.199 17.996 11.145 1.00 1.00 H new ATOM 0 HG2 LYS A 994 43.099 18.827 13.500 1.00 1.00 H new ATOM 0 HG3 LYS A 994 43.345 17.198 14.098 1.00 1.00 H new ATOM 0 HD2 LYS A 994 45.550 17.095 12.890 1.00 1.00 H new ATOM 0 HD3 LYS A 994 45.306 18.731 12.312 1.00 1.00 H new ATOM 0 HE2 LYS A 994 45.199 19.556 14.679 1.00 1.00 H new ATOM 0 HE3 LYS A 994 45.430 17.920 15.263 1.00 1.00 H new ATOM 0 HZ1 LYS A 994 47.528 19.129 15.190 1.00 1.00 H new ATOM 0 HZ2 LYS A 994 47.565 17.833 14.093 1.00 1.00 H new ATOM 0 HZ3 LYS A 994 47.341 19.418 13.527 1.00 1.00 H new ATOM 631 N ARG A 995 40.300 18.593 13.580 1.00 1.00 N ATOM 632 CA ARG A 995 39.606 19.814 13.942 1.00 1.00 C ATOM 633 C ARG A 995 40.006 20.211 15.352 1.00 1.00 C ATOM 634 O ARG A 995 40.242 19.346 16.196 1.00 1.00 O ATOM 635 CB ARG A 995 38.093 19.591 13.861 1.00 1.00 C ATOM 636 CG ARG A 995 37.359 20.900 14.154 1.00 1.00 C ATOM 637 CD ARG A 995 35.850 20.662 14.087 1.00 1.00 C ATOM 638 NE ARG A 995 35.135 21.924 14.239 1.00 1.00 N ATOM 639 CZ ARG A 995 34.846 22.687 13.188 1.00 1.00 C ATOM 640 NH1 ARG A 995 35.207 22.319 11.987 1.00 1.00 N ATOM 641 NH2 ARG A 995 34.202 23.810 13.359 1.00 1.00 N ATOM 0 H ARG A 995 40.367 17.906 14.331 1.00 1.00 H new ATOM 0 HA ARG A 995 39.877 20.614 13.252 1.00 1.00 H new ATOM 0 HB2 ARG A 995 37.823 19.226 12.870 1.00 1.00 H new ATOM 0 HB3 ARG A 995 37.790 18.826 14.576 1.00 1.00 H new ATOM 0 HG2 ARG A 995 37.636 21.272 15.140 1.00 1.00 H new ATOM 0 HG3 ARG A 995 37.650 21.663 13.432 1.00 1.00 H new ATOM 0 HD2 ARG A 995 35.589 20.200 13.135 1.00 1.00 H new ATOM 0 HD3 ARG A 995 35.549 19.968 14.871 1.00 1.00 H new ATOM 0 HE ARG A 995 34.851 22.228 15.170 1.00 1.00 H new ATOM 0 HH11 ARG A 995 35.713 21.443 11.852 1.00 1.00 H new ATOM 0 HH12 ARG A 995 34.983 22.907 11.184 1.00 1.00 H new ATOM 0 HH21 ARG A 995 33.922 24.100 14.296 1.00 1.00 H new ATOM 0 HH22 ARG A 995 33.979 24.397 12.556 1.00 1.00 H new ATOM 808 N ASP B 692 26.918 -17.023 -11.780 1.00 1.00 N ATOM 809 CA ASP B 692 26.337 -15.970 -10.953 1.00 1.00 C ATOM 810 C ASP B 692 27.336 -15.473 -9.911 1.00 1.00 C ATOM 811 O ASP B 692 27.031 -14.570 -9.131 1.00 1.00 O ATOM 812 CB ASP B 692 25.084 -16.495 -10.248 1.00 1.00 C ATOM 813 CG ASP B 692 23.989 -16.772 -11.271 1.00 1.00 C ATOM 814 OD1 ASP B 692 24.118 -16.303 -12.391 1.00 1.00 O ATOM 815 OD2 ASP B 692 23.035 -17.448 -10.920 1.00 1.00 O ATOM 0 HA ASP B 692 26.073 -15.136 -11.604 1.00 1.00 H new ATOM 0 HB2 ASP B 692 25.320 -17.407 -9.700 1.00 1.00 H new ATOM 0 HB3 ASP B 692 24.735 -15.765 -9.518 1.00 1.00 H new ATOM 820 N ILE B 693 28.526 -16.065 -9.895 1.00 1.00 N ATOM 821 CA ILE B 693 29.547 -15.665 -8.932 1.00 1.00 C ATOM 822 C ILE B 693 30.015 -14.238 -9.197 1.00 1.00 C ATOM 823 O ILE B 693 30.222 -13.464 -8.262 1.00 1.00 O ATOM 824 CB ILE B 693 30.746 -16.614 -8.994 1.00 1.00 C ATOM 825 CG1 ILE B 693 31.694 -16.307 -7.829 1.00 1.00 C ATOM 826 CG2 ILE B 693 31.488 -16.420 -10.318 1.00 1.00 C ATOM 827 CD1 ILE B 693 32.755 -17.403 -7.714 1.00 1.00 C ATOM 0 H ILE B 693 28.805 -16.814 -10.529 1.00 1.00 H new ATOM 0 HA ILE B 693 29.103 -15.712 -7.938 1.00 1.00 H new ATOM 0 HB ILE B 693 30.398 -17.645 -8.923 1.00 1.00 H new ATOM 0 HG12 ILE B 693 32.173 -15.340 -7.985 1.00 1.00 H new ATOM 0 HG13 ILE B 693 31.130 -16.237 -6.899 1.00 1.00 H new ATOM 0 HG21 ILE B 693 32.341 -17.097 -10.359 1.00 1.00 H new ATOM 0 HG22 ILE B 693 30.814 -16.634 -11.148 1.00 1.00 H new ATOM 0 HG23 ILE B 693 31.838 -15.390 -10.392 1.00 1.00 H new ATOM 0 HD11 ILE B 693 33.424 -17.176 -6.884 1.00 1.00 H new ATOM 0 HD12 ILE B 693 32.269 -18.363 -7.537 1.00 1.00 H new ATOM 0 HD13 ILE B 693 33.329 -17.452 -8.639 1.00 1.00 H new ATOM 839 N LEU B 694 30.184 -13.894 -10.469 1.00 1.00 N ATOM 840 CA LEU B 694 30.633 -12.553 -10.825 1.00 1.00 C ATOM 841 C LEU B 694 29.611 -11.518 -10.369 1.00 1.00 C ATOM 842 O LEU B 694 29.973 -10.472 -9.833 1.00 1.00 O ATOM 843 CB LEU B 694 30.826 -12.451 -12.339 1.00 1.00 C ATOM 844 CG LEU B 694 32.030 -13.299 -12.765 1.00 1.00 C ATOM 845 CD1 LEU B 694 32.089 -13.371 -14.291 1.00 1.00 C ATOM 846 CD2 LEU B 694 33.333 -12.683 -12.235 1.00 1.00 C ATOM 0 H LEU B 694 30.020 -14.515 -11.261 1.00 1.00 H new ATOM 0 HA LEU B 694 31.583 -12.359 -10.327 1.00 1.00 H new ATOM 0 HB2 LEU B 694 29.928 -12.793 -12.854 1.00 1.00 H new ATOM 0 HB3 LEU B 694 30.982 -11.411 -12.626 1.00 1.00 H new ATOM 0 HG LEU B 694 31.918 -14.301 -12.351 1.00 1.00 H new ATOM 0 HD11 LEU B 694 32.945 -13.974 -14.594 1.00 1.00 H new ATOM 0 HD12 LEU B 694 31.173 -13.825 -14.670 1.00 1.00 H new ATOM 0 HD13 LEU B 694 32.191 -12.365 -14.699 1.00 1.00 H new ATOM 0 HD21 LEU B 694 34.178 -13.297 -12.546 1.00 1.00 H new ATOM 0 HD22 LEU B 694 33.449 -11.676 -12.636 1.00 1.00 H new ATOM 0 HD23 LEU B 694 33.298 -12.638 -11.146 1.00 1.00 H new ATOM 858 N VAL B 695 28.336 -11.826 -10.571 1.00 1.00 N ATOM 859 CA VAL B 695 27.268 -10.919 -10.165 1.00 1.00 C ATOM 860 C VAL B 695 27.267 -10.751 -8.650 1.00 1.00 C ATOM 861 O VAL B 695 27.139 -9.640 -8.136 1.00 1.00 O ATOM 862 CB VAL B 695 25.914 -11.467 -10.622 1.00 1.00 C ATOM 863 CG1 VAL B 695 24.792 -10.620 -10.020 1.00 1.00 C ATOM 864 CG2 VAL B 695 25.831 -11.410 -12.149 1.00 1.00 C ATOM 0 H VAL B 695 28.017 -12.690 -11.010 1.00 1.00 H new ATOM 0 HA VAL B 695 27.439 -9.948 -10.630 1.00 1.00 H new ATOM 0 HB VAL B 695 25.809 -12.500 -10.290 1.00 1.00 H new ATOM 0 HG11 VAL B 695 23.827 -11.010 -10.345 1.00 1.00 H new ATOM 0 HG12 VAL B 695 24.851 -10.658 -8.932 1.00 1.00 H new ATOM 0 HG13 VAL B 695 24.897 -9.587 -10.353 1.00 1.00 H new ATOM 0 HG21 VAL B 695 24.867 -11.800 -12.476 1.00 1.00 H new ATOM 0 HG22 VAL B 695 25.936 -10.377 -12.481 1.00 1.00 H new ATOM 0 HG23 VAL B 695 26.631 -12.012 -12.580 1.00 1.00 H new ATOM 874 N VAL B 696 27.410 -11.866 -7.943 1.00 1.00 N ATOM 875 CA VAL B 696 27.423 -11.848 -6.485 1.00 1.00 C ATOM 876 C VAL B 696 28.609 -11.042 -5.962 1.00 1.00 C ATOM 877 O VAL B 696 28.463 -10.247 -5.034 1.00 1.00 O ATOM 878 CB VAL B 696 27.501 -13.277 -5.947 1.00 1.00 C ATOM 879 CG1 VAL B 696 27.721 -13.243 -4.434 1.00 1.00 C ATOM 880 CG2 VAL B 696 26.191 -14.009 -6.254 1.00 1.00 C ATOM 0 H VAL B 696 27.518 -12.793 -8.355 1.00 1.00 H new ATOM 0 HA VAL B 696 26.502 -11.377 -6.142 1.00 1.00 H new ATOM 0 HB VAL B 696 28.331 -13.799 -6.423 1.00 1.00 H new ATOM 0 HG11 VAL B 696 27.776 -14.262 -4.051 1.00 1.00 H new ATOM 0 HG12 VAL B 696 28.652 -12.721 -4.213 1.00 1.00 H new ATOM 0 HG13 VAL B 696 26.891 -12.721 -3.957 1.00 1.00 H new ATOM 0 HG21 VAL B 696 26.245 -15.028 -5.871 1.00 1.00 H new ATOM 0 HG22 VAL B 696 25.362 -13.486 -5.778 1.00 1.00 H new ATOM 0 HG23 VAL B 696 26.033 -14.035 -7.332 1.00 1.00 H new ATOM 890 N LEU B 697 29.782 -11.260 -6.554 1.00 1.00 N ATOM 891 CA LEU B 697 30.985 -10.553 -6.127 1.00 1.00 C ATOM 892 C LEU B 697 30.821 -9.048 -6.331 1.00 1.00 C ATOM 893 O LEU B 697 31.186 -8.250 -5.467 1.00 1.00 O ATOM 894 CB LEU B 697 32.191 -11.057 -6.932 1.00 1.00 C ATOM 895 CG LEU B 697 33.468 -10.312 -6.516 1.00 1.00 C ATOM 896 CD1 LEU B 697 33.712 -10.486 -5.016 1.00 1.00 C ATOM 897 CD2 LEU B 697 34.658 -10.883 -7.289 1.00 1.00 C ATOM 0 H LEU B 697 29.923 -11.914 -7.323 1.00 1.00 H new ATOM 0 HA LEU B 697 31.148 -10.745 -5.067 1.00 1.00 H new ATOM 0 HB2 LEU B 697 32.320 -12.128 -6.773 1.00 1.00 H new ATOM 0 HB3 LEU B 697 32.010 -10.913 -7.997 1.00 1.00 H new ATOM 0 HG LEU B 697 33.352 -9.251 -6.739 1.00 1.00 H new ATOM 0 HD11 LEU B 697 34.620 -9.954 -4.731 1.00 1.00 H new ATOM 0 HD12 LEU B 697 32.865 -10.083 -4.460 1.00 1.00 H new ATOM 0 HD13 LEU B 697 33.825 -11.546 -4.786 1.00 1.00 H new ATOM 0 HD21 LEU B 697 35.567 -10.357 -6.997 1.00 1.00 H new ATOM 0 HD22 LEU B 697 34.764 -11.944 -7.063 1.00 1.00 H new ATOM 0 HD23 LEU B 697 34.492 -10.755 -8.359 1.00 1.00 H new ATOM 909 N LEU B 698 30.268 -8.665 -7.474 1.00 1.00 N ATOM 910 CA LEU B 698 30.055 -7.254 -7.771 1.00 1.00 C ATOM 911 C LEU B 698 29.066 -6.629 -6.788 1.00 1.00 C ATOM 912 O LEU B 698 29.249 -5.495 -6.348 1.00 1.00 O ATOM 913 CB LEU B 698 29.530 -7.091 -9.199 1.00 1.00 C ATOM 914 CG LEU B 698 30.639 -7.436 -10.201 1.00 1.00 C ATOM 915 CD1 LEU B 698 30.050 -7.499 -11.611 1.00 1.00 C ATOM 916 CD2 LEU B 698 31.747 -6.373 -10.160 1.00 1.00 C ATOM 0 H LEU B 698 29.961 -9.305 -8.206 1.00 1.00 H new ATOM 0 HA LEU B 698 31.012 -6.741 -7.673 1.00 1.00 H new ATOM 0 HB2 LEU B 698 28.669 -7.741 -9.357 1.00 1.00 H new ATOM 0 HB3 LEU B 698 29.190 -6.068 -9.357 1.00 1.00 H new ATOM 0 HG LEU B 698 31.066 -8.403 -9.934 1.00 1.00 H new ATOM 0 HD11 LEU B 698 30.837 -7.744 -12.324 1.00 1.00 H new ATOM 0 HD12 LEU B 698 29.276 -8.265 -11.648 1.00 1.00 H new ATOM 0 HD13 LEU B 698 29.616 -6.532 -11.868 1.00 1.00 H new ATOM 0 HD21 LEU B 698 32.526 -6.632 -10.877 1.00 1.00 H new ATOM 0 HD22 LEU B 698 31.327 -5.400 -10.416 1.00 1.00 H new ATOM 0 HD23 LEU B 698 32.174 -6.331 -9.158 1.00 1.00 H new ATOM 928 N SER B 699 28.003 -7.365 -6.472 1.00 1.00 N ATOM 929 CA SER B 699 26.975 -6.857 -5.567 1.00 1.00 C ATOM 930 C SER B 699 27.534 -6.527 -4.183 1.00 1.00 C ATOM 931 O SER B 699 27.218 -5.477 -3.624 1.00 1.00 O ATOM 932 CB SER B 699 25.859 -7.891 -5.426 1.00 1.00 C ATOM 933 OG SER B 699 25.261 -8.111 -6.697 1.00 1.00 O ATOM 0 H SER B 699 27.832 -8.306 -6.825 1.00 1.00 H new ATOM 0 HA SER B 699 26.588 -5.934 -5.999 1.00 1.00 H new ATOM 0 HB2 SER B 699 26.260 -8.825 -5.033 1.00 1.00 H new ATOM 0 HB3 SER B 699 25.111 -7.541 -4.715 1.00 1.00 H new ATOM 0 HG SER B 699 25.873 -8.627 -7.262 1.00 1.00 H new ATOM 939 N VAL B 700 28.363 -7.411 -3.630 1.00 1.00 N ATOM 940 CA VAL B 700 28.932 -7.153 -2.309 1.00 1.00 C ATOM 941 C VAL B 700 29.858 -5.939 -2.347 1.00 1.00 C ATOM 942 O VAL B 700 29.842 -5.107 -1.440 1.00 1.00 O ATOM 943 CB VAL B 700 29.680 -8.381 -1.777 1.00 1.00 C ATOM 944 CG1 VAL B 700 28.672 -9.482 -1.443 1.00 1.00 C ATOM 945 CG2 VAL B 700 30.648 -8.902 -2.833 1.00 1.00 C ATOM 0 H VAL B 700 28.650 -8.289 -4.062 1.00 1.00 H new ATOM 0 HA VAL B 700 28.108 -6.939 -1.629 1.00 1.00 H new ATOM 0 HB VAL B 700 30.237 -8.098 -0.884 1.00 1.00 H new ATOM 0 HG11 VAL B 700 29.201 -10.357 -1.064 1.00 1.00 H new ATOM 0 HG12 VAL B 700 27.977 -9.121 -0.684 1.00 1.00 H new ATOM 0 HG13 VAL B 700 28.119 -9.754 -2.342 1.00 1.00 H new ATOM 0 HG21 VAL B 700 31.174 -9.774 -2.445 1.00 1.00 H new ATOM 0 HG22 VAL B 700 30.093 -9.181 -3.729 1.00 1.00 H new ATOM 0 HG23 VAL B 700 31.369 -8.123 -3.081 1.00 1.00 H new ATOM 955 N MET B 701 30.661 -5.841 -3.404 1.00 1.00 N ATOM 956 CA MET B 701 31.586 -4.722 -3.547 1.00 1.00 C ATOM 957 C MET B 701 30.828 -3.403 -3.674 1.00 1.00 C ATOM 958 O MET B 701 31.232 -2.388 -3.106 1.00 1.00 O ATOM 959 CB MET B 701 32.465 -4.925 -4.783 1.00 1.00 C ATOM 960 CG MET B 701 33.520 -5.995 -4.490 1.00 1.00 C ATOM 961 SD MET B 701 34.495 -6.308 -5.985 1.00 1.00 S ATOM 962 CE MET B 701 35.366 -4.721 -6.046 1.00 1.00 C ATOM 0 H MET B 701 30.690 -6.517 -4.167 1.00 1.00 H new ATOM 0 HA MET B 701 32.212 -4.682 -2.655 1.00 1.00 H new ATOM 0 HB2 MET B 701 31.852 -5.227 -5.632 1.00 1.00 H new ATOM 0 HB3 MET B 701 32.949 -3.987 -5.056 1.00 1.00 H new ATOM 0 HG2 MET B 701 34.172 -5.666 -3.680 1.00 1.00 H new ATOM 0 HG3 MET B 701 33.038 -6.915 -4.158 1.00 1.00 H new ATOM 0 HE1 MET B 701 36.305 -4.842 -6.586 1.00 1.00 H new ATOM 0 HE2 MET B 701 34.745 -3.985 -6.557 1.00 1.00 H new ATOM 0 HE3 MET B 701 35.573 -4.380 -5.031 1.00 1.00 H new ATOM 972 N GLY B 702 29.736 -3.423 -4.432 1.00 1.00 N ATOM 973 CA GLY B 702 28.939 -2.218 -4.639 1.00 1.00 C ATOM 974 C GLY B 702 28.331 -1.717 -3.332 1.00 1.00 C ATOM 975 O GLY B 702 28.306 -0.514 -3.072 1.00 1.00 O ATOM 0 H GLY B 702 29.385 -4.253 -4.910 1.00 1.00 H new ATOM 0 HA2 GLY B 702 29.564 -1.438 -5.073 1.00 1.00 H new ATOM 0 HA3 GLY B 702 28.144 -2.425 -5.355 1.00 1.00 H new ATOM 979 N ALA B 703 27.838 -2.641 -2.513 1.00 1.00 N ATOM 980 CA ALA B 703 27.235 -2.266 -1.240 1.00 1.00 C ATOM 981 C ALA B 703 28.275 -1.634 -0.320 1.00 1.00 C ATOM 982 O ALA B 703 27.992 -0.665 0.384 1.00 1.00 O ATOM 983 CB ALA B 703 26.631 -3.498 -0.562 1.00 1.00 C ATOM 0 H ALA B 703 27.844 -3.643 -2.705 1.00 1.00 H new ATOM 0 HA ALA B 703 26.448 -1.538 -1.434 1.00 1.00 H new ATOM 0 HB1 ALA B 703 26.183 -3.207 0.388 1.00 1.00 H new ATOM 0 HB2 ALA B 703 25.866 -3.930 -1.207 1.00 1.00 H new ATOM 0 HB3 ALA B 703 27.414 -4.236 -0.384 1.00 1.00 H new ATOM 989 N ILE B 704 29.480 -2.188 -0.336 1.00 1.00 N ATOM 990 CA ILE B 704 30.562 -1.675 0.496 1.00 1.00 C ATOM 991 C ILE B 704 30.935 -0.253 0.089 1.00 1.00 C ATOM 992 O ILE B 704 31.149 0.610 0.940 1.00 1.00 O ATOM 993 CB ILE B 704 31.783 -2.585 0.382 1.00 1.00 C ATOM 994 CG1 ILE B 704 31.461 -3.931 1.032 1.00 1.00 C ATOM 995 CG2 ILE B 704 32.971 -1.937 1.097 1.00 1.00 C ATOM 996 CD1 ILE B 704 32.552 -4.943 0.685 1.00 1.00 C ATOM 0 H ILE B 704 29.733 -2.990 -0.913 1.00 1.00 H new ATOM 0 HA ILE B 704 30.219 -1.657 1.531 1.00 1.00 H new ATOM 0 HB ILE B 704 32.037 -2.736 -0.667 1.00 1.00 H new ATOM 0 HG12 ILE B 704 31.389 -3.816 2.113 1.00 1.00 H new ATOM 0 HG13 ILE B 704 30.493 -4.292 0.684 1.00 1.00 H new ATOM 0 HG21 ILE B 704 33.843 -2.586 1.016 1.00 1.00 H new ATOM 0 HG22 ILE B 704 33.192 -0.974 0.636 1.00 1.00 H new ATOM 0 HG23 ILE B 704 32.726 -1.789 2.149 1.00 1.00 H new ATOM 0 HD11 ILE B 704 32.320 -5.901 1.149 1.00 1.00 H new ATOM 0 HD12 ILE B 704 32.603 -5.067 -0.397 1.00 1.00 H new ATOM 0 HD13 ILE B 704 33.512 -4.584 1.054 1.00 1.00 H new ATOM 1008 N LEU B 705 31.019 -0.019 -1.216 1.00 1.00 N ATOM 1009 CA LEU B 705 31.376 1.303 -1.720 1.00 1.00 C ATOM 1010 C LEU B 705 30.333 2.331 -1.298 1.00 1.00 C ATOM 1011 O LEU B 705 30.674 3.445 -0.901 1.00 1.00 O ATOM 1012 CB LEU B 705 31.475 1.271 -3.246 1.00 1.00 C ATOM 1013 CG LEU B 705 32.698 0.446 -3.666 1.00 1.00 C ATOM 1014 CD1 LEU B 705 32.666 0.228 -5.179 1.00 1.00 C ATOM 1015 CD2 LEU B 705 33.992 1.178 -3.284 1.00 1.00 C ATOM 0 H LEU B 705 30.847 -0.719 -1.938 1.00 1.00 H new ATOM 0 HA LEU B 705 32.342 1.585 -1.301 1.00 1.00 H new ATOM 0 HB2 LEU B 705 30.569 0.838 -3.670 1.00 1.00 H new ATOM 0 HB3 LEU B 705 31.557 2.285 -3.636 1.00 1.00 H new ATOM 0 HG LEU B 705 32.671 -0.515 -3.152 1.00 1.00 H new ATOM 0 HD11 LEU B 705 33.534 -0.358 -5.481 1.00 1.00 H new ATOM 0 HD12 LEU B 705 31.755 -0.306 -5.450 1.00 1.00 H new ATOM 0 HD13 LEU B 705 32.686 1.193 -5.686 1.00 1.00 H new ATOM 0 HD21 LEU B 705 34.851 0.581 -3.588 1.00 1.00 H new ATOM 0 HD22 LEU B 705 34.025 2.144 -3.787 1.00 1.00 H new ATOM 0 HD23 LEU B 705 34.019 1.330 -2.205 1.00 1.00 H new ATOM 1027 N LEU B 706 29.063 1.950 -1.382 1.00 1.00 N ATOM 1028 CA LEU B 706 27.982 2.851 -0.999 1.00 1.00 C ATOM 1029 C LEU B 706 28.091 3.205 0.483 1.00 1.00 C ATOM 1030 O LEU B 706 27.920 4.361 0.870 1.00 1.00 O ATOM 1031 CB LEU B 706 26.628 2.184 -1.279 1.00 1.00 C ATOM 1032 CG LEU B 706 25.475 3.109 -0.866 1.00 1.00 C ATOM 1033 CD1 LEU B 706 25.582 4.445 -1.604 1.00 1.00 C ATOM 1034 CD2 LEU B 706 24.145 2.443 -1.223 1.00 1.00 C ATOM 0 H LEU B 706 28.759 1.033 -1.708 1.00 1.00 H new ATOM 0 HA LEU B 706 28.060 3.767 -1.585 1.00 1.00 H new ATOM 0 HB2 LEU B 706 26.547 1.944 -2.339 1.00 1.00 H new ATOM 0 HB3 LEU B 706 26.560 1.243 -0.733 1.00 1.00 H new ATOM 0 HG LEU B 706 25.528 3.289 0.208 1.00 1.00 H new ATOM 0 HD11 LEU B 706 24.759 5.094 -1.304 1.00 1.00 H new ATOM 0 HD12 LEU B 706 26.530 4.923 -1.356 1.00 1.00 H new ATOM 0 HD13 LEU B 706 25.533 4.272 -2.679 1.00 1.00 H new ATOM 0 HD21 LEU B 706 23.322 3.095 -0.932 1.00 1.00 H new ATOM 0 HD22 LEU B 706 24.104 2.265 -2.298 1.00 1.00 H new ATOM 0 HD23 LEU B 706 24.060 1.494 -0.694 1.00 1.00 H new ATOM 1046 N ILE B 707 28.381 2.201 1.305 1.00 1.00 N ATOM 1047 CA ILE B 707 28.517 2.415 2.744 1.00 1.00 C ATOM 1048 C ILE B 707 29.685 3.343 3.049 1.00 1.00 C ATOM 1049 O ILE B 707 29.570 4.240 3.884 1.00 1.00 O ATOM 1050 CB ILE B 707 28.726 1.080 3.455 1.00 1.00 C ATOM 1051 CG1 ILE B 707 27.444 0.252 3.367 1.00 1.00 C ATOM 1052 CG2 ILE B 707 29.074 1.329 4.925 1.00 1.00 C ATOM 1053 CD1 ILE B 707 27.733 -1.181 3.814 1.00 1.00 C ATOM 0 H ILE B 707 28.526 1.237 1.003 1.00 1.00 H new ATOM 0 HA ILE B 707 27.600 2.880 3.105 1.00 1.00 H new ATOM 0 HB ILE B 707 29.543 0.539 2.978 1.00 1.00 H new ATOM 0 HG12 ILE B 707 26.670 0.692 3.996 1.00 1.00 H new ATOM 0 HG13 ILE B 707 27.065 0.256 2.345 1.00 1.00 H new ATOM 0 HG21 ILE B 707 29.223 0.375 5.430 1.00 1.00 H new ATOM 0 HG22 ILE B 707 29.988 1.919 4.988 1.00 1.00 H new ATOM 0 HG23 ILE B 707 28.259 1.871 5.405 1.00 1.00 H new ATOM 0 HD11 ILE B 707 26.820 -1.773 3.752 1.00 1.00 H new ATOM 0 HD12 ILE B 707 28.493 -1.618 3.166 1.00 1.00 H new ATOM 0 HD13 ILE B 707 28.092 -1.176 4.843 1.00 1.00 H new ATOM 1065 N GLY B 708 30.811 3.126 2.379 1.00 1.00 N ATOM 1066 CA GLY B 708 31.983 3.962 2.609 1.00 1.00 C ATOM 1067 C GLY B 708 31.673 5.418 2.268 1.00 1.00 C ATOM 1068 O GLY B 708 32.037 6.338 3.005 1.00 1.00 O ATOM 0 H GLY B 708 30.937 2.391 1.683 1.00 1.00 H new ATOM 0 HA2 GLY B 708 32.294 3.884 3.651 1.00 1.00 H new ATOM 0 HA3 GLY B 708 32.815 3.608 2.000 1.00 1.00 H new ATOM 1072 N LEU B 709 30.999 5.620 1.141 1.00 1.00 N ATOM 1073 CA LEU B 709 30.632 6.968 0.711 1.00 1.00 C ATOM 1074 C LEU B 709 29.668 7.612 1.705 1.00 1.00 C ATOM 1075 O LEU B 709 29.779 8.796 2.022 1.00 1.00 O ATOM 1076 CB LEU B 709 29.985 6.915 -0.680 1.00 1.00 C ATOM 1077 CG LEU B 709 29.611 8.327 -1.149 1.00 1.00 C ATOM 1078 CD1 LEU B 709 30.860 9.212 -1.195 1.00 1.00 C ATOM 1079 CD2 LEU B 709 28.999 8.246 -2.549 1.00 1.00 C ATOM 0 H LEU B 709 30.697 4.876 0.512 1.00 1.00 H new ATOM 0 HA LEU B 709 31.538 7.573 0.667 1.00 1.00 H new ATOM 0 HB2 LEU B 709 30.674 6.459 -1.391 1.00 1.00 H new ATOM 0 HB3 LEU B 709 29.095 6.287 -0.650 1.00 1.00 H new ATOM 0 HG LEU B 709 28.892 8.758 -0.452 1.00 1.00 H new ATOM 0 HD11 LEU B 709 30.585 10.212 -1.529 1.00 1.00 H new ATOM 0 HD12 LEU B 709 31.302 9.270 -0.200 1.00 1.00 H new ATOM 0 HD13 LEU B 709 31.584 8.784 -1.889 1.00 1.00 H new ATOM 0 HD21 LEU B 709 28.731 9.247 -2.887 1.00 1.00 H new ATOM 0 HD22 LEU B 709 29.723 7.812 -3.238 1.00 1.00 H new ATOM 0 HD23 LEU B 709 28.106 7.622 -2.520 1.00 1.00 H new ATOM 1091 N ALA B 710 28.707 6.827 2.179 1.00 1.00 N ATOM 1092 CA ALA B 710 27.715 7.345 3.122 1.00 1.00 C ATOM 1093 C ALA B 710 28.383 7.800 4.423 1.00 1.00 C ATOM 1094 O ALA B 710 28.004 8.819 5.003 1.00 1.00 O ATOM 1095 CB ALA B 710 26.676 6.268 3.437 1.00 1.00 C ATOM 0 H ALA B 710 28.591 5.844 1.932 1.00 1.00 H new ATOM 0 HA ALA B 710 27.226 8.202 2.659 1.00 1.00 H new ATOM 0 HB1 ALA B 710 25.943 6.664 4.140 1.00 1.00 H new ATOM 0 HB2 ALA B 710 26.173 5.968 2.518 1.00 1.00 H new ATOM 0 HB3 ALA B 710 27.171 5.403 3.878 1.00 1.00 H new ATOM 1101 N ALA B 711 29.369 7.037 4.882 1.00 1.00 N ATOM 1102 CA ALA B 711 30.067 7.377 6.123 1.00 1.00 C ATOM 1103 C ALA B 711 30.791 8.714 5.979 1.00 1.00 C ATOM 1104 O ALA B 711 30.793 9.537 6.898 1.00 1.00 O ATOM 1105 CB ALA B 711 31.080 6.281 6.472 1.00 1.00 C ATOM 0 H ALA B 711 29.702 6.189 4.423 1.00 1.00 H new ATOM 0 HA ALA B 711 29.330 7.457 6.922 1.00 1.00 H new ATOM 0 HB1 ALA B 711 31.595 6.542 7.397 1.00 1.00 H new ATOM 0 HB2 ALA B 711 30.559 5.332 6.602 1.00 1.00 H new ATOM 0 HB3 ALA B 711 31.808 6.188 5.666 1.00 1.00 H new ATOM 1111 N LEU B 712 31.396 8.925 4.817 1.00 1.00 N ATOM 1112 CA LEU B 712 32.109 10.162 4.546 1.00 1.00 C ATOM 1113 C LEU B 712 31.149 11.342 4.549 1.00 1.00 C ATOM 1114 O LEU B 712 31.465 12.412 5.075 1.00 1.00 O ATOM 1115 CB LEU B 712 32.830 10.054 3.202 1.00 1.00 C ATOM 1116 CG LEU B 712 33.620 11.335 2.920 1.00 1.00 C ATOM 1117 CD1 LEU B 712 34.945 10.964 2.257 1.00 1.00 C ATOM 1118 CD2 LEU B 712 32.830 12.236 1.963 1.00 1.00 C ATOM 0 H LEU B 712 31.406 8.254 4.049 1.00 1.00 H new ATOM 0 HA LEU B 712 32.847 10.328 5.330 1.00 1.00 H new ATOM 0 HB2 LEU B 712 33.504 9.197 3.211 1.00 1.00 H new ATOM 0 HB3 LEU B 712 32.106 9.882 2.406 1.00 1.00 H new ATOM 0 HG LEU B 712 33.795 11.863 3.857 1.00 1.00 H new ATOM 0 HD11 LEU B 712 35.515 11.870 2.052 1.00 1.00 H new ATOM 0 HD12 LEU B 712 35.517 10.318 2.923 1.00 1.00 H new ATOM 0 HD13 LEU B 712 34.750 10.439 1.322 1.00 1.00 H new ATOM 0 HD21 LEU B 712 33.398 13.145 1.767 1.00 1.00 H new ATOM 0 HD22 LEU B 712 32.656 11.707 1.026 1.00 1.00 H new ATOM 0 HD23 LEU B 712 31.873 12.497 2.415 1.00 1.00 H new ATOM 1130 N LEU B 713 29.977 11.144 3.951 1.00 1.00 N ATOM 1131 CA LEU B 713 28.981 12.206 3.879 1.00 1.00 C ATOM 1132 C LEU B 713 28.546 12.613 5.305 1.00 1.00 C ATOM 1133 O LEU B 713 28.455 13.815 5.654 1.00 1.00 O ATOM 1134 CB LEU B 713 27.772 11.690 3.070 1.00 1.00 C ATOM 1135 CG LEU B 713 26.704 12.776 2.931 1.00 1.00 C ATOM 1136 CD1 LEU B 713 27.298 14.007 2.242 1.00 1.00 C ATOM 1137 CD2 LEU B 713 25.538 12.236 2.085 1.00 1.00 C ATOM 0 H LEU B 713 29.697 10.266 3.514 1.00 1.00 H new ATOM 0 HA LEU B 713 29.400 13.084 3.387 1.00 1.00 H new ATOM 0 HB2 LEU B 713 28.101 11.369 2.082 1.00 1.00 H new ATOM 0 HB3 LEU B 713 27.346 10.816 3.563 1.00 1.00 H new ATOM 0 HG LEU B 713 26.346 13.056 3.922 1.00 1.00 H new ATOM 0 HD11 LEU B 713 26.531 14.776 2.147 1.00 1.00 H new ATOM 0 HD12 LEU B 713 28.126 14.392 2.836 1.00 1.00 H new ATOM 0 HD13 LEU B 713 27.660 13.731 1.252 1.00 1.00 H new ATOM 0 HD21 LEU B 713 24.774 13.007 1.984 1.00 1.00 H new ATOM 0 HD22 LEU B 713 25.904 11.956 1.097 1.00 1.00 H new ATOM 0 HD23 LEU B 713 25.108 11.362 2.574 1.00 1.00 H new ATOM 1149 N ILE B 714 28.288 11.612 6.144 1.00 1.00 N ATOM 1150 CA ILE B 714 27.857 11.947 7.521 1.00 1.00 C ATOM 1151 C ILE B 714 28.968 12.703 8.253 1.00 1.00 C ATOM 1152 O ILE B 714 28.715 13.710 8.922 1.00 1.00 O ATOM 1153 CB ILE B 714 27.505 10.692 8.315 1.00 1.00 C ATOM 1154 CG1 ILE B 714 26.275 10.040 7.675 1.00 1.00 C ATOM 1155 CG2 ILE B 714 27.180 11.086 9.766 1.00 1.00 C ATOM 1156 CD1 ILE B 714 26.032 8.652 8.282 1.00 1.00 C ATOM 0 H ILE B 714 28.360 10.618 5.926 1.00 1.00 H new ATOM 0 HA ILE B 714 26.968 12.573 7.443 1.00 1.00 H new ATOM 0 HB ILE B 714 28.342 9.994 8.309 1.00 1.00 H new ATOM 0 HG12 ILE B 714 25.399 10.670 7.829 1.00 1.00 H new ATOM 0 HG13 ILE B 714 26.420 9.953 6.598 1.00 1.00 H new ATOM 0 HG21 ILE B 714 26.928 10.193 10.338 1.00 1.00 H new ATOM 0 HG22 ILE B 714 28.047 11.571 10.214 1.00 1.00 H new ATOM 0 HG23 ILE B 714 26.334 11.774 9.776 1.00 1.00 H new ATOM 0 HD11 ILE B 714 25.155 8.200 7.818 1.00 1.00 H new ATOM 0 HD12 ILE B 714 26.902 8.020 8.105 1.00 1.00 H new ATOM 0 HD13 ILE B 714 25.866 8.748 9.355 1.00 1.00 H new ATOM 1168 N TRP B 715 30.200 12.227 8.111 1.00 1.00 N ATOM 1169 CA TRP B 715 31.337 12.884 8.758 1.00 1.00 C ATOM 1170 C TRP B 715 31.455 14.320 8.241 1.00 1.00 C ATOM 1171 O TRP B 715 31.696 15.254 9.001 1.00 1.00 O ATOM 1172 CB TRP B 715 32.630 12.116 8.447 1.00 1.00 C ATOM 1173 CG TRP B 715 33.642 12.266 9.547 1.00 1.00 C ATOM 1174 CD1 TRP B 715 33.708 13.284 10.437 1.00 1.00 C ATOM 1175 CD2 TRP B 715 34.746 11.365 9.880 1.00 1.00 C ATOM 1176 NE1 TRP B 715 34.772 13.062 11.295 1.00 1.00 N ATOM 1177 CE2 TRP B 715 35.441 11.895 10.992 1.00 1.00 C ATOM 1178 CE3 TRP B 715 35.207 10.148 9.331 1.00 1.00 C ATOM 1179 CZ2 TRP B 715 36.548 11.248 11.541 1.00 1.00 C ATOM 1180 CZ3 TRP B 715 36.324 9.496 9.883 1.00 1.00 C ATOM 1181 CH2 TRP B 715 36.992 10.045 10.986 1.00 1.00 C ATOM 0 H TRP B 715 30.439 11.401 7.563 1.00 1.00 H new ATOM 0 HA TRP B 715 31.181 12.896 9.837 1.00 1.00 H new ATOM 0 HB2 TRP B 715 32.401 11.060 8.304 1.00 1.00 H new ATOM 0 HB3 TRP B 715 33.053 12.480 7.511 1.00 1.00 H new ATOM 0 HD1 TRP B 715 33.039 14.131 10.472 1.00 1.00 H new ATOM 0 HE1 TRP B 715 35.030 13.687 12.059 1.00 1.00 H new ATOM 0 HE3 TRP B 715 34.698 9.716 8.482 1.00 1.00 H new ATOM 0 HZ2 TRP B 715 37.060 11.675 12.391 1.00 1.00 H new ATOM 0 HZ3 TRP B 715 36.669 8.567 9.454 1.00 1.00 H new ATOM 0 HH2 TRP B 715 37.849 9.539 11.406 1.00 1.00 H new ATOM 1192 N LYS B 716 31.285 14.482 6.929 1.00 1.00 N ATOM 1193 CA LYS B 716 31.386 15.807 6.308 1.00 1.00 C ATOM 1194 C LYS B 716 30.341 16.746 6.901 1.00 1.00 C ATOM 1195 O LYS B 716 30.621 17.917 7.160 1.00 1.00 O ATOM 1196 CB LYS B 716 31.158 15.702 4.787 1.00 1.00 C ATOM 1197 CG LYS B 716 32.471 15.924 3.996 1.00 1.00 C ATOM 1198 CD LYS B 716 32.667 17.408 3.623 1.00 1.00 C ATOM 1199 CE LYS B 716 33.068 18.221 4.859 1.00 1.00 C ATOM 1200 NZ LYS B 716 33.535 19.580 4.445 1.00 1.00 N ATOM 0 H LYS B 716 31.079 13.723 6.280 1.00 1.00 H new ATOM 0 HA LYS B 716 32.384 16.201 6.501 1.00 1.00 H new ATOM 0 HB2 LYS B 716 30.750 14.720 4.547 1.00 1.00 H new ATOM 0 HB3 LYS B 716 30.417 16.440 4.478 1.00 1.00 H new ATOM 0 HG2 LYS B 716 33.317 15.584 4.592 1.00 1.00 H new ATOM 0 HG3 LYS B 716 32.456 15.319 3.089 1.00 1.00 H new ATOM 0 HD2 LYS B 716 33.436 17.498 2.855 1.00 1.00 H new ATOM 0 HD3 LYS B 716 31.746 17.808 3.200 1.00 1.00 H new ATOM 0 HE2 LYS B 716 32.220 18.310 5.538 1.00 1.00 H new ATOM 0 HE3 LYS B 716 33.859 17.705 5.403 1.00 1.00 H new ATOM 0 HZ1 LYS B 716 33.805 20.126 5.288 1.00 1.00 H new ATOM 0 HZ2 LYS B 716 34.357 19.487 3.814 1.00 1.00 H new ATOM 0 HZ3 LYS B 716 32.768 20.073 3.945 1.00 1.00 H new ATOM 1214 N LEU B 717 29.135 16.237 7.110 1.00 1.00 N ATOM 1215 CA LEU B 717 28.070 17.060 7.666 1.00 1.00 C ATOM 1216 C LEU B 717 28.422 17.534 9.072 1.00 1.00 C ATOM 1217 O LEU B 717 28.133 18.672 9.444 1.00 1.00 O ATOM 1218 CB LEU B 717 26.751 16.289 7.694 1.00 1.00 C ATOM 1219 CG LEU B 717 26.246 16.080 6.261 1.00 1.00 C ATOM 1220 CD1 LEU B 717 25.068 15.095 6.269 1.00 1.00 C ATOM 1221 CD2 LEU B 717 25.801 17.424 5.658 1.00 1.00 C ATOM 0 H LEU B 717 28.872 15.273 6.907 1.00 1.00 H new ATOM 0 HA LEU B 717 27.956 17.933 7.023 1.00 1.00 H new ATOM 0 HB2 LEU B 717 26.892 15.326 8.185 1.00 1.00 H new ATOM 0 HB3 LEU B 717 26.010 16.838 8.275 1.00 1.00 H new ATOM 0 HG LEU B 717 27.053 15.671 5.653 1.00 1.00 H new ATOM 0 HD11 LEU B 717 24.710 14.947 5.250 1.00 1.00 H new ATOM 0 HD12 LEU B 717 25.395 14.140 6.681 1.00 1.00 H new ATOM 0 HD13 LEU B 717 24.262 15.497 6.882 1.00 1.00 H new ATOM 0 HD21 LEU B 717 25.444 17.266 4.640 1.00 1.00 H new ATOM 0 HD22 LEU B 717 24.998 17.846 6.263 1.00 1.00 H new ATOM 0 HD23 LEU B 717 26.645 18.113 5.643 1.00 1.00 H new ATOM 1233 N LEU B 718 29.026 16.649 9.857 1.00 1.00 N ATOM 1234 CA LEU B 718 29.394 16.983 11.231 1.00 1.00 C ATOM 1235 C LEU B 718 30.399 18.137 11.264 1.00 1.00 C ATOM 1236 O LEU B 718 30.280 19.053 12.085 1.00 1.00 O ATOM 1237 CB LEU B 718 29.991 15.751 11.918 1.00 1.00 C ATOM 1238 CG LEU B 718 28.896 14.695 12.137 1.00 1.00 C ATOM 1239 CD1 LEU B 718 29.540 13.407 12.641 1.00 1.00 C ATOM 1240 CD2 LEU B 718 27.878 15.180 13.182 1.00 1.00 C ATOM 0 H LEU B 718 29.270 15.701 9.570 1.00 1.00 H new ATOM 0 HA LEU B 718 28.496 17.298 11.763 1.00 1.00 H new ATOM 0 HB2 LEU B 718 30.793 15.336 11.307 1.00 1.00 H new ATOM 0 HB3 LEU B 718 30.432 16.034 12.874 1.00 1.00 H new ATOM 0 HG LEU B 718 28.381 14.522 11.192 1.00 1.00 H new ATOM 0 HD11 LEU B 718 28.769 12.652 12.799 1.00 1.00 H new ATOM 0 HD12 LEU B 718 30.256 13.045 11.903 1.00 1.00 H new ATOM 0 HD13 LEU B 718 30.055 13.602 13.582 1.00 1.00 H new ATOM 0 HD21 LEU B 718 27.111 14.419 13.323 1.00 1.00 H new ATOM 0 HD22 LEU B 718 28.387 15.362 14.129 1.00 1.00 H new ATOM 0 HD23 LEU B 718 27.414 16.103 12.836 1.00 1.00 H new ATOM 1252 N ILE B 719 31.378 18.096 10.366 1.00 1.00 N ATOM 1253 CA ILE B 719 32.385 19.163 10.303 1.00 1.00 C ATOM 1254 C ILE B 719 31.730 20.494 9.906 1.00 1.00 C ATOM 1255 O ILE B 719 32.022 21.548 10.478 1.00 1.00 O ATOM 1256 CB ILE B 719 33.487 18.825 9.287 1.00 1.00 C ATOM 1257 CG1 ILE B 719 34.308 17.636 9.797 1.00 1.00 C ATOM 1258 CG2 ILE B 719 34.408 20.039 9.120 1.00 1.00 C ATOM 1259 CD1 ILE B 719 35.243 17.124 8.695 1.00 1.00 C ATOM 0 H ILE B 719 31.500 17.351 9.680 1.00 1.00 H new ATOM 0 HA ILE B 719 32.831 19.253 11.293 1.00 1.00 H new ATOM 0 HB ILE B 719 33.033 18.570 8.329 1.00 1.00 H new ATOM 0 HG12 ILE B 719 34.891 17.935 10.668 1.00 1.00 H new ATOM 0 HG13 ILE B 719 33.641 16.836 10.119 1.00 1.00 H new ATOM 0 HG21 ILE B 719 35.192 19.805 8.400 1.00 1.00 H new ATOM 0 HG22 ILE B 719 33.828 20.889 8.761 1.00 1.00 H new ATOM 0 HG23 ILE B 719 34.860 20.288 10.080 1.00 1.00 H new ATOM 0 HD11 ILE B 719 35.820 16.279 9.071 1.00 1.00 H new ATOM 0 HD12 ILE B 719 34.653 16.806 7.836 1.00 1.00 H new ATOM 0 HD13 ILE B 719 35.922 17.922 8.394 1.00 1.00 H new ATOM 1271 N THR B 720 30.844 20.439 8.917 1.00 1.00 N ATOM 1272 CA THR B 720 30.145 21.646 8.437 1.00 1.00 C ATOM 1273 C THR B 720 29.288 22.272 9.568 1.00 1.00 C ATOM 1274 O THR B 720 29.193 23.500 9.737 1.00 1.00 O ATOM 1275 CB THR B 720 29.226 21.280 7.265 1.00 1.00 C ATOM 1276 OG1 THR B 720 29.937 20.476 6.332 1.00 1.00 O ATOM 1277 CG2 THR B 720 28.745 22.550 6.555 1.00 1.00 C ATOM 0 H THR B 720 30.588 19.581 8.429 1.00 1.00 H new ATOM 0 HA THR B 720 30.895 22.369 8.116 1.00 1.00 H new ATOM 0 HB THR B 720 28.368 20.731 7.653 1.00 1.00 H new ATOM 0 HG1 THR B 720 29.986 19.555 6.664 1.00 1.00 H new ATOM 0 HG21 THR B 720 28.093 22.278 5.725 1.00 1.00 H new ATOM 0 HG22 THR B 720 28.195 23.174 7.259 1.00 1.00 H new ATOM 0 HG23 THR B 720 29.605 23.102 6.176 1.00 1.00 H new ATOM 1285 N ILE B 721 28.608 21.420 10.304 1.00 1.00 N ATOM 1286 CA ILE B 721 27.735 21.954 11.386 1.00 1.00 C ATOM 1287 C ILE B 721 28.556 22.707 12.443 1.00 1.00 C ATOM 1288 O ILE B 721 28.171 23.795 12.892 1.00 1.00 O ATOM 1289 CB ILE B 721 26.921 20.843 12.071 1.00 1.00 C ATOM 1290 CG1 ILE B 721 25.899 20.285 11.077 1.00 1.00 C ATOM 1291 CG2 ILE B 721 26.193 21.414 13.303 1.00 1.00 C ATOM 1292 CD1 ILE B 721 25.305 19.002 11.650 1.00 1.00 C ATOM 0 H ILE B 721 28.622 20.405 10.202 1.00 1.00 H new ATOM 0 HA ILE B 721 27.041 22.646 10.909 1.00 1.00 H new ATOM 0 HB ILE B 721 27.590 20.045 12.394 1.00 1.00 H new ATOM 0 HG12 ILE B 721 25.112 21.017 10.895 1.00 1.00 H new ATOM 0 HG13 ILE B 721 26.376 20.084 10.118 1.00 1.00 H new ATOM 0 HG21 ILE B 721 25.618 20.623 13.785 1.00 1.00 H new ATOM 0 HG22 ILE B 721 26.925 21.811 14.007 1.00 1.00 H new ATOM 0 HG23 ILE B 721 25.520 22.213 12.990 1.00 1.00 H new ATOM 0 HD11 ILE B 721 24.575 18.595 10.950 1.00 1.00 H new ATOM 0 HD12 ILE B 721 26.099 18.273 11.810 1.00 1.00 H new ATOM 0 HD13 ILE B 721 24.815 19.220 12.599 1.00 1.00 H new ATOM 1304 N HIS B 722 29.689 22.135 12.844 1.00 1.00 N ATOM 1305 CA HIS B 722 30.524 22.792 13.858 1.00 1.00 C ATOM 1306 C HIS B 722 31.080 24.100 13.302 1.00 1.00 C ATOM 1307 O HIS B 722 31.145 25.115 14.000 1.00 1.00 O ATOM 1308 CB HIS B 722 31.679 21.880 14.290 1.00 1.00 C ATOM 1309 CG HIS B 722 31.156 20.780 15.184 1.00 1.00 C ATOM 1310 ND1 HIS B 722 30.566 19.631 14.681 1.00 1.00 N ATOM 1311 CD2 HIS B 722 31.118 20.647 16.553 1.00 1.00 C ATOM 1312 CE1 HIS B 722 30.204 18.865 15.726 1.00 1.00 C ATOM 1313 NE2 HIS B 722 30.513 19.438 16.892 1.00 1.00 N ATOM 0 H HIS B 722 30.046 21.245 12.497 1.00 1.00 H new ATOM 0 HA HIS B 722 29.905 23.001 14.730 1.00 1.00 H new ATOM 0 HB2 HIS B 722 32.162 21.449 13.413 1.00 1.00 H new ATOM 0 HB3 HIS B 722 32.435 22.461 14.817 1.00 1.00 H new ATOM 0 HD1 HIS B 722 30.431 19.407 13.695 1.00 1.00 H new ATOM 0 HD2 HIS B 722 31.499 21.370 17.258 1.00 1.00 H new ATOM 0 HE1 HIS B 722 29.722 17.903 15.633 1.00 1.00 H new ATOM 1321 N ASP B 723 31.490 24.064 12.041 1.00 1.00 N ATOM 1322 CA ASP B 723 32.046 25.248 11.402 1.00 1.00 C ATOM 1323 C ASP B 723 30.976 26.328 11.277 1.00 1.00 C ATOM 1324 O ASP B 723 31.255 27.511 11.446 1.00 1.00 O ATOM 1325 CB ASP B 723 32.593 24.891 10.008 1.00 1.00 C ATOM 1326 CG ASP B 723 34.022 24.352 10.104 1.00 1.00 C ATOM 1327 OD1 ASP B 723 34.691 24.632 11.088 1.00 1.00 O ATOM 1328 OD2 ASP B 723 34.417 23.639 9.198 1.00 1.00 O ATOM 0 H ASP B 723 31.449 23.237 11.446 1.00 1.00 H new ATOM 0 HA ASP B 723 32.862 25.626 12.017 1.00 1.00 H new ATOM 0 HB2 ASP B 723 31.950 24.146 9.540 1.00 1.00 H new ATOM 0 HB3 ASP B 723 32.575 25.774 9.369 1.00 1.00 H new