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 86:sc= 1.23 USER MOD Single : A 987 MET CE :methyl -160:sc= -0.0605 (180deg=-0.7) 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= 0.921 USER MOD Single : B 701 MET CE :methyl 134:sc= -0.163 (180deg=-1.08) USER MOD Single : B 716 LYS NZ :NH3+ 180:sc= -0.188 (180deg=-0.188) USER MOD Single : B 720 THR OG1 : rot 81:sc= 1.06 USER MOD Single : B 722 HIS : no HE2:sc= 1.22 K(o=1.2,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 136 N ILE A 966 30.617 -18.446 -0.869 1.00 1.00 N ATOM 137 CA ILE A 966 30.745 -17.593 0.308 1.00 1.00 C ATOM 138 C ILE A 966 32.146 -16.994 0.447 1.00 1.00 C ATOM 139 O ILE A 966 32.287 -15.828 0.807 1.00 1.00 O ATOM 140 CB ILE A 966 30.413 -18.397 1.567 1.00 1.00 C ATOM 141 CG1 ILE A 966 28.923 -18.749 1.566 1.00 1.00 C ATOM 142 CG2 ILE A 966 30.739 -17.559 2.805 1.00 1.00 C ATOM 143 CD1 ILE A 966 28.639 -19.776 2.662 1.00 1.00 C ATOM 0 HA ILE A 966 30.043 -16.768 0.185 1.00 1.00 H new ATOM 0 HB ILE A 966 31.003 -19.313 1.583 1.00 1.00 H new ATOM 0 HG12 ILE A 966 28.327 -17.852 1.731 1.00 1.00 H new ATOM 0 HG13 ILE A 966 28.634 -19.150 0.594 1.00 1.00 H new ATOM 0 HG21 ILE A 966 30.503 -18.130 3.703 1.00 1.00 H new ATOM 0 HG22 ILE A 966 31.799 -17.306 2.804 1.00 1.00 H new ATOM 0 HG23 ILE A 966 30.147 -16.644 2.791 1.00 1.00 H new ATOM 0 HD11 ILE A 966 27.578 -20.026 2.660 1.00 1.00 H new ATOM 0 HD12 ILE A 966 29.224 -20.677 2.477 1.00 1.00 H new ATOM 0 HD13 ILE A 966 28.912 -19.359 3.631 1.00 1.00 H new ATOM 155 N TRP A 967 33.179 -17.793 0.208 1.00 1.00 N ATOM 156 CA TRP A 967 34.550 -17.307 0.366 1.00 1.00 C ATOM 157 C TRP A 967 34.816 -16.071 -0.493 1.00 1.00 C ATOM 158 O TRP A 967 35.505 -15.149 -0.059 1.00 1.00 O ATOM 159 CB TRP A 967 35.543 -18.404 -0.022 1.00 1.00 C ATOM 160 CG TRP A 967 35.470 -19.520 0.966 1.00 1.00 C ATOM 161 CD1 TRP A 967 34.900 -20.721 0.733 1.00 1.00 C ATOM 162 CD2 TRP A 967 35.969 -19.561 2.335 1.00 1.00 C ATOM 163 NE1 TRP A 967 35.016 -21.502 1.869 1.00 1.00 N ATOM 164 CE2 TRP A 967 35.668 -20.831 2.885 1.00 1.00 C ATOM 165 CE3 TRP A 967 36.647 -18.632 3.143 1.00 1.00 C ATOM 166 CZ2 TRP A 967 36.028 -21.165 4.191 1.00 1.00 C ATOM 167 CZ3 TRP A 967 37.010 -18.965 4.458 1.00 1.00 C ATOM 168 CH2 TRP A 967 36.701 -20.229 4.981 1.00 1.00 C ATOM 0 H TRP A 967 33.100 -18.765 -0.091 1.00 1.00 H new ATOM 0 HA TRP A 967 34.679 -17.034 1.413 1.00 1.00 H new ATOM 0 HB2 TRP A 967 35.318 -18.775 -1.022 1.00 1.00 H new ATOM 0 HB3 TRP A 967 36.554 -17.998 -0.053 1.00 1.00 H new ATOM 0 HD1 TRP A 967 34.429 -21.023 -0.191 1.00 1.00 H new ATOM 0 HE1 TRP A 967 34.663 -22.456 1.947 1.00 1.00 H new ATOM 0 HE3 TRP A 967 36.890 -17.656 2.750 1.00 1.00 H new ATOM 0 HZ2 TRP A 967 35.788 -22.140 4.589 1.00 1.00 H new ATOM 0 HZ3 TRP A 967 37.530 -18.243 5.070 1.00 1.00 H new ATOM 0 HH2 TRP A 967 36.983 -20.479 5.993 1.00 1.00 H new ATOM 179 N TRP A 968 34.277 -16.048 -1.707 1.00 1.00 N ATOM 180 CA TRP A 968 34.486 -14.905 -2.592 1.00 1.00 C ATOM 181 C TRP A 968 33.933 -13.621 -1.974 1.00 1.00 C ATOM 182 O TRP A 968 34.540 -12.557 -2.096 1.00 1.00 O ATOM 183 CB TRP A 968 33.822 -15.158 -3.946 1.00 1.00 C ATOM 184 CG TRP A 968 34.613 -16.177 -4.703 1.00 1.00 C ATOM 185 CD1 TRP A 968 34.286 -17.482 -4.823 1.00 1.00 C ATOM 186 CD2 TRP A 968 35.854 -15.996 -5.445 1.00 1.00 C ATOM 187 NE1 TRP A 968 35.246 -18.116 -5.591 1.00 1.00 N ATOM 188 CE2 TRP A 968 36.233 -17.242 -5.998 1.00 1.00 C ATOM 189 CE3 TRP A 968 36.679 -14.883 -5.689 1.00 1.00 C ATOM 190 CZ2 TRP A 968 37.390 -17.378 -6.768 1.00 1.00 C ATOM 191 CZ3 TRP A 968 37.844 -15.017 -6.462 1.00 1.00 C ATOM 192 CH2 TRP A 968 38.198 -16.262 -7.000 1.00 1.00 C ATOM 0 H TRP A 968 33.701 -16.794 -2.097 1.00 1.00 H new ATOM 0 HA TRP A 968 35.560 -14.782 -2.735 1.00 1.00 H new ATOM 0 HB2 TRP A 968 32.800 -15.508 -3.803 1.00 1.00 H new ATOM 0 HB3 TRP A 968 33.765 -14.230 -4.515 1.00 1.00 H new ATOM 0 HD1 TRP A 968 33.416 -17.954 -4.390 1.00 1.00 H new ATOM 0 HE1 TRP A 968 35.227 -19.108 -5.827 1.00 1.00 H new ATOM 0 HE3 TRP A 968 36.415 -13.919 -5.279 1.00 1.00 H new ATOM 0 HZ2 TRP A 968 37.658 -18.339 -7.181 1.00 1.00 H new ATOM 0 HZ3 TRP A 968 38.470 -14.156 -6.643 1.00 1.00 H new ATOM 0 HH2 TRP A 968 39.095 -16.359 -7.594 1.00 1.00 H new ATOM 203 N VAL A 969 32.784 -13.725 -1.313 1.00 1.00 N ATOM 204 CA VAL A 969 32.168 -12.559 -0.685 1.00 1.00 C ATOM 205 C VAL A 969 33.067 -11.997 0.414 1.00 1.00 C ATOM 206 O VAL A 969 33.270 -10.788 0.506 1.00 1.00 O ATOM 207 CB VAL A 969 30.808 -12.935 -0.095 1.00 1.00 C ATOM 208 CG1 VAL A 969 30.285 -11.780 0.759 1.00 1.00 C ATOM 209 CG2 VAL A 969 29.821 -13.207 -1.232 1.00 1.00 C ATOM 0 H VAL A 969 32.264 -14.595 -1.198 1.00 1.00 H new ATOM 0 HA VAL A 969 32.031 -11.794 -1.449 1.00 1.00 H new ATOM 0 HB VAL A 969 30.914 -13.827 0.523 1.00 1.00 H new ATOM 0 HG11 VAL A 969 29.316 -12.048 1.179 1.00 1.00 H new ATOM 0 HG12 VAL A 969 30.988 -11.578 1.567 1.00 1.00 H new ATOM 0 HG13 VAL A 969 30.178 -10.889 0.140 1.00 1.00 H new ATOM 0 HG21 VAL A 969 28.850 -13.475 -0.815 1.00 1.00 H new ATOM 0 HG22 VAL A 969 29.717 -12.312 -1.846 1.00 1.00 H new ATOM 0 HG23 VAL A 969 30.191 -14.028 -1.847 1.00 1.00 H new ATOM 219 N LEU A 970 33.607 -12.885 1.242 1.00 1.00 N ATOM 220 CA LEU A 970 34.489 -12.467 2.328 1.00 1.00 C ATOM 221 C LEU A 970 35.743 -11.799 1.775 1.00 1.00 C ATOM 222 O LEU A 970 36.215 -10.802 2.319 1.00 1.00 O ATOM 223 CB LEU A 970 34.886 -13.667 3.196 1.00 1.00 C ATOM 224 CG LEU A 970 33.802 -13.968 4.248 1.00 1.00 C ATOM 225 CD1 LEU A 970 33.847 -12.924 5.371 1.00 1.00 C ATOM 226 CD2 LEU A 970 32.411 -13.955 3.604 1.00 1.00 C ATOM 0 H LEU A 970 33.452 -13.891 1.184 1.00 1.00 H new ATOM 0 HA LEU A 970 33.946 -11.749 2.943 1.00 1.00 H new ATOM 0 HB2 LEU A 970 35.039 -14.542 2.565 1.00 1.00 H new ATOM 0 HB3 LEU A 970 35.834 -13.463 3.693 1.00 1.00 H new ATOM 0 HG LEU A 970 33.997 -14.957 4.663 1.00 1.00 H new ATOM 0 HD11 LEU A 970 33.076 -13.149 6.108 1.00 1.00 H new ATOM 0 HD12 LEU A 970 34.825 -12.948 5.851 1.00 1.00 H new ATOM 0 HD13 LEU A 970 33.672 -11.933 4.953 1.00 1.00 H new ATOM 0 HD21 LEU A 970 31.657 -14.170 4.362 1.00 1.00 H new ATOM 0 HD22 LEU A 970 32.220 -12.974 3.170 1.00 1.00 H new ATOM 0 HD23 LEU A 970 32.365 -14.713 2.822 1.00 1.00 H new ATOM 238 N VAL A 971 36.283 -12.355 0.696 1.00 1.00 N ATOM 239 CA VAL A 971 37.488 -11.797 0.092 1.00 1.00 C ATOM 240 C VAL A 971 37.233 -10.371 -0.384 1.00 1.00 C ATOM 241 O VAL A 971 38.039 -9.473 -0.135 1.00 1.00 O ATOM 242 CB VAL A 971 37.926 -12.662 -1.091 1.00 1.00 C ATOM 243 CG1 VAL A 971 39.060 -11.966 -1.843 1.00 1.00 C ATOM 244 CG2 VAL A 971 38.412 -14.018 -0.576 1.00 1.00 C ATOM 0 H VAL A 971 35.912 -13.181 0.226 1.00 1.00 H new ATOM 0 HA VAL A 971 38.278 -11.783 0.843 1.00 1.00 H new ATOM 0 HB VAL A 971 37.082 -12.809 -1.765 1.00 1.00 H new ATOM 0 HG11 VAL A 971 39.371 -12.584 -2.686 1.00 1.00 H new ATOM 0 HG12 VAL A 971 38.714 -11.000 -2.210 1.00 1.00 H new ATOM 0 HG13 VAL A 971 39.905 -11.818 -1.171 1.00 1.00 H new ATOM 0 HG21 VAL A 971 38.725 -14.636 -1.418 1.00 1.00 H new ATOM 0 HG22 VAL A 971 39.255 -13.870 0.099 1.00 1.00 H new ATOM 0 HG23 VAL A 971 37.603 -14.515 -0.041 1.00 1.00 H new ATOM 254 N GLY A 972 36.106 -10.164 -1.058 1.00 1.00 N ATOM 255 CA GLY A 972 35.759 -8.833 -1.546 1.00 1.00 C ATOM 256 C GLY A 972 35.544 -7.876 -0.379 1.00 1.00 C ATOM 257 O GLY A 972 35.929 -6.710 -0.434 1.00 1.00 O ATOM 0 H GLY A 972 35.425 -10.891 -1.277 1.00 1.00 H new ATOM 0 HA2 GLY A 972 36.553 -8.457 -2.191 1.00 1.00 H new ATOM 0 HA3 GLY A 972 34.855 -8.886 -2.152 1.00 1.00 H new ATOM 261 N VAL A 973 34.928 -8.388 0.680 1.00 1.00 N ATOM 262 CA VAL A 973 34.662 -7.585 1.867 1.00 1.00 C ATOM 263 C VAL A 973 35.967 -7.127 2.519 1.00 1.00 C ATOM 264 O VAL A 973 36.101 -5.966 2.911 1.00 1.00 O ATOM 265 CB VAL A 973 33.835 -8.398 2.865 1.00 1.00 C ATOM 266 CG1 VAL A 973 33.762 -7.652 4.197 1.00 1.00 C ATOM 267 CG2 VAL A 973 32.421 -8.589 2.312 1.00 1.00 C ATOM 0 H VAL A 973 34.604 -9.353 0.741 1.00 1.00 H new ATOM 0 HA VAL A 973 34.101 -6.699 1.568 1.00 1.00 H new ATOM 0 HB VAL A 973 34.304 -9.370 3.019 1.00 1.00 H new ATOM 0 HG11 VAL A 973 33.173 -8.232 4.907 1.00 1.00 H new ATOM 0 HG12 VAL A 973 34.769 -7.511 4.591 1.00 1.00 H new ATOM 0 HG13 VAL A 973 33.293 -6.680 4.044 1.00 1.00 H new ATOM 0 HG21 VAL A 973 31.828 -9.168 3.020 1.00 1.00 H new ATOM 0 HG22 VAL A 973 31.955 -7.615 2.160 1.00 1.00 H new ATOM 0 HG23 VAL A 973 32.471 -9.120 1.361 1.00 1.00 H new ATOM 277 N LEU A 974 36.927 -8.040 2.632 1.00 1.00 N ATOM 278 CA LEU A 974 38.211 -7.703 3.240 1.00 1.00 C ATOM 279 C LEU A 974 38.899 -6.616 2.420 1.00 1.00 C ATOM 280 O LEU A 974 39.435 -5.654 2.969 1.00 1.00 O ATOM 281 CB LEU A 974 39.101 -8.951 3.298 1.00 1.00 C ATOM 282 CG LEU A 974 40.461 -8.613 3.923 1.00 1.00 C ATOM 283 CD1 LEU A 974 40.264 -8.030 5.325 1.00 1.00 C ATOM 284 CD2 LEU A 974 41.300 -9.890 4.018 1.00 1.00 C ATOM 0 H LEU A 974 36.843 -9.006 2.316 1.00 1.00 H new ATOM 0 HA LEU A 974 38.043 -7.336 4.253 1.00 1.00 H new ATOM 0 HB2 LEU A 974 38.609 -9.729 3.882 1.00 1.00 H new ATOM 0 HB3 LEU A 974 39.245 -9.349 2.294 1.00 1.00 H new ATOM 0 HG LEU A 974 40.971 -7.878 3.300 1.00 1.00 H new ATOM 0 HD11 LEU A 974 41.235 -7.793 5.760 1.00 1.00 H new ATOM 0 HD12 LEU A 974 39.664 -7.122 5.261 1.00 1.00 H new ATOM 0 HD13 LEU A 974 39.753 -8.759 5.954 1.00 1.00 H new ATOM 0 HD21 LEU A 974 42.268 -9.657 4.461 1.00 1.00 H new ATOM 0 HD22 LEU A 974 40.782 -10.620 4.640 1.00 1.00 H new ATOM 0 HD23 LEU A 974 41.448 -10.303 3.020 1.00 1.00 H new ATOM 296 N GLY A 975 38.851 -6.769 1.102 1.00 1.00 N ATOM 297 CA GLY A 975 39.445 -5.789 0.201 1.00 1.00 C ATOM 298 C GLY A 975 38.731 -4.454 0.356 1.00 1.00 C ATOM 299 O GLY A 975 39.325 -3.385 0.205 1.00 1.00 O ATOM 0 H GLY A 975 38.408 -7.560 0.634 1.00 1.00 H new ATOM 0 HA2 GLY A 975 40.506 -5.673 0.422 1.00 1.00 H new ATOM 0 HA3 GLY A 975 39.370 -6.135 -0.830 1.00 1.00 H new ATOM 303 N GLY A 976 37.440 -4.538 0.648 1.00 1.00 N ATOM 304 CA GLY A 976 36.617 -3.350 0.817 1.00 1.00 C ATOM 305 C GLY A 976 37.114 -2.492 1.972 1.00 1.00 C ATOM 306 O GLY A 976 37.044 -1.263 1.922 1.00 1.00 O ATOM 0 H GLY A 976 36.940 -5.418 0.773 1.00 1.00 H new ATOM 0 HA2 GLY A 976 36.625 -2.765 -0.103 1.00 1.00 H new ATOM 0 HA3 GLY A 976 35.583 -3.644 0.998 1.00 1.00 H new ATOM 310 N LEU A 977 37.616 -3.149 3.008 1.00 1.00 N ATOM 311 CA LEU A 977 38.127 -2.446 4.178 1.00 1.00 C ATOM 312 C LEU A 977 39.303 -1.562 3.776 1.00 1.00 C ATOM 313 O LEU A 977 39.438 -0.431 4.244 1.00 1.00 O ATOM 314 CB LEU A 977 38.568 -3.466 5.236 1.00 1.00 C ATOM 315 CG LEU A 977 39.129 -2.753 6.473 1.00 1.00 C ATOM 316 CD1 LEU A 977 38.079 -1.804 7.057 1.00 1.00 C ATOM 317 CD2 LEU A 977 39.507 -3.797 7.530 1.00 1.00 C ATOM 0 H LEU A 977 37.681 -4.165 3.063 1.00 1.00 H new ATOM 0 HA LEU A 977 37.342 -1.816 4.596 1.00 1.00 H new ATOM 0 HB2 LEU A 977 37.722 -4.090 5.522 1.00 1.00 H new ATOM 0 HB3 LEU A 977 39.325 -4.128 4.817 1.00 1.00 H new ATOM 0 HG LEU A 977 40.009 -2.178 6.184 1.00 1.00 H new ATOM 0 HD11 LEU A 977 38.489 -1.304 7.934 1.00 1.00 H new ATOM 0 HD12 LEU A 977 37.806 -1.059 6.309 1.00 1.00 H new ATOM 0 HD13 LEU A 977 37.194 -2.372 7.343 1.00 1.00 H new ATOM 0 HD21 LEU A 977 39.906 -3.295 8.411 1.00 1.00 H new ATOM 0 HD22 LEU A 977 38.622 -4.370 7.808 1.00 1.00 H new ATOM 0 HD23 LEU A 977 40.262 -4.470 7.123 1.00 1.00 H new ATOM 329 N LEU A 978 40.149 -2.094 2.904 1.00 1.00 N ATOM 330 CA LEU A 978 41.318 -1.363 2.428 1.00 1.00 C ATOM 331 C LEU A 978 40.895 -0.094 1.689 1.00 1.00 C ATOM 332 O LEU A 978 41.521 0.955 1.838 1.00 1.00 O ATOM 333 CB LEU A 978 42.146 -2.261 1.498 1.00 1.00 C ATOM 334 CG LEU A 978 43.379 -1.508 0.974 1.00 1.00 C ATOM 335 CD1 LEU A 978 44.233 -1.020 2.147 1.00 1.00 C ATOM 336 CD2 LEU A 978 44.213 -2.452 0.105 1.00 1.00 C ATOM 0 H LEU A 978 40.048 -3.030 2.511 1.00 1.00 H new ATOM 0 HA LEU A 978 41.925 -1.075 3.287 1.00 1.00 H new ATOM 0 HB2 LEU A 978 42.461 -3.156 2.034 1.00 1.00 H new ATOM 0 HB3 LEU A 978 41.531 -2.591 0.660 1.00 1.00 H new ATOM 0 HG LEU A 978 43.052 -0.650 0.387 1.00 1.00 H new ATOM 0 HD11 LEU A 978 45.104 -0.488 1.766 1.00 1.00 H new ATOM 0 HD12 LEU A 978 43.643 -0.350 2.772 1.00 1.00 H new ATOM 0 HD13 LEU A 978 44.560 -1.875 2.739 1.00 1.00 H new ATOM 0 HD21 LEU A 978 45.089 -1.923 -0.270 1.00 1.00 H new ATOM 0 HD22 LEU A 978 44.533 -3.307 0.700 1.00 1.00 H new ATOM 0 HD23 LEU A 978 43.612 -2.799 -0.736 1.00 1.00 H new ATOM 348 N LEU A 979 39.842 -0.194 0.878 1.00 1.00 N ATOM 349 CA LEU A 979 39.376 0.964 0.113 1.00 1.00 C ATOM 350 C LEU A 979 38.942 2.097 1.039 1.00 1.00 C ATOM 351 O LEU A 979 39.273 3.259 0.804 1.00 1.00 O ATOM 352 CB LEU A 979 38.169 0.561 -0.740 1.00 1.00 C ATOM 353 CG LEU A 979 38.619 -0.196 -1.990 1.00 1.00 C ATOM 354 CD1 LEU A 979 37.403 -0.887 -2.606 1.00 1.00 C ATOM 355 CD2 LEU A 979 39.209 0.777 -3.019 1.00 1.00 C ATOM 0 H LEU A 979 39.303 -1.048 0.734 1.00 1.00 H new ATOM 0 HA LEU A 979 40.201 1.305 -0.513 1.00 1.00 H new ATOM 0 HB2 LEU A 979 37.495 -0.064 -0.153 1.00 1.00 H new ATOM 0 HB3 LEU A 979 37.609 1.450 -1.029 1.00 1.00 H new ATOM 0 HG LEU A 979 39.380 -0.926 -1.714 1.00 1.00 H new ATOM 0 HD11 LEU A 979 37.708 -1.432 -3.500 1.00 1.00 H new ATOM 0 HD12 LEU A 979 36.976 -1.583 -1.884 1.00 1.00 H new ATOM 0 HD13 LEU A 979 36.657 -0.139 -2.874 1.00 1.00 H new ATOM 0 HD21 LEU A 979 39.525 0.224 -3.903 1.00 1.00 H new ATOM 0 HD22 LEU A 979 38.454 1.511 -3.301 1.00 1.00 H new ATOM 0 HD23 LEU A 979 40.068 1.289 -2.585 1.00 1.00 H new ATOM 367 N LEU A 980 38.204 1.756 2.088 1.00 1.00 N ATOM 368 CA LEU A 980 37.740 2.765 3.032 1.00 1.00 C ATOM 369 C LEU A 980 38.927 3.409 3.743 1.00 1.00 C ATOM 370 O LEU A 980 38.965 4.623 3.947 1.00 1.00 O ATOM 371 CB LEU A 980 36.793 2.132 4.060 1.00 1.00 C ATOM 372 CG LEU A 980 36.232 3.211 4.995 1.00 1.00 C ATOM 373 CD1 LEU A 980 35.423 4.232 4.186 1.00 1.00 C ATOM 374 CD2 LEU A 980 35.322 2.551 6.037 1.00 1.00 C ATOM 0 H LEU A 980 37.917 0.802 2.305 1.00 1.00 H new ATOM 0 HA LEU A 980 37.200 3.535 2.481 1.00 1.00 H new ATOM 0 HB2 LEU A 980 35.976 1.623 3.548 1.00 1.00 H new ATOM 0 HB3 LEU A 980 37.325 1.378 4.640 1.00 1.00 H new ATOM 0 HG LEU A 980 37.056 3.721 5.494 1.00 1.00 H new ATOM 0 HD11 LEU A 980 35.027 4.996 4.856 1.00 1.00 H new ATOM 0 HD12 LEU A 980 36.068 4.700 3.442 1.00 1.00 H new ATOM 0 HD13 LEU A 980 34.598 3.727 3.684 1.00 1.00 H new ATOM 0 HD21 LEU A 980 34.920 3.313 6.704 1.00 1.00 H new ATOM 0 HD22 LEU A 980 34.501 2.041 5.533 1.00 1.00 H new ATOM 0 HD23 LEU A 980 35.897 1.828 6.616 1.00 1.00 H new ATOM 386 N THR A 981 39.884 2.574 4.131 1.00 1.00 N ATOM 387 CA THR A 981 41.076 3.041 4.833 1.00 1.00 C ATOM 388 C THR A 981 41.879 4.016 3.982 1.00 1.00 C ATOM 389 O THR A 981 42.329 5.052 4.474 1.00 1.00 O ATOM 390 CB THR A 981 41.953 1.847 5.220 1.00 1.00 C ATOM 391 OG1 THR A 981 41.154 0.859 5.854 1.00 1.00 O ATOM 392 CG2 THR A 981 43.060 2.307 6.168 1.00 1.00 C ATOM 0 H THR A 981 39.858 1.567 3.971 1.00 1.00 H new ATOM 0 HA THR A 981 40.752 3.566 5.732 1.00 1.00 H new ATOM 0 HB THR A 981 42.406 1.423 4.324 1.00 1.00 H new ATOM 0 HG1 THR A 981 40.754 0.276 5.175 1.00 1.00 H new ATOM 0 HG21 THR A 981 43.682 1.455 6.441 1.00 1.00 H new ATOM 0 HG22 THR A 981 43.673 3.060 5.673 1.00 1.00 H new ATOM 0 HG23 THR A 981 42.615 2.735 7.067 1.00 1.00 H new ATOM 400 N ILE A 982 42.069 3.681 2.711 1.00 1.00 N ATOM 401 CA ILE A 982 42.835 4.543 1.820 1.00 1.00 C ATOM 402 C ILE A 982 42.149 5.896 1.650 1.00 1.00 C ATOM 403 O ILE A 982 42.804 6.938 1.702 1.00 1.00 O ATOM 404 CB ILE A 982 42.989 3.874 0.455 1.00 1.00 C ATOM 405 CG1 ILE A 982 43.896 2.647 0.588 1.00 1.00 C ATOM 406 CG2 ILE A 982 43.611 4.864 -0.529 1.00 1.00 C ATOM 407 CD1 ILE A 982 43.827 1.821 -0.698 1.00 1.00 C ATOM 0 H ILE A 982 41.708 2.830 2.279 1.00 1.00 H new ATOM 0 HA ILE A 982 43.818 4.704 2.262 1.00 1.00 H new ATOM 0 HB ILE A 982 42.010 3.564 0.089 1.00 1.00 H new ATOM 0 HG12 ILE A 982 44.923 2.959 0.778 1.00 1.00 H new ATOM 0 HG13 ILE A 982 43.584 2.042 1.439 1.00 1.00 H new ATOM 0 HG21 ILE A 982 43.721 4.388 -1.503 1.00 1.00 H new ATOM 0 HG22 ILE A 982 42.966 5.738 -0.623 1.00 1.00 H new ATOM 0 HG23 ILE A 982 44.590 5.174 -0.164 1.00 1.00 H new ATOM 0 HD11 ILE A 982 44.472 0.947 -0.604 1.00 1.00 H new ATOM 0 HD12 ILE A 982 42.800 1.497 -0.868 1.00 1.00 H new ATOM 0 HD13 ILE A 982 44.159 2.429 -1.539 1.00 1.00 H new ATOM 419 N LEU A 983 40.832 5.879 1.460 1.00 1.00 N ATOM 420 CA LEU A 983 40.087 7.123 1.296 1.00 1.00 C ATOM 421 C LEU A 983 40.183 7.966 2.563 1.00 1.00 C ATOM 422 O LEU A 983 40.370 9.180 2.502 1.00 1.00 O ATOM 423 CB LEU A 983 38.616 6.820 0.996 1.00 1.00 C ATOM 424 CG LEU A 983 38.486 6.202 -0.401 1.00 1.00 C ATOM 425 CD1 LEU A 983 37.054 5.707 -0.602 1.00 1.00 C ATOM 426 CD2 LEU A 983 38.823 7.240 -1.479 1.00 1.00 C ATOM 0 H LEU A 983 40.266 5.031 1.416 1.00 1.00 H new ATOM 0 HA LEU A 983 40.518 7.678 0.463 1.00 1.00 H new ATOM 0 HB2 LEU A 983 38.216 6.136 1.745 1.00 1.00 H new ATOM 0 HB3 LEU A 983 38.028 7.736 1.055 1.00 1.00 H new ATOM 0 HG LEU A 983 39.183 5.369 -0.486 1.00 1.00 H new ATOM 0 HD11 LEU A 983 36.957 5.267 -1.594 1.00 1.00 H new ATOM 0 HD12 LEU A 983 36.819 4.956 0.153 1.00 1.00 H new ATOM 0 HD13 LEU A 983 36.363 6.545 -0.508 1.00 1.00 H new ATOM 0 HD21 LEU A 983 38.726 6.785 -2.465 1.00 1.00 H new ATOM 0 HD22 LEU A 983 38.137 8.083 -1.399 1.00 1.00 H new ATOM 0 HD23 LEU A 983 39.846 7.590 -1.340 1.00 1.00 H new ATOM 438 N VAL A 984 40.062 7.304 3.709 1.00 1.00 N ATOM 439 CA VAL A 984 40.141 7.986 4.996 1.00 1.00 C ATOM 440 C VAL A 984 41.526 8.586 5.207 1.00 1.00 C ATOM 441 O VAL A 984 41.663 9.719 5.669 1.00 1.00 O ATOM 442 CB VAL A 984 39.835 7.001 6.126 1.00 1.00 C ATOM 443 CG1 VAL A 984 40.122 7.665 7.475 1.00 1.00 C ATOM 444 CG2 VAL A 984 38.363 6.595 6.056 1.00 1.00 C ATOM 0 H VAL A 984 39.909 6.298 3.773 1.00 1.00 H new ATOM 0 HA VAL A 984 39.406 8.791 5.002 1.00 1.00 H new ATOM 0 HB VAL A 984 40.462 6.116 6.020 1.00 1.00 H new ATOM 0 HG11 VAL A 984 39.904 6.963 8.280 1.00 1.00 H new ATOM 0 HG12 VAL A 984 41.172 7.956 7.522 1.00 1.00 H new ATOM 0 HG13 VAL A 984 39.495 8.550 7.586 1.00 1.00 H new ATOM 0 HG21 VAL A 984 38.141 5.893 6.860 1.00 1.00 H new ATOM 0 HG22 VAL A 984 37.736 7.480 6.163 1.00 1.00 H new ATOM 0 HG23 VAL A 984 38.161 6.122 5.095 1.00 1.00 H new ATOM 454 N LEU A 985 42.550 7.807 4.880 1.00 1.00 N ATOM 455 CA LEU A 985 43.928 8.251 5.052 1.00 1.00 C ATOM 456 C LEU A 985 44.221 9.481 4.198 1.00 1.00 C ATOM 457 O LEU A 985 44.875 10.417 4.656 1.00 1.00 O ATOM 458 CB LEU A 985 44.885 7.111 4.668 1.00 1.00 C ATOM 459 CG LEU A 985 46.347 7.556 4.813 1.00 1.00 C ATOM 460 CD1 LEU A 985 46.614 8.028 6.243 1.00 1.00 C ATOM 461 CD2 LEU A 985 47.270 6.375 4.494 1.00 1.00 C ATOM 0 H LEU A 985 42.453 6.867 4.495 1.00 1.00 H new ATOM 0 HA LEU A 985 44.075 8.522 6.098 1.00 1.00 H new ATOM 0 HB2 LEU A 985 44.699 6.244 5.303 1.00 1.00 H new ATOM 0 HB3 LEU A 985 44.695 6.801 3.641 1.00 1.00 H new ATOM 0 HG LEU A 985 46.539 8.377 4.122 1.00 1.00 H new ATOM 0 HD11 LEU A 985 47.654 8.341 6.335 1.00 1.00 H new ATOM 0 HD12 LEU A 985 45.960 8.868 6.477 1.00 1.00 H new ATOM 0 HD13 LEU A 985 46.419 7.211 6.938 1.00 1.00 H new ATOM 0 HD21 LEU A 985 48.309 6.688 4.596 1.00 1.00 H new ATOM 0 HD22 LEU A 985 47.067 5.558 5.186 1.00 1.00 H new ATOM 0 HD23 LEU A 985 47.091 6.039 3.473 1.00 1.00 H new ATOM 473 N ALA A 986 43.747 9.479 2.958 1.00 1.00 N ATOM 474 CA ALA A 986 43.994 10.610 2.071 1.00 1.00 C ATOM 475 C ALA A 986 43.369 11.892 2.618 1.00 1.00 C ATOM 476 O ALA A 986 43.992 12.955 2.582 1.00 1.00 O ATOM 477 CB ALA A 986 43.423 10.319 0.683 1.00 1.00 C ATOM 0 H ALA A 986 43.199 8.722 2.549 1.00 1.00 H new ATOM 0 HA ALA A 986 45.072 10.753 2.005 1.00 1.00 H new ATOM 0 HB1 ALA A 986 43.612 11.168 0.027 1.00 1.00 H new ATOM 0 HB2 ALA A 986 43.901 9.430 0.272 1.00 1.00 H new ATOM 0 HB3 ALA A 986 42.349 10.151 0.759 1.00 1.00 H new ATOM 483 N MET A 987 42.145 11.796 3.132 1.00 1.00 N ATOM 484 CA MET A 987 41.478 12.973 3.690 1.00 1.00 C ATOM 485 C MET A 987 42.204 13.467 4.940 1.00 1.00 C ATOM 486 O MET A 987 42.380 14.666 5.135 1.00 1.00 O ATOM 487 CB MET A 987 40.021 12.642 4.040 1.00 1.00 C ATOM 488 CG MET A 987 39.237 12.267 2.775 1.00 1.00 C ATOM 489 SD MET A 987 39.194 13.668 1.620 1.00 1.00 S ATOM 490 CE MET A 987 38.036 14.721 2.533 1.00 1.00 C ATOM 0 H MET A 987 41.602 10.934 3.175 1.00 1.00 H new ATOM 0 HA MET A 987 41.499 13.761 2.937 1.00 1.00 H new ATOM 0 HB2 MET A 987 39.990 11.817 4.752 1.00 1.00 H new ATOM 0 HB3 MET A 987 39.553 13.499 4.524 1.00 1.00 H new ATOM 0 HG2 MET A 987 39.700 11.405 2.294 1.00 1.00 H new ATOM 0 HG3 MET A 987 38.221 11.976 3.042 1.00 1.00 H new ATOM 0 HE1 MET A 987 37.600 15.455 1.855 1.00 1.00 H new ATOM 0 HE2 MET A 987 37.244 14.106 2.960 1.00 1.00 H new ATOM 0 HE3 MET A 987 38.566 15.236 3.334 1.00 1.00 H new ATOM 500 N TRP A 988 42.632 12.528 5.770 1.00 1.00 N ATOM 501 CA TRP A 988 43.350 12.860 6.996 1.00 1.00 C ATOM 502 C TRP A 988 44.670 13.557 6.669 1.00 1.00 C ATOM 503 O TRP A 988 45.100 14.471 7.371 1.00 1.00 O ATOM 504 CB TRP A 988 43.620 11.591 7.807 1.00 1.00 C ATOM 505 CG TRP A 988 44.579 11.877 8.927 1.00 1.00 C ATOM 506 CD1 TRP A 988 44.686 13.055 9.593 1.00 1.00 C ATOM 507 CD2 TRP A 988 45.565 10.982 9.522 1.00 1.00 C ATOM 508 NE1 TRP A 988 45.677 12.936 10.553 1.00 1.00 N ATOM 509 CE2 TRP A 988 46.248 11.679 10.549 1.00 1.00 C ATOM 510 CE3 TRP A 988 45.932 9.647 9.272 1.00 1.00 C ATOM 511 CZ2 TRP A 988 47.258 11.072 11.299 1.00 1.00 C ATOM 512 CZ3 TRP A 988 46.946 9.033 10.027 1.00 1.00 C ATOM 513 CH2 TRP A 988 47.609 9.744 11.038 1.00 1.00 C ATOM 0 H TRP A 988 42.496 11.529 5.619 1.00 1.00 H new ATOM 0 HA TRP A 988 42.732 13.537 7.587 1.00 1.00 H new ATOM 0 HB2 TRP A 988 42.684 11.205 8.211 1.00 1.00 H new ATOM 0 HB3 TRP A 988 44.030 10.818 7.158 1.00 1.00 H new ATOM 0 HD1 TRP A 988 44.095 13.940 9.405 1.00 1.00 H new ATOM 0 HE1 TRP A 988 45.952 13.687 11.187 1.00 1.00 H new ATOM 0 HE3 TRP A 988 45.431 9.090 8.494 1.00 1.00 H new ATOM 0 HZ2 TRP A 988 47.765 11.625 12.076 1.00 1.00 H new ATOM 0 HZ3 TRP A 988 47.217 8.007 9.827 1.00 1.00 H new ATOM 0 HH2 TRP A 988 48.389 9.267 11.613 1.00 1.00 H new ATOM 524 N LYS A 989 45.318 13.088 5.610 1.00 1.00 N ATOM 525 CA LYS A 989 46.608 13.631 5.198 1.00 1.00 C ATOM 526 C LYS A 989 46.467 15.084 4.735 1.00 1.00 C ATOM 527 O LYS A 989 47.465 15.779 4.548 1.00 1.00 O ATOM 528 CB LYS A 989 47.175 12.787 4.045 1.00 1.00 C ATOM 529 CG LYS A 989 48.502 12.090 4.437 1.00 1.00 C ATOM 530 CD LYS A 989 49.725 13.018 4.238 1.00 1.00 C ATOM 531 CE LYS A 989 49.982 13.876 5.486 1.00 1.00 C ATOM 532 NZ LYS A 989 51.330 14.501 5.382 1.00 1.00 N ATOM 0 H LYS A 989 44.972 12.332 5.020 1.00 1.00 H new ATOM 0 HA LYS A 989 47.283 13.600 6.053 1.00 1.00 H new ATOM 0 HB2 LYS A 989 46.443 12.035 3.752 1.00 1.00 H new ATOM 0 HB3 LYS A 989 47.342 13.424 3.177 1.00 1.00 H new ATOM 0 HG2 LYS A 989 48.452 11.775 5.479 1.00 1.00 H new ATOM 0 HG3 LYS A 989 48.629 11.189 3.837 1.00 1.00 H new ATOM 0 HD2 LYS A 989 50.608 12.418 4.018 1.00 1.00 H new ATOM 0 HD3 LYS A 989 49.557 13.665 3.377 1.00 1.00 H new ATOM 0 HE2 LYS A 989 49.217 14.647 5.576 1.00 1.00 H new ATOM 0 HE3 LYS A 989 49.922 13.261 6.384 1.00 1.00 H new ATOM 0 HZ1 LYS A 989 51.509 15.083 6.225 1.00 1.00 H new ATOM 0 HZ2 LYS A 989 52.053 13.757 5.315 1.00 1.00 H new ATOM 0 HZ3 LYS A 989 51.370 15.100 4.533 1.00 1.00 H new ATOM 546 N VAL A 990 45.234 15.547 4.546 1.00 1.00 N ATOM 547 CA VAL A 990 45.021 16.919 4.108 1.00 1.00 C ATOM 548 C VAL A 990 44.924 17.834 5.320 1.00 1.00 C ATOM 549 O VAL A 990 45.079 19.050 5.212 1.00 1.00 O ATOM 550 CB VAL A 990 43.741 17.024 3.275 1.00 1.00 C ATOM 551 CG1 VAL A 990 43.348 18.495 3.130 1.00 1.00 C ATOM 552 CG2 VAL A 990 43.982 16.421 1.890 1.00 1.00 C ATOM 0 H VAL A 990 44.383 15.002 4.687 1.00 1.00 H new ATOM 0 HA VAL A 990 45.865 17.224 3.489 1.00 1.00 H new ATOM 0 HB VAL A 990 42.938 16.480 3.772 1.00 1.00 H new ATOM 0 HG11 VAL A 990 42.437 18.571 2.537 1.00 1.00 H new ATOM 0 HG12 VAL A 990 43.176 18.925 4.117 1.00 1.00 H new ATOM 0 HG13 VAL A 990 44.151 19.039 2.633 1.00 1.00 H new ATOM 0 HG21 VAL A 990 43.071 16.496 1.297 1.00 1.00 H new ATOM 0 HG22 VAL A 990 44.785 16.964 1.391 1.00 1.00 H new ATOM 0 HG23 VAL A 990 44.263 15.373 1.993 1.00 1.00 H new ATOM 562 N GLY A 991 44.666 17.233 6.476 1.00 1.00 N ATOM 563 CA GLY A 991 44.554 17.991 7.712 1.00 1.00 C ATOM 564 C GLY A 991 43.184 18.638 7.816 1.00 1.00 C ATOM 565 O GLY A 991 42.920 19.415 8.734 1.00 1.00 O ATOM 0 H GLY A 991 44.531 16.227 6.581 1.00 1.00 H new ATOM 0 HA2 GLY A 991 44.718 17.333 8.565 1.00 1.00 H new ATOM 0 HA3 GLY A 991 45.328 18.757 7.747 1.00 1.00 H new ATOM 569 N PHE A 992 42.312 18.315 6.867 1.00 1.00 N ATOM 570 CA PHE A 992 40.970 18.878 6.869 1.00 1.00 C ATOM 571 C PHE A 992 40.219 18.471 8.130 1.00 1.00 C ATOM 572 O PHE A 992 39.520 19.281 8.738 1.00 1.00 O ATOM 573 CB PHE A 992 40.190 18.423 5.628 1.00 1.00 C ATOM 574 CG PHE A 992 38.728 18.848 5.707 1.00 1.00 C ATOM 575 CD1 PHE A 992 38.333 20.035 6.357 1.00 1.00 C ATOM 576 CD2 PHE A 992 37.753 18.029 5.120 1.00 1.00 C ATOM 577 CE1 PHE A 992 36.981 20.387 6.413 1.00 1.00 C ATOM 578 CE2 PHE A 992 36.401 18.387 5.178 1.00 1.00 C ATOM 579 CZ PHE A 992 36.017 19.566 5.824 1.00 1.00 C ATOM 0 H PHE A 992 42.508 17.675 6.097 1.00 1.00 H new ATOM 0 HA PHE A 992 41.060 19.964 6.848 1.00 1.00 H new ATOM 0 HB2 PHE A 992 40.646 18.847 4.733 1.00 1.00 H new ATOM 0 HB3 PHE A 992 40.251 17.339 5.534 1.00 1.00 H new ATOM 0 HD1 PHE A 992 39.076 20.673 6.812 1.00 1.00 H new ATOM 0 HD2 PHE A 992 38.047 17.117 4.621 1.00 1.00 H new ATOM 0 HE1 PHE A 992 36.681 21.296 6.913 1.00 1.00 H new ATOM 0 HE2 PHE A 992 35.654 17.752 4.724 1.00 1.00 H new ATOM 0 HZ PHE A 992 34.974 19.842 5.868 1.00 1.00 H new ATOM 589 N PHE A 993 40.361 17.205 8.512 1.00 1.00 N ATOM 590 CA PHE A 993 39.680 16.702 9.698 1.00 1.00 C ATOM 591 C PHE A 993 40.536 16.906 10.945 1.00 1.00 C ATOM 592 O PHE A 993 40.094 16.627 12.059 1.00 1.00 O ATOM 593 CB PHE A 993 39.363 15.216 9.530 1.00 1.00 C ATOM 594 CG PHE A 993 38.211 15.054 8.568 1.00 1.00 C ATOM 595 CD1 PHE A 993 36.895 15.149 9.036 1.00 1.00 C ATOM 596 CD2 PHE A 993 38.456 14.807 7.212 1.00 1.00 C ATOM 597 CE1 PHE A 993 35.823 14.998 8.148 1.00 1.00 C ATOM 598 CE2 PHE A 993 37.383 14.657 6.323 1.00 1.00 C ATOM 599 CZ PHE A 993 36.068 14.753 6.791 1.00 1.00 C ATOM 0 H PHE A 993 40.934 16.517 8.024 1.00 1.00 H new ATOM 0 HA PHE A 993 38.751 17.260 9.819 1.00 1.00 H new ATOM 0 HB2 PHE A 993 40.239 14.686 9.157 1.00 1.00 H new ATOM 0 HB3 PHE A 993 39.110 14.776 10.495 1.00 1.00 H new ATOM 0 HD1 PHE A 993 36.707 15.339 10.082 1.00 1.00 H new ATOM 0 HD2 PHE A 993 39.471 14.732 6.851 1.00 1.00 H new ATOM 0 HE1 PHE A 993 34.808 15.070 8.509 1.00 1.00 H new ATOM 0 HE2 PHE A 993 37.571 14.467 5.277 1.00 1.00 H new ATOM 0 HZ PHE A 993 35.241 14.638 6.105 1.00 1.00 H new ATOM 609 N LYS A 994 41.752 17.406 10.757 1.00 1.00 N ATOM 610 CA LYS A 994 42.636 17.650 11.888 1.00 1.00 C ATOM 611 C LYS A 994 42.435 19.071 12.402 1.00 1.00 C ATOM 612 O LYS A 994 42.546 20.035 11.644 1.00 1.00 O ATOM 613 CB LYS A 994 44.094 17.452 11.469 1.00 1.00 C ATOM 614 CG LYS A 994 45.007 17.620 12.686 1.00 1.00 C ATOM 615 CD LYS A 994 46.458 17.366 12.274 1.00 1.00 C ATOM 616 CE LYS A 994 47.368 17.519 13.494 1.00 1.00 C ATOM 617 NZ LYS A 994 48.780 17.253 13.097 1.00 1.00 N ATOM 0 H LYS A 994 42.143 17.647 9.846 1.00 1.00 H new ATOM 0 HA LYS A 994 42.398 16.943 12.682 1.00 1.00 H new ATOM 0 HB2 LYS A 994 44.227 16.460 11.037 1.00 1.00 H new ATOM 0 HB3 LYS A 994 44.362 18.174 10.698 1.00 1.00 H new ATOM 0 HG2 LYS A 994 44.905 18.625 13.095 1.00 1.00 H new ATOM 0 HG3 LYS A 994 44.714 16.925 13.473 1.00 1.00 H new ATOM 0 HD2 LYS A 994 46.558 16.365 11.855 1.00 1.00 H new ATOM 0 HD3 LYS A 994 46.755 18.069 11.495 1.00 1.00 H new ATOM 0 HE2 LYS A 994 47.278 18.525 13.905 1.00 1.00 H new ATOM 0 HE3 LYS A 994 47.063 16.826 14.278 1.00 1.00 H new ATOM 0 HZ1 LYS A 994 49.399 17.357 13.926 1.00 1.00 H new ATOM 0 HZ2 LYS A 994 48.859 16.285 12.725 1.00 1.00 H new ATOM 0 HZ3 LYS A 994 49.068 17.931 12.363 1.00 1.00 H new ATOM 631 N ARG A 995 42.136 19.197 13.690 1.00 1.00 N ATOM 632 CA ARG A 995 41.919 20.501 14.285 1.00 1.00 C ATOM 633 C ARG A 995 42.535 20.527 15.671 1.00 1.00 C ATOM 634 O ARG A 995 42.544 19.511 16.365 1.00 1.00 O ATOM 635 CB ARG A 995 40.419 20.792 14.368 1.00 1.00 C ATOM 636 CG ARG A 995 40.197 22.206 14.904 1.00 1.00 C ATOM 637 CD ARG A 995 38.697 22.499 14.959 1.00 1.00 C ATOM 638 NE ARG A 995 38.149 22.557 13.609 1.00 1.00 N ATOM 639 CZ ARG A 995 36.853 22.760 13.399 1.00 1.00 C ATOM 640 NH1 ARG A 995 36.046 22.928 14.411 1.00 1.00 N ATOM 641 NH2 ARG A 995 36.389 22.796 12.180 1.00 1.00 N ATOM 0 H ARG A 995 42.040 18.413 14.336 1.00 1.00 H new ATOM 0 HA ARG A 995 42.389 21.267 13.668 1.00 1.00 H new ATOM 0 HB2 ARG A 995 39.964 20.691 13.383 1.00 1.00 H new ATOM 0 HB3 ARG A 995 39.933 20.065 15.019 1.00 1.00 H new ATOM 0 HG2 ARG A 995 40.634 22.303 15.898 1.00 1.00 H new ATOM 0 HG3 ARG A 995 40.697 22.932 14.263 1.00 1.00 H new ATOM 0 HD2 ARG A 995 38.188 21.725 15.534 1.00 1.00 H new ATOM 0 HD3 ARG A 995 38.522 23.444 15.472 1.00 1.00 H new ATOM 0 HE ARG A 995 38.773 22.439 12.811 1.00 1.00 H new ATOM 0 HH11 ARG A 995 36.410 22.903 15.363 1.00 1.00 H new ATOM 0 HH12 ARG A 995 35.051 23.084 14.249 1.00 1.00 H new ATOM 0 HH21 ARG A 995 37.021 22.668 11.390 1.00 1.00 H new ATOM 0 HH22 ARG A 995 35.394 22.952 12.017 1.00 1.00 H new ATOM 808 N ASP B 692 27.749 -17.546 -10.507 1.00 1.00 N ATOM 809 CA ASP B 692 27.496 -16.110 -10.442 1.00 1.00 C ATOM 810 C ASP B 692 28.512 -15.421 -9.533 1.00 1.00 C ATOM 811 O ASP B 692 28.194 -14.437 -8.866 1.00 1.00 O ATOM 812 CB ASP B 692 26.080 -15.847 -9.922 1.00 1.00 C ATOM 813 CG ASP B 692 25.055 -16.201 -10.993 1.00 1.00 C ATOM 814 OD1 ASP B 692 25.448 -16.352 -12.138 1.00 1.00 O ATOM 815 OD2 ASP B 692 23.888 -16.312 -10.654 1.00 1.00 O ATOM 0 HA ASP B 692 27.594 -15.702 -11.448 1.00 1.00 H new ATOM 0 HB2 ASP B 692 25.898 -16.438 -9.024 1.00 1.00 H new ATOM 0 HB3 ASP B 692 25.976 -14.799 -9.640 1.00 1.00 H new ATOM 820 N ILE B 693 29.736 -15.940 -9.515 1.00 1.00 N ATOM 821 CA ILE B 693 30.787 -15.360 -8.686 1.00 1.00 C ATOM 822 C ILE B 693 31.114 -13.942 -9.142 1.00 1.00 C ATOM 823 O ILE B 693 31.274 -13.040 -8.319 1.00 1.00 O ATOM 824 CB ILE B 693 32.052 -16.224 -8.756 1.00 1.00 C ATOM 825 CG1 ILE B 693 31.802 -17.588 -8.080 1.00 1.00 C ATOM 826 CG2 ILE B 693 33.220 -15.498 -8.079 1.00 1.00 C ATOM 827 CD1 ILE B 693 31.439 -17.424 -6.593 1.00 1.00 C ATOM 0 H ILE B 693 30.023 -16.753 -10.060 1.00 1.00 H new ATOM 0 HA ILE B 693 30.428 -15.325 -7.658 1.00 1.00 H new ATOM 0 HB ILE B 693 32.306 -16.397 -9.802 1.00 1.00 H new ATOM 0 HG12 ILE B 693 30.996 -18.109 -8.597 1.00 1.00 H new ATOM 0 HG13 ILE B 693 32.693 -18.209 -8.172 1.00 1.00 H new ATOM 0 HG21 ILE B 693 34.115 -16.118 -8.133 1.00 1.00 H new ATOM 0 HG22 ILE B 693 33.404 -14.551 -8.587 1.00 1.00 H new ATOM 0 HG23 ILE B 693 32.973 -15.307 -7.035 1.00 1.00 H new ATOM 0 HD11 ILE B 693 31.270 -18.405 -6.149 1.00 1.00 H new ATOM 0 HD12 ILE B 693 32.257 -16.926 -6.072 1.00 1.00 H new ATOM 0 HD13 ILE B 693 30.533 -16.824 -6.504 1.00 1.00 H new ATOM 839 N LEU B 694 31.216 -13.750 -10.455 1.00 1.00 N ATOM 840 CA LEU B 694 31.531 -12.432 -10.996 1.00 1.00 C ATOM 841 C LEU B 694 30.436 -11.431 -10.638 1.00 1.00 C ATOM 842 O LEU B 694 30.720 -10.297 -10.257 1.00 1.00 O ATOM 843 CB LEU B 694 31.671 -12.513 -12.518 1.00 1.00 C ATOM 844 CG LEU B 694 33.072 -13.014 -12.880 1.00 1.00 C ATOM 845 CD1 LEU B 694 33.276 -14.417 -12.307 1.00 1.00 C ATOM 846 CD2 LEU B 694 33.216 -13.064 -14.403 1.00 1.00 C ATOM 0 H LEU B 694 31.087 -14.480 -11.155 1.00 1.00 H new ATOM 0 HA LEU B 694 32.472 -12.096 -10.561 1.00 1.00 H new ATOM 0 HB2 LEU B 694 30.917 -13.185 -12.927 1.00 1.00 H new ATOM 0 HB3 LEU B 694 31.499 -11.532 -12.962 1.00 1.00 H new ATOM 0 HG LEU B 694 33.818 -12.338 -12.463 1.00 1.00 H new ATOM 0 HD11 LEU B 694 34.273 -14.774 -12.565 1.00 1.00 H new ATOM 0 HD12 LEU B 694 33.171 -14.386 -11.223 1.00 1.00 H new ATOM 0 HD13 LEU B 694 32.530 -15.093 -12.725 1.00 1.00 H new ATOM 0 HD21 LEU B 694 34.213 -13.420 -14.663 1.00 1.00 H new ATOM 0 HD22 LEU B 694 32.469 -13.741 -14.817 1.00 1.00 H new ATOM 0 HD23 LEU B 694 33.069 -12.066 -14.815 1.00 1.00 H new ATOM 858 N VAL B 695 29.186 -11.866 -10.751 1.00 1.00 N ATOM 859 CA VAL B 695 28.056 -11.003 -10.425 1.00 1.00 C ATOM 860 C VAL B 695 28.079 -10.646 -8.944 1.00 1.00 C ATOM 861 O VAL B 695 27.878 -9.492 -8.566 1.00 1.00 O ATOM 862 CB VAL B 695 26.744 -11.708 -10.765 1.00 1.00 C ATOM 863 CG1 VAL B 695 25.568 -10.887 -10.234 1.00 1.00 C ATOM 864 CG2 VAL B 695 26.619 -11.849 -12.285 1.00 1.00 C ATOM 0 H VAL B 695 28.930 -12.803 -11.063 1.00 1.00 H new ATOM 0 HA VAL B 695 28.133 -10.088 -11.013 1.00 1.00 H new ATOM 0 HB VAL B 695 26.735 -12.696 -10.304 1.00 1.00 H new ATOM 0 HG11 VAL B 695 24.633 -11.391 -10.477 1.00 1.00 H new ATOM 0 HG12 VAL B 695 25.654 -10.785 -9.152 1.00 1.00 H new ATOM 0 HG13 VAL B 695 25.577 -9.899 -10.693 1.00 1.00 H new ATOM 0 HG21 VAL B 695 25.683 -12.352 -12.528 1.00 1.00 H new ATOM 0 HG22 VAL B 695 26.630 -10.861 -12.744 1.00 1.00 H new ATOM 0 HG23 VAL B 695 27.455 -12.435 -12.666 1.00 1.00 H new ATOM 874 N VAL B 696 28.330 -11.650 -8.109 1.00 1.00 N ATOM 875 CA VAL B 696 28.382 -11.443 -6.668 1.00 1.00 C ATOM 876 C VAL B 696 29.513 -10.488 -6.308 1.00 1.00 C ATOM 877 O VAL B 696 29.336 -9.579 -5.499 1.00 1.00 O ATOM 878 CB VAL B 696 28.595 -12.779 -5.953 1.00 1.00 C ATOM 879 CG1 VAL B 696 28.853 -12.529 -4.467 1.00 1.00 C ATOM 880 CG2 VAL B 696 27.345 -13.650 -6.115 1.00 1.00 C ATOM 0 H VAL B 696 28.500 -12.611 -8.405 1.00 1.00 H new ATOM 0 HA VAL B 696 27.435 -11.008 -6.348 1.00 1.00 H new ATOM 0 HB VAL B 696 29.454 -13.290 -6.389 1.00 1.00 H new ATOM 0 HG11 VAL B 696 29.005 -13.481 -3.959 1.00 1.00 H new ATOM 0 HG12 VAL B 696 29.743 -11.910 -4.351 1.00 1.00 H new ATOM 0 HG13 VAL B 696 27.996 -12.017 -4.030 1.00 1.00 H new ATOM 0 HG21 VAL B 696 27.496 -14.602 -5.606 1.00 1.00 H new ATOM 0 HG22 VAL B 696 26.486 -13.138 -5.680 1.00 1.00 H new ATOM 0 HG23 VAL B 696 27.162 -13.830 -7.174 1.00 1.00 H new ATOM 890 N LEU B 697 30.678 -10.701 -6.913 1.00 1.00 N ATOM 891 CA LEU B 697 31.829 -9.851 -6.641 1.00 1.00 C ATOM 892 C LEU B 697 31.531 -8.413 -7.056 1.00 1.00 C ATOM 893 O LEU B 697 31.856 -7.471 -6.333 1.00 1.00 O ATOM 894 CB LEU B 697 33.055 -10.371 -7.406 1.00 1.00 C ATOM 895 CG LEU B 697 34.274 -9.475 -7.142 1.00 1.00 C ATOM 896 CD1 LEU B 697 34.567 -9.418 -5.641 1.00 1.00 C ATOM 897 CD2 LEU B 697 35.490 -10.052 -7.871 1.00 1.00 C ATOM 0 H LEU B 697 30.848 -11.447 -7.588 1.00 1.00 H new ATOM 0 HA LEU B 697 32.038 -9.873 -5.572 1.00 1.00 H new ATOM 0 HB2 LEU B 697 33.275 -11.394 -7.100 1.00 1.00 H new ATOM 0 HB3 LEU B 697 32.840 -10.397 -8.474 1.00 1.00 H new ATOM 0 HG LEU B 697 34.065 -8.469 -7.505 1.00 1.00 H new ATOM 0 HD11 LEU B 697 35.433 -8.780 -5.463 1.00 1.00 H new ATOM 0 HD12 LEU B 697 33.703 -9.010 -5.117 1.00 1.00 H new ATOM 0 HD13 LEU B 697 34.774 -10.423 -5.272 1.00 1.00 H new ATOM 0 HD21 LEU B 697 36.358 -9.420 -7.687 1.00 1.00 H new ATOM 0 HD22 LEU B 697 35.690 -11.059 -7.504 1.00 1.00 H new ATOM 0 HD23 LEU B 697 35.289 -10.089 -8.942 1.00 1.00 H new ATOM 909 N LEU B 698 30.908 -8.247 -8.220 1.00 1.00 N ATOM 910 CA LEU B 698 30.574 -6.912 -8.700 1.00 1.00 C ATOM 911 C LEU B 698 29.601 -6.244 -7.736 1.00 1.00 C ATOM 912 O LEU B 698 29.751 -5.068 -7.399 1.00 1.00 O ATOM 913 CB LEU B 698 29.947 -7.001 -10.098 1.00 1.00 C ATOM 914 CG LEU B 698 29.570 -5.600 -10.605 1.00 1.00 C ATOM 915 CD1 LEU B 698 30.805 -4.694 -10.621 1.00 1.00 C ATOM 916 CD2 LEU B 698 29.007 -5.711 -12.023 1.00 1.00 C ATOM 0 H LEU B 698 30.628 -9.008 -8.839 1.00 1.00 H new ATOM 0 HA LEU B 698 31.485 -6.316 -8.757 1.00 1.00 H new ATOM 0 HB2 LEU B 698 30.648 -7.469 -10.789 1.00 1.00 H new ATOM 0 HB3 LEU B 698 29.060 -7.634 -10.066 1.00 1.00 H new ATOM 0 HG LEU B 698 28.821 -5.170 -9.940 1.00 1.00 H new ATOM 0 HD11 LEU B 698 30.525 -3.704 -10.982 1.00 1.00 H new ATOM 0 HD12 LEU B 698 31.209 -4.612 -9.612 1.00 1.00 H new ATOM 0 HD13 LEU B 698 31.561 -5.121 -11.281 1.00 1.00 H new ATOM 0 HD21 LEU B 698 28.738 -4.719 -12.386 1.00 1.00 H new ATOM 0 HD22 LEU B 698 29.760 -6.147 -12.680 1.00 1.00 H new ATOM 0 HD23 LEU B 698 28.121 -6.346 -12.014 1.00 1.00 H new ATOM 928 N SER B 699 28.609 -7.006 -7.285 1.00 1.00 N ATOM 929 CA SER B 699 27.623 -6.485 -6.348 1.00 1.00 C ATOM 930 C SER B 699 28.306 -6.048 -5.054 1.00 1.00 C ATOM 931 O SER B 699 27.980 -5.004 -4.490 1.00 1.00 O ATOM 932 CB SER B 699 26.576 -7.555 -6.038 1.00 1.00 C ATOM 933 OG SER B 699 25.912 -7.928 -7.239 1.00 1.00 O ATOM 0 H SER B 699 28.468 -7.980 -7.552 1.00 1.00 H new ATOM 0 HA SER B 699 27.133 -5.624 -6.802 1.00 1.00 H new ATOM 0 HB2 SER B 699 27.052 -8.426 -5.587 1.00 1.00 H new ATOM 0 HB3 SER B 699 25.855 -7.175 -5.314 1.00 1.00 H new ATOM 0 HG SER B 699 26.510 -8.480 -7.786 1.00 1.00 H new ATOM 939 N VAL B 700 29.257 -6.858 -4.594 1.00 1.00 N ATOM 940 CA VAL B 700 29.987 -6.553 -3.365 1.00 1.00 C ATOM 941 C VAL B 700 30.790 -5.268 -3.517 1.00 1.00 C ATOM 942 O VAL B 700 30.798 -4.423 -2.624 1.00 1.00 O ATOM 943 CB VAL B 700 30.930 -7.704 -3.008 1.00 1.00 C ATOM 944 CG1 VAL B 700 31.861 -7.268 -1.872 1.00 1.00 C ATOM 945 CG2 VAL B 700 30.113 -8.915 -2.547 1.00 1.00 C ATOM 0 H VAL B 700 29.539 -7.726 -5.050 1.00 1.00 H new ATOM 0 HA VAL B 700 29.259 -6.421 -2.565 1.00 1.00 H new ATOM 0 HB VAL B 700 31.518 -7.971 -3.886 1.00 1.00 H new ATOM 0 HG11 VAL B 700 32.533 -8.088 -1.617 1.00 1.00 H new ATOM 0 HG12 VAL B 700 32.446 -6.405 -2.192 1.00 1.00 H new ATOM 0 HG13 VAL B 700 31.268 -7.000 -0.998 1.00 1.00 H new ATOM 0 HG21 VAL B 700 30.787 -9.733 -2.293 1.00 1.00 H new ATOM 0 HG22 VAL B 700 29.525 -8.644 -1.670 1.00 1.00 H new ATOM 0 HG23 VAL B 700 29.445 -9.230 -3.349 1.00 1.00 H new ATOM 955 N MET B 701 31.473 -5.130 -4.645 1.00 1.00 N ATOM 956 CA MET B 701 32.281 -3.943 -4.885 1.00 1.00 C ATOM 957 C MET B 701 31.407 -2.691 -4.931 1.00 1.00 C ATOM 958 O MET B 701 31.781 -1.649 -4.395 1.00 1.00 O ATOM 959 CB MET B 701 33.050 -4.082 -6.199 1.00 1.00 C ATOM 960 CG MET B 701 34.219 -5.048 -6.009 1.00 1.00 C ATOM 961 SD MET B 701 35.065 -5.268 -7.594 1.00 1.00 S ATOM 962 CE MET B 701 35.748 -3.597 -7.736 1.00 1.00 C ATOM 0 H MET B 701 31.484 -5.816 -5.400 1.00 1.00 H new ATOM 0 HA MET B 701 32.989 -3.845 -4.062 1.00 1.00 H new ATOM 0 HB2 MET B 701 32.387 -4.447 -6.983 1.00 1.00 H new ATOM 0 HB3 MET B 701 33.419 -3.108 -6.521 1.00 1.00 H new ATOM 0 HG2 MET B 701 34.912 -4.658 -5.263 1.00 1.00 H new ATOM 0 HG3 MET B 701 33.858 -6.007 -5.638 1.00 1.00 H new ATOM 0 HE1 MET B 701 36.795 -3.656 -8.032 1.00 1.00 H new ATOM 0 HE2 MET B 701 35.190 -3.038 -8.487 1.00 1.00 H new ATOM 0 HE3 MET B 701 35.671 -3.089 -6.775 1.00 1.00 H new ATOM 972 N GLY B 702 30.246 -2.799 -5.569 1.00 1.00 N ATOM 973 CA GLY B 702 29.336 -1.666 -5.668 1.00 1.00 C ATOM 974 C GLY B 702 28.803 -1.257 -4.291 1.00 1.00 C ATOM 975 O GLY B 702 28.725 -0.067 -3.973 1.00 1.00 O ATOM 0 H GLY B 702 29.916 -3.652 -6.021 1.00 1.00 H new ATOM 0 HA2 GLY B 702 29.852 -0.822 -6.126 1.00 1.00 H new ATOM 0 HA3 GLY B 702 28.502 -1.923 -6.321 1.00 1.00 H new ATOM 979 N ALA B 703 28.446 -2.259 -3.484 1.00 1.00 N ATOM 980 CA ALA B 703 27.922 -2.024 -2.136 1.00 1.00 C ATOM 981 C ALA B 703 28.978 -1.350 -1.256 1.00 1.00 C ATOM 982 O ALA B 703 28.673 -0.474 -0.451 1.00 1.00 O ATOM 983 CB ALA B 703 27.530 -3.358 -1.496 1.00 1.00 C ATOM 0 H ALA B 703 28.511 -3.244 -3.742 1.00 1.00 H new ATOM 0 HA ALA B 703 27.051 -1.373 -2.216 1.00 1.00 H new ATOM 0 HB1 ALA B 703 27.141 -3.180 -0.494 1.00 1.00 H new ATOM 0 HB2 ALA B 703 26.764 -3.841 -2.102 1.00 1.00 H new ATOM 0 HB3 ALA B 703 28.406 -4.004 -1.436 1.00 1.00 H new ATOM 989 N ILE B 704 30.232 -1.759 -1.424 1.00 1.00 N ATOM 990 CA ILE B 704 31.319 -1.166 -0.642 1.00 1.00 C ATOM 991 C ILE B 704 31.527 0.311 -0.982 1.00 1.00 C ATOM 992 O ILE B 704 31.719 1.136 -0.091 1.00 1.00 O ATOM 993 CB ILE B 704 32.634 -1.908 -0.854 1.00 1.00 C ATOM 994 CG1 ILE B 704 32.540 -3.299 -0.234 1.00 1.00 C ATOM 995 CG2 ILE B 704 33.759 -1.134 -0.158 1.00 1.00 C ATOM 996 CD1 ILE B 704 33.668 -4.186 -0.765 1.00 1.00 C ATOM 0 H ILE B 704 30.520 -2.484 -2.081 1.00 1.00 H new ATOM 0 HA ILE B 704 31.020 -1.252 0.403 1.00 1.00 H new ATOM 0 HB ILE B 704 32.837 -1.993 -1.922 1.00 1.00 H new ATOM 0 HG12 ILE B 704 32.603 -3.227 0.852 1.00 1.00 H new ATOM 0 HG13 ILE B 704 31.574 -3.746 -0.468 1.00 1.00 H new ATOM 0 HG21 ILE B 704 34.704 -1.657 -0.304 1.00 1.00 H new ATOM 0 HG22 ILE B 704 33.829 -0.133 -0.583 1.00 1.00 H new ATOM 0 HG23 ILE B 704 33.545 -1.061 0.908 1.00 1.00 H new ATOM 0 HD11 ILE B 704 33.593 -5.177 -0.317 1.00 1.00 H new ATOM 0 HD12 ILE B 704 33.585 -4.270 -1.849 1.00 1.00 H new ATOM 0 HD13 ILE B 704 34.630 -3.744 -0.508 1.00 1.00 H new ATOM 1008 N LEU B 705 31.500 0.640 -2.268 1.00 1.00 N ATOM 1009 CA LEU B 705 31.709 2.022 -2.674 1.00 1.00 C ATOM 1010 C LEU B 705 30.599 2.911 -2.098 1.00 1.00 C ATOM 1011 O LEU B 705 30.877 4.012 -1.622 1.00 1.00 O ATOM 1012 CB LEU B 705 31.733 2.123 -4.206 1.00 1.00 C ATOM 1013 CG LEU B 705 32.998 1.442 -4.744 1.00 1.00 C ATOM 1014 CD1 LEU B 705 32.906 1.357 -6.267 1.00 1.00 C ATOM 1015 CD2 LEU B 705 34.249 2.240 -4.352 1.00 1.00 C ATOM 0 H LEU B 705 31.339 -0.016 -3.032 1.00 1.00 H new ATOM 0 HA LEU B 705 32.669 2.365 -2.287 1.00 1.00 H new ATOM 0 HB2 LEU B 705 30.846 1.650 -4.626 1.00 1.00 H new ATOM 0 HB3 LEU B 705 31.712 3.169 -4.512 1.00 1.00 H new ATOM 0 HG LEU B 705 33.075 0.443 -4.315 1.00 1.00 H new ATOM 0 HD11 LEU B 705 33.801 0.874 -6.659 1.00 1.00 H new ATOM 0 HD12 LEU B 705 32.028 0.775 -6.547 1.00 1.00 H new ATOM 0 HD13 LEU B 705 32.823 2.361 -6.683 1.00 1.00 H new ATOM 0 HD21 LEU B 705 35.136 1.741 -4.743 1.00 1.00 H new ATOM 0 HD22 LEU B 705 34.185 3.245 -4.769 1.00 1.00 H new ATOM 0 HD23 LEU B 705 34.316 2.301 -3.266 1.00 1.00 H new ATOM 1027 N LEU B 706 29.352 2.434 -2.121 1.00 1.00 N ATOM 1028 CA LEU B 706 28.255 3.228 -1.565 1.00 1.00 C ATOM 1029 C LEU B 706 28.421 3.408 -0.056 1.00 1.00 C ATOM 1030 O LEU B 706 28.216 4.500 0.478 1.00 1.00 O ATOM 1031 CB LEU B 706 26.900 2.584 -1.863 1.00 1.00 C ATOM 1032 CG LEU B 706 26.596 2.687 -3.357 1.00 1.00 C ATOM 1033 CD1 LEU B 706 25.399 1.797 -3.657 1.00 1.00 C ATOM 1034 CD2 LEU B 706 26.263 4.139 -3.761 1.00 1.00 C ATOM 0 H LEU B 706 29.082 1.529 -2.506 1.00 1.00 H new ATOM 0 HA LEU B 706 28.287 4.207 -2.043 1.00 1.00 H new ATOM 0 HB2 LEU B 706 26.908 1.538 -1.555 1.00 1.00 H new ATOM 0 HB3 LEU B 706 26.117 3.079 -1.288 1.00 1.00 H new ATOM 0 HG LEU B 706 27.473 2.372 -3.923 1.00 1.00 H new ATOM 0 HD11 LEU B 706 25.161 1.853 -4.719 1.00 1.00 H new ATOM 0 HD12 LEU B 706 25.636 0.767 -3.392 1.00 1.00 H new ATOM 0 HD13 LEU B 706 24.541 2.133 -3.075 1.00 1.00 H new ATOM 0 HD21 LEU B 706 26.051 4.180 -4.829 1.00 1.00 H new ATOM 0 HD22 LEU B 706 25.390 4.480 -3.205 1.00 1.00 H new ATOM 0 HD23 LEU B 706 27.112 4.784 -3.534 1.00 1.00 H new ATOM 1046 N ILE B 707 28.795 2.321 0.624 1.00 1.00 N ATOM 1047 CA ILE B 707 28.997 2.354 2.069 1.00 1.00 C ATOM 1048 C ILE B 707 30.176 3.254 2.437 1.00 1.00 C ATOM 1049 O ILE B 707 30.102 4.026 3.391 1.00 1.00 O ATOM 1050 CB ILE B 707 29.238 0.943 2.612 1.00 1.00 C ATOM 1051 CG1 ILE B 707 27.960 0.105 2.486 1.00 1.00 C ATOM 1052 CG2 ILE B 707 29.613 1.041 4.090 1.00 1.00 C ATOM 1053 CD1 ILE B 707 28.284 -1.366 2.778 1.00 1.00 C ATOM 0 H ILE B 707 28.963 1.411 0.195 1.00 1.00 H new ATOM 0 HA ILE B 707 28.092 2.761 2.521 1.00 1.00 H new ATOM 0 HB ILE B 707 30.039 0.471 2.042 1.00 1.00 H new ATOM 0 HG12 ILE B 707 27.204 0.468 3.183 1.00 1.00 H new ATOM 0 HG13 ILE B 707 27.544 0.205 1.484 1.00 1.00 H new ATOM 0 HG21 ILE B 707 29.787 0.041 4.488 1.00 1.00 H new ATOM 0 HG22 ILE B 707 30.519 1.637 4.197 1.00 1.00 H new ATOM 0 HG23 ILE B 707 28.800 1.514 4.641 1.00 1.00 H new ATOM 0 HD11 ILE B 707 27.376 -1.963 2.689 1.00 1.00 H new ATOM 0 HD12 ILE B 707 29.025 -1.724 2.064 1.00 1.00 H new ATOM 0 HD13 ILE B 707 28.681 -1.457 3.789 1.00 1.00 H new ATOM 1065 N GLY B 708 31.274 3.147 1.689 1.00 1.00 N ATOM 1066 CA GLY B 708 32.446 3.964 1.981 1.00 1.00 C ATOM 1067 C GLY B 708 32.123 5.441 1.790 1.00 1.00 C ATOM 1068 O GLY B 708 32.528 6.287 2.588 1.00 1.00 O ATOM 0 H GLY B 708 31.374 2.516 0.894 1.00 1.00 H new ATOM 0 HA2 GLY B 708 32.775 3.786 3.005 1.00 1.00 H new ATOM 0 HA3 GLY B 708 33.269 3.677 1.327 1.00 1.00 H new ATOM 1072 N LEU B 709 31.386 5.741 0.729 1.00 1.00 N ATOM 1073 CA LEU B 709 30.994 7.111 0.437 1.00 1.00 C ATOM 1074 C LEU B 709 30.088 7.648 1.546 1.00 1.00 C ATOM 1075 O LEU B 709 30.216 8.798 1.966 1.00 1.00 O ATOM 1076 CB LEU B 709 30.271 7.153 -0.911 1.00 1.00 C ATOM 1077 CG LEU B 709 29.842 8.590 -1.253 1.00 1.00 C ATOM 1078 CD1 LEU B 709 31.063 9.509 -1.297 1.00 1.00 C ATOM 1079 CD2 LEU B 709 29.159 8.607 -2.622 1.00 1.00 C ATOM 0 H LEU B 709 31.048 5.053 0.056 1.00 1.00 H new ATOM 0 HA LEU B 709 31.883 7.740 0.387 1.00 1.00 H new ATOM 0 HB2 LEU B 709 30.926 6.768 -1.693 1.00 1.00 H new ATOM 0 HB3 LEU B 709 29.396 6.504 -0.880 1.00 1.00 H new ATOM 0 HG LEU B 709 29.152 8.942 -0.486 1.00 1.00 H new ATOM 0 HD11 LEU B 709 30.746 10.523 -1.540 1.00 1.00 H new ATOM 0 HD12 LEU B 709 31.556 9.506 -0.325 1.00 1.00 H new ATOM 0 HD13 LEU B 709 31.758 9.154 -2.058 1.00 1.00 H new ATOM 0 HD21 LEU B 709 28.855 9.625 -2.864 1.00 1.00 H new ATOM 0 HD22 LEU B 709 29.854 8.246 -3.380 1.00 1.00 H new ATOM 0 HD23 LEU B 709 28.281 7.962 -2.598 1.00 1.00 H new ATOM 1091 N ALA B 710 29.166 6.805 2.008 1.00 1.00 N ATOM 1092 CA ALA B 710 28.239 7.211 3.057 1.00 1.00 C ATOM 1093 C ALA B 710 28.997 7.565 4.330 1.00 1.00 C ATOM 1094 O ALA B 710 28.656 8.530 5.015 1.00 1.00 O ATOM 1095 CB ALA B 710 27.244 6.082 3.354 1.00 1.00 C ATOM 0 H ALA B 710 29.043 5.848 1.676 1.00 1.00 H new ATOM 0 HA ALA B 710 27.695 8.089 2.709 1.00 1.00 H new ATOM 0 HB1 ALA B 710 26.558 6.399 4.139 1.00 1.00 H new ATOM 0 HB2 ALA B 710 26.679 5.848 2.452 1.00 1.00 H new ATOM 0 HB3 ALA B 710 27.787 5.196 3.683 1.00 1.00 H new ATOM 1101 N ALA B 711 30.033 6.790 4.645 1.00 1.00 N ATOM 1102 CA ALA B 711 30.820 7.060 5.845 1.00 1.00 C ATOM 1103 C ALA B 711 31.490 8.421 5.732 1.00 1.00 C ATOM 1104 O ALA B 711 31.550 9.179 6.700 1.00 1.00 O ATOM 1105 CB ALA B 711 31.890 5.981 6.045 1.00 1.00 C ATOM 0 H ALA B 711 30.342 5.986 4.098 1.00 1.00 H new ATOM 0 HA ALA B 711 30.148 7.053 6.703 1.00 1.00 H new ATOM 0 HB1 ALA B 711 32.465 6.201 6.944 1.00 1.00 H new ATOM 0 HB2 ALA B 711 31.410 5.008 6.150 1.00 1.00 H new ATOM 0 HB3 ALA B 711 32.557 5.966 5.183 1.00 1.00 H new ATOM 1111 N LEU B 712 31.977 8.726 4.536 1.00 1.00 N ATOM 1112 CA LEU B 712 32.630 10.005 4.288 1.00 1.00 C ATOM 1113 C LEU B 712 31.637 11.147 4.487 1.00 1.00 C ATOM 1114 O LEU B 712 31.971 12.181 5.063 1.00 1.00 O ATOM 1115 CB LEU B 712 33.176 10.044 2.859 1.00 1.00 C ATOM 1116 CG LEU B 712 34.353 9.070 2.732 1.00 1.00 C ATOM 1117 CD1 LEU B 712 34.752 8.946 1.262 1.00 1.00 C ATOM 1118 CD2 LEU B 712 35.556 9.574 3.543 1.00 1.00 C ATOM 0 H LEU B 712 31.933 8.108 3.726 1.00 1.00 H new ATOM 0 HA LEU B 712 33.454 10.121 4.992 1.00 1.00 H new ATOM 0 HB2 LEU B 712 32.391 9.776 2.152 1.00 1.00 H new ATOM 0 HB3 LEU B 712 33.499 11.055 2.610 1.00 1.00 H new ATOM 0 HG LEU B 712 34.048 8.098 3.119 1.00 1.00 H new ATOM 0 HD11 LEU B 712 35.589 8.254 1.169 1.00 1.00 H new ATOM 0 HD12 LEU B 712 33.906 8.572 0.686 1.00 1.00 H new ATOM 0 HD13 LEU B 712 35.046 9.924 0.881 1.00 1.00 H new ATOM 0 HD21 LEU B 712 36.383 8.871 3.442 1.00 1.00 H new ATOM 0 HD22 LEU B 712 35.863 10.551 3.170 1.00 1.00 H new ATOM 0 HD23 LEU B 712 35.277 9.658 4.593 1.00 1.00 H new ATOM 1130 N LEU B 713 30.417 10.947 4.004 1.00 1.00 N ATOM 1131 CA LEU B 713 29.374 11.960 4.126 1.00 1.00 C ATOM 1132 C LEU B 713 29.060 12.233 5.595 1.00 1.00 C ATOM 1133 O LEU B 713 28.879 13.383 5.994 1.00 1.00 O ATOM 1134 CB LEU B 713 28.108 11.485 3.402 1.00 1.00 C ATOM 1135 CG LEU B 713 26.993 12.533 3.519 1.00 1.00 C ATOM 1136 CD1 LEU B 713 27.463 13.874 2.946 1.00 1.00 C ATOM 1137 CD2 LEU B 713 25.771 12.046 2.737 1.00 1.00 C ATOM 0 H LEU B 713 30.125 10.095 3.525 1.00 1.00 H new ATOM 0 HA LEU B 713 29.728 12.885 3.670 1.00 1.00 H new ATOM 0 HB2 LEU B 713 28.331 11.300 2.351 1.00 1.00 H new ATOM 0 HB3 LEU B 713 27.772 10.540 3.828 1.00 1.00 H new ATOM 0 HG LEU B 713 26.736 12.671 4.569 1.00 1.00 H new ATOM 0 HD11 LEU B 713 26.663 14.608 3.035 1.00 1.00 H new ATOM 0 HD12 LEU B 713 28.336 14.220 3.499 1.00 1.00 H new ATOM 0 HD13 LEU B 713 27.725 13.749 1.895 1.00 1.00 H new ATOM 0 HD21 LEU B 713 24.972 12.784 2.814 1.00 1.00 H new ATOM 0 HD22 LEU B 713 26.040 11.910 1.690 1.00 1.00 H new ATOM 0 HD23 LEU B 713 25.429 11.097 3.150 1.00 1.00 H new ATOM 1149 N ILE B 714 28.992 11.174 6.397 1.00 1.00 N ATOM 1150 CA ILE B 714 28.693 11.328 7.817 1.00 1.00 C ATOM 1151 C ILE B 714 29.791 12.134 8.502 1.00 1.00 C ATOM 1152 O ILE B 714 29.512 13.029 9.298 1.00 1.00 O ATOM 1153 CB ILE B 714 28.574 9.951 8.476 1.00 1.00 C ATOM 1154 CG1 ILE B 714 27.329 9.241 7.941 1.00 1.00 C ATOM 1155 CG2 ILE B 714 28.456 10.118 9.993 1.00 1.00 C ATOM 1156 CD1 ILE B 714 27.349 7.772 8.371 1.00 1.00 C ATOM 0 H ILE B 714 29.138 10.211 6.093 1.00 1.00 H new ATOM 0 HA ILE B 714 27.747 11.860 7.921 1.00 1.00 H new ATOM 0 HB ILE B 714 29.459 9.358 8.246 1.00 1.00 H new ATOM 0 HG12 ILE B 714 26.430 9.728 8.318 1.00 1.00 H new ATOM 0 HG13 ILE B 714 27.297 9.311 6.854 1.00 1.00 H new ATOM 0 HG21 ILE B 714 28.371 9.137 10.461 1.00 1.00 H new ATOM 0 HG22 ILE B 714 29.342 10.626 10.373 1.00 1.00 H new ATOM 0 HG23 ILE B 714 27.570 10.709 10.226 1.00 1.00 H new ATOM 0 HD11 ILE B 714 26.461 7.269 7.989 1.00 1.00 H new ATOM 0 HD12 ILE B 714 28.240 7.288 7.972 1.00 1.00 H new ATOM 0 HD13 ILE B 714 27.360 7.712 9.459 1.00 1.00 H new ATOM 1168 N TRP B 715 31.041 11.823 8.177 1.00 1.00 N ATOM 1169 CA TRP B 715 32.170 12.539 8.758 1.00 1.00 C ATOM 1170 C TRP B 715 32.066 14.020 8.385 1.00 1.00 C ATOM 1171 O TRP B 715 32.261 14.906 9.218 1.00 1.00 O ATOM 1172 CB TRP B 715 33.481 11.957 8.216 1.00 1.00 C ATOM 1173 CG TRP B 715 34.581 12.098 9.227 1.00 1.00 C ATOM 1174 CD1 TRP B 715 34.667 13.058 10.179 1.00 1.00 C ATOM 1175 CD2 TRP B 715 35.758 11.255 9.397 1.00 1.00 C ATOM 1176 NE1 TRP B 715 35.819 12.854 10.919 1.00 1.00 N ATOM 1177 CE2 TRP B 715 36.524 11.756 10.475 1.00 1.00 C ATOM 1178 CE3 TRP B 715 36.229 10.112 8.726 1.00 1.00 C ATOM 1179 CZ2 TRP B 715 37.716 11.146 10.872 1.00 1.00 C ATOM 1180 CZ3 TRP B 715 37.426 9.496 9.122 1.00 1.00 C ATOM 1181 CH2 TRP B 715 38.168 10.012 10.193 1.00 1.00 C ATOM 0 H TRP B 715 31.297 11.086 7.520 1.00 1.00 H new ATOM 0 HA TRP B 715 32.156 12.434 9.843 1.00 1.00 H new ATOM 0 HB2 TRP B 715 33.342 10.905 7.966 1.00 1.00 H new ATOM 0 HB3 TRP B 715 33.759 12.469 7.295 1.00 1.00 H new ATOM 0 HD1 TRP B 715 33.953 13.853 10.335 1.00 1.00 H new ATOM 0 HE1 TRP B 715 36.111 13.444 11.698 1.00 1.00 H new ATOM 0 HE3 TRP B 715 35.665 9.705 7.900 1.00 1.00 H new ATOM 0 HZ2 TRP B 715 38.284 11.548 11.698 1.00 1.00 H new ATOM 0 HZ3 TRP B 715 37.777 8.619 8.598 1.00 1.00 H new ATOM 0 HH2 TRP B 715 39.088 9.533 10.493 1.00 1.00 H new ATOM 1192 N LYS B 716 31.741 14.276 7.119 1.00 1.00 N ATOM 1193 CA LYS B 716 31.599 15.645 6.625 1.00 1.00 C ATOM 1194 C LYS B 716 30.471 16.352 7.380 1.00 1.00 C ATOM 1195 O LYS B 716 30.594 17.512 7.770 1.00 1.00 O ATOM 1196 CB LYS B 716 31.252 15.605 5.124 1.00 1.00 C ATOM 1197 CG LYS B 716 32.436 16.069 4.248 1.00 1.00 C ATOM 1198 CD LYS B 716 32.350 17.576 3.965 1.00 1.00 C ATOM 1199 CE LYS B 716 32.627 18.365 5.243 1.00 1.00 C ATOM 1200 NZ LYS B 716 32.769 19.810 4.909 1.00 1.00 N ATOM 0 H LYS B 716 31.571 13.555 6.418 1.00 1.00 H new ATOM 0 HA LYS B 716 32.533 16.185 6.779 1.00 1.00 H new ATOM 0 HB2 LYS B 716 30.968 14.591 4.844 1.00 1.00 H new ATOM 0 HB3 LYS B 716 30.388 16.242 4.934 1.00 1.00 H new ATOM 0 HG2 LYS B 716 33.376 15.842 4.751 1.00 1.00 H new ATOM 0 HG3 LYS B 716 32.436 15.518 3.308 1.00 1.00 H new ATOM 0 HD2 LYS B 716 33.070 17.851 3.195 1.00 1.00 H new ATOM 0 HD3 LYS B 716 31.361 17.826 3.581 1.00 1.00 H new ATOM 0 HE2 LYS B 716 31.814 18.223 5.955 1.00 1.00 H new ATOM 0 HE3 LYS B 716 33.536 17.999 5.720 1.00 1.00 H new ATOM 0 HZ1 LYS B 716 32.958 20.350 5.777 1.00 1.00 H new ATOM 0 HZ2 LYS B 716 33.559 19.937 4.244 1.00 1.00 H new ATOM 0 HZ3 LYS B 716 31.890 20.153 4.472 1.00 1.00 H new ATOM 1214 N LEU B 717 29.370 15.640 7.580 1.00 1.00 N ATOM 1215 CA LEU B 717 28.223 16.198 8.285 1.00 1.00 C ATOM 1216 C LEU B 717 28.572 16.545 9.735 1.00 1.00 C ATOM 1217 O LEU B 717 28.153 17.583 10.243 1.00 1.00 O ATOM 1218 CB LEU B 717 27.062 15.194 8.259 1.00 1.00 C ATOM 1219 CG LEU B 717 25.843 15.754 9.008 1.00 1.00 C ATOM 1220 CD1 LEU B 717 25.415 17.086 8.388 1.00 1.00 C ATOM 1221 CD2 LEU B 717 24.688 14.757 8.902 1.00 1.00 C ATOM 0 H LEU B 717 29.247 14.678 7.265 1.00 1.00 H new ATOM 0 HA LEU B 717 27.929 17.118 7.779 1.00 1.00 H new ATOM 0 HB2 LEU B 717 26.790 14.971 7.227 1.00 1.00 H new ATOM 0 HB3 LEU B 717 27.376 14.255 8.716 1.00 1.00 H new ATOM 0 HG LEU B 717 26.106 15.913 10.054 1.00 1.00 H new ATOM 0 HD11 LEU B 717 24.550 17.476 8.925 1.00 1.00 H new ATOM 0 HD12 LEU B 717 26.236 17.799 8.456 1.00 1.00 H new ATOM 0 HD13 LEU B 717 25.153 16.933 7.341 1.00 1.00 H new ATOM 0 HD21 LEU B 717 23.820 15.149 9.432 1.00 1.00 H new ATOM 0 HD22 LEU B 717 24.435 14.604 7.853 1.00 1.00 H new ATOM 0 HD23 LEU B 717 24.986 13.807 9.346 1.00 1.00 H new ATOM 1233 N LEU B 718 29.306 15.659 10.408 1.00 1.00 N ATOM 1234 CA LEU B 718 29.656 15.885 11.812 1.00 1.00 C ATOM 1235 C LEU B 718 30.524 17.128 12.003 1.00 1.00 C ATOM 1236 O LEU B 718 30.283 17.918 12.915 1.00 1.00 O ATOM 1237 CB LEU B 718 30.397 14.666 12.365 1.00 1.00 C ATOM 1238 CG LEU B 718 29.431 13.482 12.489 1.00 1.00 C ATOM 1239 CD1 LEU B 718 30.225 12.216 12.812 1.00 1.00 C ATOM 1240 CD2 LEU B 718 28.404 13.739 13.603 1.00 1.00 C ATOM 0 H LEU B 718 29.666 14.790 10.012 1.00 1.00 H new ATOM 0 HA LEU B 718 28.723 16.043 12.354 1.00 1.00 H new ATOM 0 HB2 LEU B 718 31.226 14.404 11.707 1.00 1.00 H new ATOM 0 HB3 LEU B 718 30.826 14.901 13.339 1.00 1.00 H new ATOM 0 HG LEU B 718 28.900 13.359 11.545 1.00 1.00 H new ATOM 0 HD11 LEU B 718 29.542 11.371 12.901 1.00 1.00 H new ATOM 0 HD12 LEU B 718 30.941 12.022 12.013 1.00 1.00 H new ATOM 0 HD13 LEU B 718 30.759 12.352 13.752 1.00 1.00 H new ATOM 0 HD21 LEU B 718 27.727 12.888 13.677 1.00 1.00 H new ATOM 0 HD22 LEU B 718 28.923 13.873 14.552 1.00 1.00 H new ATOM 0 HD23 LEU B 718 27.833 14.638 13.371 1.00 1.00 H new ATOM 1252 N ILE B 719 31.520 17.317 11.146 1.00 1.00 N ATOM 1253 CA ILE B 719 32.386 18.488 11.270 1.00 1.00 C ATOM 1254 C ILE B 719 31.611 19.764 10.960 1.00 1.00 C ATOM 1255 O ILE B 719 31.810 20.792 11.605 1.00 1.00 O ATOM 1256 CB ILE B 719 33.617 18.363 10.363 1.00 1.00 C ATOM 1257 CG1 ILE B 719 34.475 19.626 10.494 1.00 1.00 C ATOM 1258 CG2 ILE B 719 33.186 18.172 8.911 1.00 1.00 C ATOM 1259 CD1 ILE B 719 35.836 19.398 9.828 1.00 1.00 C ATOM 0 H ILE B 719 31.747 16.691 10.373 1.00 1.00 H new ATOM 0 HA ILE B 719 32.736 18.542 12.301 1.00 1.00 H new ATOM 0 HB ILE B 719 34.201 17.495 10.668 1.00 1.00 H new ATOM 0 HG12 ILE B 719 33.968 20.471 10.028 1.00 1.00 H new ATOM 0 HG13 ILE B 719 34.612 19.877 11.546 1.00 1.00 H new ATOM 0 HG21 ILE B 719 34.069 18.085 8.278 1.00 1.00 H new ATOM 0 HG22 ILE B 719 32.587 17.265 8.826 1.00 1.00 H new ATOM 0 HG23 ILE B 719 32.594 19.029 8.591 1.00 1.00 H new ATOM 0 HD11 ILE B 719 36.443 20.298 9.923 1.00 1.00 H new ATOM 0 HD12 ILE B 719 36.344 18.565 10.314 1.00 1.00 H new ATOM 0 HD13 ILE B 719 35.691 19.168 8.772 1.00 1.00 H new ATOM 1271 N THR B 720 30.729 19.691 9.970 1.00 1.00 N ATOM 1272 CA THR B 720 29.932 20.849 9.584 1.00 1.00 C ATOM 1273 C THR B 720 29.036 21.304 10.734 1.00 1.00 C ATOM 1274 O THR B 720 28.922 22.500 11.004 1.00 1.00 O ATOM 1275 CB THR B 720 29.067 20.503 8.368 1.00 1.00 C ATOM 1276 OG1 THR B 720 29.908 20.184 7.269 1.00 1.00 O ATOM 1277 CG2 THR B 720 28.180 21.698 8.010 1.00 1.00 C ATOM 0 H THR B 720 30.548 18.849 9.424 1.00 1.00 H new ATOM 0 HA THR B 720 30.613 21.662 9.332 1.00 1.00 H new ATOM 0 HB THR B 720 28.435 19.647 8.602 1.00 1.00 H new ATOM 0 HG1 THR B 720 30.211 19.255 7.348 1.00 1.00 H new ATOM 0 HG21 THR B 720 27.566 21.449 7.145 1.00 1.00 H new ATOM 0 HG22 THR B 720 27.535 21.939 8.855 1.00 1.00 H new ATOM 0 HG23 THR B 720 28.806 22.558 7.775 1.00 1.00 H new ATOM 1285 N ILE B 721 28.389 20.351 11.399 1.00 1.00 N ATOM 1286 CA ILE B 721 27.491 20.680 12.504 1.00 1.00 C ATOM 1287 C ILE B 721 28.250 21.346 13.649 1.00 1.00 C ATOM 1288 O ILE B 721 27.790 22.338 14.212 1.00 1.00 O ATOM 1289 CB ILE B 721 26.797 19.418 13.015 1.00 1.00 C ATOM 1290 CG1 ILE B 721 25.833 18.897 11.945 1.00 1.00 C ATOM 1291 CG2 ILE B 721 26.012 19.747 14.288 1.00 1.00 C ATOM 1292 CD1 ILE B 721 25.350 17.497 12.331 1.00 1.00 C ATOM 0 H ILE B 721 28.467 19.355 11.196 1.00 1.00 H new ATOM 0 HA ILE B 721 26.743 21.379 12.131 1.00 1.00 H new ATOM 0 HB ILE B 721 27.545 18.656 13.234 1.00 1.00 H new ATOM 0 HG12 ILE B 721 24.983 19.572 11.846 1.00 1.00 H new ATOM 0 HG13 ILE B 721 26.331 18.867 10.976 1.00 1.00 H new ATOM 0 HG21 ILE B 721 25.517 18.847 14.653 1.00 1.00 H new ATOM 0 HG22 ILE B 721 26.696 20.120 15.051 1.00 1.00 H new ATOM 0 HG23 ILE B 721 25.264 20.509 14.068 1.00 1.00 H new ATOM 0 HD11 ILE B 721 24.664 17.126 11.570 1.00 1.00 H new ATOM 0 HD12 ILE B 721 26.205 16.825 12.407 1.00 1.00 H new ATOM 0 HD13 ILE B 721 24.837 17.541 13.291 1.00 1.00 H new ATOM 1304 N HIS B 722 29.418 20.809 13.992 1.00 1.00 N ATOM 1305 CA HIS B 722 30.214 21.387 15.070 1.00 1.00 C ATOM 1306 C HIS B 722 30.685 22.789 14.690 1.00 1.00 C ATOM 1307 O HIS B 722 30.688 23.696 15.520 1.00 1.00 O ATOM 1308 CB HIS B 722 31.421 20.497 15.382 1.00 1.00 C ATOM 1309 CG HIS B 722 30.966 19.292 16.156 1.00 1.00 C ATOM 1310 ND1 HIS B 722 30.359 18.204 15.548 1.00 1.00 N ATOM 1311 CD2 HIS B 722 31.022 18.990 17.492 1.00 1.00 C ATOM 1312 CE1 HIS B 722 30.077 17.308 16.508 1.00 1.00 C ATOM 1313 NE2 HIS B 722 30.458 17.737 17.714 1.00 1.00 N ATOM 0 H HIS B 722 29.829 19.988 13.547 1.00 1.00 H new ATOM 0 HA HIS B 722 29.588 21.454 15.960 1.00 1.00 H new ATOM 0 HB2 HIS B 722 31.907 20.187 14.457 1.00 1.00 H new ATOM 0 HB3 HIS B 722 32.159 21.055 15.958 1.00 1.00 H new ATOM 0 HD1 HIS B 722 30.162 18.102 14.552 1.00 1.00 H new ATOM 0 HD2 HIS B 722 31.440 19.628 18.257 1.00 1.00 H new ATOM 0 HE1 HIS B 722 29.600 16.356 16.327 1.00 1.00 H new ATOM 1321 N ASP B 723 31.090 22.961 13.434 1.00 1.00 N ATOM 1322 CA ASP B 723 31.559 24.269 12.975 1.00 1.00 C ATOM 1323 C ASP B 723 30.413 25.283 13.015 1.00 1.00 C ATOM 1324 O ASP B 723 30.605 26.436 13.406 1.00 1.00 O ATOM 1325 CB ASP B 723 32.091 24.157 11.542 1.00 1.00 C ATOM 1326 CG ASP B 723 33.550 23.699 11.536 1.00 1.00 C ATOM 1327 OD1 ASP B 723 34.119 23.555 12.606 1.00 1.00 O ATOM 1328 OD2 ASP B 723 34.072 23.472 10.456 1.00 1.00 O ATOM 0 H ASP B 723 31.104 22.227 12.726 1.00 1.00 H new ATOM 0 HA ASP B 723 32.359 24.606 13.634 1.00 1.00 H new ATOM 0 HB2 ASP B 723 31.482 23.451 10.978 1.00 1.00 H new ATOM 0 HB3 ASP B 723 32.006 25.122 11.042 1.00 1.00 H new