USER MOD reduce.3.24.130724 H: found=0, std=0, add=557, rem=0, adj=8 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 92:sc= 1.22 USER MOD Single : A 987 MET CE :methyl -125:sc= 0 (180deg=-2.26!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 994 LYS NZ :NH3+ -163:sc= -0.0313 (180deg=-0.32) USER MOD Single : B 699 SER OG : rot 73:sc= 0.709 USER MOD Single : B 701 MET CE :methyl 157:sc= -0.111 (180deg=-0.961) USER MOD Single : B 716 LYS NZ :NH3+ -169:sc= -0.187 (180deg=-0.39) USER MOD Single : B 720 THR OG1 : rot 91:sc= 1.24 USER MOD Single : B 722 HIS : no HE2:sc= 0.0257 K(o=0.026,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 136 N ILE A 966 31.870 -18.690 -2.674 1.00 1.00 N ATOM 137 CA ILE A 966 31.792 -17.735 -1.573 1.00 1.00 C ATOM 138 C ILE A 966 33.176 -17.276 -1.107 1.00 1.00 C ATOM 139 O ILE A 966 33.306 -16.190 -0.540 1.00 1.00 O ATOM 140 CB ILE A 966 31.048 -18.367 -0.394 1.00 1.00 C ATOM 141 CG1 ILE A 966 29.689 -18.910 -0.868 1.00 1.00 C ATOM 142 CG2 ILE A 966 30.844 -17.328 0.712 1.00 1.00 C ATOM 143 CD1 ILE A 966 28.844 -17.797 -1.504 1.00 1.00 C ATOM 0 HA ILE A 966 31.254 -16.860 -1.938 1.00 1.00 H new ATOM 0 HB ILE A 966 31.640 -19.191 0.003 1.00 1.00 H new ATOM 0 HG12 ILE A 966 29.845 -19.711 -1.591 1.00 1.00 H new ATOM 0 HG13 ILE A 966 29.152 -19.342 -0.024 1.00 1.00 H new ATOM 0 HG21 ILE A 966 30.314 -17.785 1.547 1.00 1.00 H new ATOM 0 HG22 ILE A 966 31.813 -16.964 1.053 1.00 1.00 H new ATOM 0 HG23 ILE A 966 30.259 -16.494 0.324 1.00 1.00 H new ATOM 0 HD11 ILE A 966 27.888 -18.207 -1.831 1.00 1.00 H new ATOM 0 HD12 ILE A 966 28.669 -17.009 -0.771 1.00 1.00 H new ATOM 0 HD13 ILE A 966 29.374 -17.383 -2.362 1.00 1.00 H new ATOM 155 N TRP A 967 34.206 -18.089 -1.330 1.00 1.00 N ATOM 156 CA TRP A 967 35.548 -17.699 -0.900 1.00 1.00 C ATOM 157 C TRP A 967 35.948 -16.377 -1.550 1.00 1.00 C ATOM 158 O TRP A 967 36.575 -15.530 -0.914 1.00 1.00 O ATOM 159 CB TRP A 967 36.583 -18.767 -1.265 1.00 1.00 C ATOM 160 CG TRP A 967 36.434 -19.954 -0.368 1.00 1.00 C ATOM 161 CD1 TRP A 967 36.078 -21.192 -0.774 1.00 1.00 C ATOM 162 CD2 TRP A 967 36.622 -20.034 1.076 1.00 1.00 C ATOM 163 NE1 TRP A 967 36.042 -22.030 0.325 1.00 1.00 N ATOM 164 CE2 TRP A 967 36.368 -21.363 1.489 1.00 1.00 C ATOM 165 CE3 TRP A 967 36.987 -19.094 2.057 1.00 1.00 C ATOM 166 CZ2 TRP A 967 36.472 -21.747 2.827 1.00 1.00 C ATOM 167 CZ3 TRP A 967 37.091 -19.477 3.405 1.00 1.00 C ATOM 168 CH2 TRP A 967 36.834 -20.800 3.789 1.00 1.00 C ATOM 0 H TRP A 967 34.143 -18.996 -1.792 1.00 1.00 H new ATOM 0 HA TRP A 967 35.525 -17.588 0.184 1.00 1.00 H new ATOM 0 HB2 TRP A 967 36.455 -19.069 -2.305 1.00 1.00 H new ATOM 0 HB3 TRP A 967 37.589 -18.356 -1.174 1.00 1.00 H new ATOM 0 HD1 TRP A 967 35.857 -21.480 -1.791 1.00 1.00 H new ATOM 0 HE1 TRP A 967 35.804 -23.021 0.281 1.00 1.00 H new ATOM 0 HE3 TRP A 967 37.188 -18.072 1.772 1.00 1.00 H new ATOM 0 HZ2 TRP A 967 36.274 -22.768 3.117 1.00 1.00 H new ATOM 0 HZ3 TRP A 967 37.371 -18.747 4.150 1.00 1.00 H new ATOM 0 HH2 TRP A 967 36.916 -21.087 4.827 1.00 1.00 H new ATOM 179 N TRP A 968 35.579 -16.206 -2.818 1.00 1.00 N ATOM 180 CA TRP A 968 35.901 -14.979 -3.542 1.00 1.00 C ATOM 181 C TRP A 968 35.259 -13.770 -2.864 1.00 1.00 C ATOM 182 O TRP A 968 35.854 -12.694 -2.789 1.00 1.00 O ATOM 183 CB TRP A 968 35.410 -15.081 -4.986 1.00 1.00 C ATOM 184 CG TRP A 968 36.257 -16.063 -5.729 1.00 1.00 C ATOM 185 CD1 TRP A 968 35.899 -17.333 -6.021 1.00 1.00 C ATOM 186 CD2 TRP A 968 37.596 -15.878 -6.275 1.00 1.00 C ATOM 187 NE1 TRP A 968 36.931 -17.941 -6.714 1.00 1.00 N ATOM 188 CE2 TRP A 968 37.999 -17.085 -6.896 1.00 1.00 C ATOM 189 CE3 TRP A 968 38.491 -14.793 -6.294 1.00 1.00 C ATOM 190 CZ2 TRP A 968 39.244 -17.210 -7.511 1.00 1.00 C ATOM 191 CZ3 TRP A 968 39.746 -14.916 -6.913 1.00 1.00 C ATOM 192 CH2 TRP A 968 40.121 -16.122 -7.521 1.00 1.00 C ATOM 0 H TRP A 968 35.061 -16.896 -3.362 1.00 1.00 H new ATOM 0 HA TRP A 968 36.983 -14.849 -3.536 1.00 1.00 H new ATOM 0 HB2 TRP A 968 34.367 -15.396 -5.006 1.00 1.00 H new ATOM 0 HB3 TRP A 968 35.458 -14.105 -5.468 1.00 1.00 H new ATOM 0 HD1 TRP A 968 34.961 -17.798 -5.757 1.00 1.00 H new ATOM 0 HE1 TRP A 968 36.906 -18.904 -7.049 1.00 1.00 H new ATOM 0 HE3 TRP A 968 38.211 -13.859 -5.829 1.00 1.00 H new ATOM 0 HZ2 TRP A 968 39.529 -18.142 -7.977 1.00 1.00 H new ATOM 0 HZ3 TRP A 968 40.426 -14.077 -6.920 1.00 1.00 H new ATOM 0 HH2 TRP A 968 41.087 -16.210 -7.997 1.00 1.00 H new ATOM 203 N VAL A 969 34.039 -13.956 -2.379 1.00 1.00 N ATOM 204 CA VAL A 969 33.313 -12.883 -1.711 1.00 1.00 C ATOM 205 C VAL A 969 34.003 -12.454 -0.418 1.00 1.00 C ATOM 206 O VAL A 969 34.098 -11.263 -0.124 1.00 1.00 O ATOM 207 CB VAL A 969 31.887 -13.334 -1.399 1.00 1.00 C ATOM 208 CG1 VAL A 969 31.206 -12.295 -0.505 1.00 1.00 C ATOM 209 CG2 VAL A 969 31.103 -13.464 -2.706 1.00 1.00 C ATOM 0 H VAL A 969 33.531 -14.839 -2.435 1.00 1.00 H new ATOM 0 HA VAL A 969 33.294 -12.028 -2.386 1.00 1.00 H new ATOM 0 HB VAL A 969 31.913 -14.295 -0.886 1.00 1.00 H new ATOM 0 HG11 VAL A 969 30.189 -12.617 -0.283 1.00 1.00 H new ATOM 0 HG12 VAL A 969 31.766 -12.192 0.425 1.00 1.00 H new ATOM 0 HG13 VAL A 969 31.178 -11.335 -1.020 1.00 1.00 H new ATOM 0 HG21 VAL A 969 30.084 -13.786 -2.489 1.00 1.00 H new ATOM 0 HG22 VAL A 969 31.079 -12.499 -3.213 1.00 1.00 H new ATOM 0 HG23 VAL A 969 31.587 -14.200 -3.349 1.00 1.00 H new ATOM 219 N LEU A 970 34.449 -13.426 0.371 1.00 1.00 N ATOM 220 CA LEU A 970 35.086 -13.117 1.649 1.00 1.00 C ATOM 221 C LEU A 970 36.363 -12.298 1.467 1.00 1.00 C ATOM 222 O LEU A 970 36.590 -11.334 2.199 1.00 1.00 O ATOM 223 CB LEU A 970 35.419 -14.416 2.387 1.00 1.00 C ATOM 224 CG LEU A 970 34.124 -15.094 2.848 1.00 1.00 C ATOM 225 CD1 LEU A 970 34.442 -16.494 3.376 1.00 1.00 C ATOM 226 CD2 LEU A 970 33.456 -14.274 3.959 1.00 1.00 C ATOM 0 H LEU A 970 34.384 -14.421 0.154 1.00 1.00 H new ATOM 0 HA LEU A 970 34.384 -12.521 2.231 1.00 1.00 H new ATOM 0 HB2 LEU A 970 35.978 -15.085 1.732 1.00 1.00 H new ATOM 0 HB3 LEU A 970 36.056 -14.205 3.246 1.00 1.00 H new ATOM 0 HG LEU A 970 33.443 -15.162 2.000 1.00 1.00 H new ATOM 0 HD11 LEU A 970 33.522 -16.977 3.704 1.00 1.00 H new ATOM 0 HD12 LEU A 970 34.900 -17.086 2.584 1.00 1.00 H new ATOM 0 HD13 LEU A 970 35.131 -16.418 4.217 1.00 1.00 H new ATOM 0 HD21 LEU A 970 32.538 -14.769 4.275 1.00 1.00 H new ATOM 0 HD22 LEU A 970 34.134 -14.191 4.808 1.00 1.00 H new ATOM 0 HD23 LEU A 970 33.220 -13.278 3.584 1.00 1.00 H new ATOM 238 N VAL A 971 37.188 -12.664 0.493 1.00 1.00 N ATOM 239 CA VAL A 971 38.422 -11.918 0.255 1.00 1.00 C ATOM 240 C VAL A 971 38.105 -10.503 -0.221 1.00 1.00 C ATOM 241 O VAL A 971 38.744 -9.540 0.199 1.00 1.00 O ATOM 242 CB VAL A 971 39.313 -12.638 -0.762 1.00 1.00 C ATOM 243 CG1 VAL A 971 39.859 -13.925 -0.139 1.00 1.00 C ATOM 244 CG2 VAL A 971 38.498 -12.992 -2.002 1.00 1.00 C ATOM 0 H VAL A 971 37.033 -13.454 -0.133 1.00 1.00 H new ATOM 0 HA VAL A 971 38.967 -11.856 1.197 1.00 1.00 H new ATOM 0 HB VAL A 971 40.138 -11.983 -1.042 1.00 1.00 H new ATOM 0 HG11 VAL A 971 40.493 -14.438 -0.862 1.00 1.00 H new ATOM 0 HG12 VAL A 971 40.444 -13.680 0.748 1.00 1.00 H new ATOM 0 HG13 VAL A 971 39.029 -14.574 0.141 1.00 1.00 H new ATOM 0 HG21 VAL A 971 39.136 -13.504 -2.723 1.00 1.00 H new ATOM 0 HG22 VAL A 971 37.672 -13.645 -1.720 1.00 1.00 H new ATOM 0 HG23 VAL A 971 38.103 -12.080 -2.450 1.00 1.00 H new ATOM 254 N GLY A 972 37.112 -10.386 -1.098 1.00 1.00 N ATOM 255 CA GLY A 972 36.717 -9.082 -1.620 1.00 1.00 C ATOM 256 C GLY A 972 36.179 -8.195 -0.503 1.00 1.00 C ATOM 257 O GLY A 972 36.442 -6.993 -0.470 1.00 1.00 O ATOM 0 H GLY A 972 36.570 -11.171 -1.459 1.00 1.00 H new ATOM 0 HA2 GLY A 972 37.572 -8.600 -2.094 1.00 1.00 H new ATOM 0 HA3 GLY A 972 35.956 -9.208 -2.390 1.00 1.00 H new ATOM 261 N VAL A 973 35.429 -8.798 0.416 1.00 1.00 N ATOM 262 CA VAL A 973 34.865 -8.051 1.532 1.00 1.00 C ATOM 263 C VAL A 973 35.978 -7.467 2.398 1.00 1.00 C ATOM 264 O VAL A 973 35.929 -6.299 2.781 1.00 1.00 O ATOM 265 CB VAL A 973 33.977 -8.967 2.378 1.00 1.00 C ATOM 266 CG1 VAL A 973 33.588 -8.246 3.669 1.00 1.00 C ATOM 267 CG2 VAL A 973 32.711 -9.311 1.591 1.00 1.00 C ATOM 0 H VAL A 973 35.200 -9.792 0.409 1.00 1.00 H new ATOM 0 HA VAL A 973 34.263 -7.233 1.135 1.00 1.00 H new ATOM 0 HB VAL A 973 34.520 -9.881 2.619 1.00 1.00 H new ATOM 0 HG11 VAL A 973 32.956 -8.897 4.273 1.00 1.00 H new ATOM 0 HG12 VAL A 973 34.488 -7.993 4.230 1.00 1.00 H new ATOM 0 HG13 VAL A 973 33.043 -7.334 3.426 1.00 1.00 H new ATOM 0 HG21 VAL A 973 32.076 -9.963 2.190 1.00 1.00 H new ATOM 0 HG22 VAL A 973 32.170 -8.395 1.354 1.00 1.00 H new ATOM 0 HG23 VAL A 973 32.984 -9.820 0.667 1.00 1.00 H new ATOM 277 N LEU A 974 36.985 -8.286 2.696 1.00 1.00 N ATOM 278 CA LEU A 974 38.107 -7.840 3.513 1.00 1.00 C ATOM 279 C LEU A 974 38.844 -6.702 2.810 1.00 1.00 C ATOM 280 O LEU A 974 39.214 -5.707 3.434 1.00 1.00 O ATOM 281 CB LEU A 974 39.066 -9.016 3.757 1.00 1.00 C ATOM 282 CG LEU A 974 40.268 -8.567 4.597 1.00 1.00 C ATOM 283 CD1 LEU A 974 39.789 -7.991 5.931 1.00 1.00 C ATOM 284 CD2 LEU A 974 41.171 -9.773 4.864 1.00 1.00 C ATOM 0 H LEU A 974 37.045 -9.256 2.385 1.00 1.00 H new ATOM 0 HA LEU A 974 37.733 -7.478 4.471 1.00 1.00 H new ATOM 0 HB2 LEU A 974 38.539 -9.822 4.268 1.00 1.00 H new ATOM 0 HB3 LEU A 974 39.411 -9.415 2.803 1.00 1.00 H new ATOM 0 HG LEU A 974 40.820 -7.800 4.054 1.00 1.00 H new ATOM 0 HD11 LEU A 974 40.649 -7.675 6.521 1.00 1.00 H new ATOM 0 HD12 LEU A 974 39.141 -7.134 5.746 1.00 1.00 H new ATOM 0 HD13 LEU A 974 39.234 -8.753 6.478 1.00 1.00 H new ATOM 0 HD21 LEU A 974 42.028 -9.461 5.461 1.00 1.00 H new ATOM 0 HD22 LEU A 974 40.610 -10.535 5.405 1.00 1.00 H new ATOM 0 HD23 LEU A 974 41.519 -10.184 3.916 1.00 1.00 H new ATOM 296 N GLY A 975 39.038 -6.856 1.506 1.00 1.00 N ATOM 297 CA GLY A 975 39.721 -5.841 0.708 1.00 1.00 C ATOM 298 C GLY A 975 38.936 -4.535 0.721 1.00 1.00 C ATOM 299 O GLY A 975 39.506 -3.447 0.616 1.00 1.00 O ATOM 0 H GLY A 975 38.733 -7.673 0.977 1.00 1.00 H new ATOM 0 HA2 GLY A 975 40.723 -5.674 1.102 1.00 1.00 H new ATOM 0 HA3 GLY A 975 39.836 -6.193 -0.317 1.00 1.00 H new ATOM 303 N GLY A 976 37.620 -4.652 0.838 1.00 1.00 N ATOM 304 CA GLY A 976 36.760 -3.474 0.849 1.00 1.00 C ATOM 305 C GLY A 976 37.111 -2.551 2.016 1.00 1.00 C ATOM 306 O GLY A 976 37.058 -1.327 1.881 1.00 1.00 O ATOM 0 H GLY A 976 37.127 -5.541 0.926 1.00 1.00 H new ATOM 0 HA2 GLY A 976 36.866 -2.933 -0.092 1.00 1.00 H new ATOM 0 HA3 GLY A 976 35.717 -3.781 0.925 1.00 1.00 H new ATOM 310 N LEU A 977 37.476 -3.137 3.155 1.00 1.00 N ATOM 311 CA LEU A 977 37.831 -2.337 4.327 1.00 1.00 C ATOM 312 C LEU A 977 39.046 -1.465 4.012 1.00 1.00 C ATOM 313 O LEU A 977 39.126 -0.301 4.432 1.00 1.00 O ATOM 314 CB LEU A 977 38.143 -3.238 5.523 1.00 1.00 C ATOM 315 CG LEU A 977 36.840 -3.656 6.217 1.00 1.00 C ATOM 316 CD1 LEU A 977 35.981 -4.469 5.251 1.00 1.00 C ATOM 317 CD2 LEU A 977 37.186 -4.508 7.444 1.00 1.00 C ATOM 0 H LEU A 977 37.534 -4.146 3.292 1.00 1.00 H new ATOM 0 HA LEU A 977 36.982 -1.702 4.580 1.00 1.00 H new ATOM 0 HB2 LEU A 977 38.688 -4.122 5.191 1.00 1.00 H new ATOM 0 HB3 LEU A 977 38.788 -2.712 6.227 1.00 1.00 H new ATOM 0 HG LEU A 977 36.284 -2.771 6.526 1.00 1.00 H new ATOM 0 HD11 LEU A 977 35.056 -4.764 5.747 1.00 1.00 H new ATOM 0 HD12 LEU A 977 35.746 -3.864 4.375 1.00 1.00 H new ATOM 0 HD13 LEU A 977 36.527 -5.360 4.940 1.00 1.00 H new ATOM 0 HD21 LEU A 977 36.268 -4.812 7.947 1.00 1.00 H new ATOM 0 HD22 LEU A 977 37.737 -5.394 7.128 1.00 1.00 H new ATOM 0 HD23 LEU A 977 37.800 -3.925 8.131 1.00 1.00 H new ATOM 329 N LEU A 978 39.988 -2.030 3.262 1.00 1.00 N ATOM 330 CA LEU A 978 41.179 -1.283 2.883 1.00 1.00 C ATOM 331 C LEU A 978 40.785 -0.074 2.045 1.00 1.00 C ATOM 332 O LEU A 978 41.367 1.002 2.189 1.00 1.00 O ATOM 333 CB LEU A 978 42.159 -2.153 2.095 1.00 1.00 C ATOM 334 CG LEU A 978 42.793 -3.200 3.021 1.00 1.00 C ATOM 335 CD1 LEU A 978 43.604 -4.196 2.187 1.00 1.00 C ATOM 336 CD2 LEU A 978 43.722 -2.523 4.042 1.00 1.00 C ATOM 0 H LEU A 978 39.950 -2.987 2.910 1.00 1.00 H new ATOM 0 HA LEU A 978 41.674 -0.956 3.797 1.00 1.00 H new ATOM 0 HB2 LEU A 978 41.640 -2.648 1.274 1.00 1.00 H new ATOM 0 HB3 LEU A 978 42.936 -1.530 1.651 1.00 1.00 H new ATOM 0 HG LEU A 978 41.998 -3.721 3.555 1.00 1.00 H new ATOM 0 HD11 LEU A 978 44.054 -4.940 2.845 1.00 1.00 H new ATOM 0 HD12 LEU A 978 42.947 -4.693 1.474 1.00 1.00 H new ATOM 0 HD13 LEU A 978 44.389 -3.665 1.648 1.00 1.00 H new ATOM 0 HD21 LEU A 978 44.163 -3.280 4.691 1.00 1.00 H new ATOM 0 HD22 LEU A 978 44.514 -1.990 3.516 1.00 1.00 H new ATOM 0 HD23 LEU A 978 43.149 -1.818 4.644 1.00 1.00 H new ATOM 348 N LEU A 979 39.798 -0.254 1.161 1.00 1.00 N ATOM 349 CA LEU A 979 39.351 0.847 0.305 1.00 1.00 C ATOM 350 C LEU A 979 38.822 2.006 1.133 1.00 1.00 C ATOM 351 O LEU A 979 39.190 3.157 0.898 1.00 1.00 O ATOM 352 CB LEU A 979 38.277 0.341 -0.667 1.00 1.00 C ATOM 353 CG LEU A 979 37.672 1.503 -1.468 1.00 1.00 C ATOM 354 CD1 LEU A 979 38.774 2.297 -2.164 1.00 1.00 C ATOM 355 CD2 LEU A 979 36.730 0.937 -2.534 1.00 1.00 C ATOM 0 H LEU A 979 39.302 -1.134 1.021 1.00 1.00 H new ATOM 0 HA LEU A 979 40.205 1.213 -0.265 1.00 1.00 H new ATOM 0 HB2 LEU A 979 38.713 -0.388 -1.350 1.00 1.00 H new ATOM 0 HB3 LEU A 979 37.491 -0.172 -0.112 1.00 1.00 H new ATOM 0 HG LEU A 979 37.130 2.159 -0.786 1.00 1.00 H new ATOM 0 HD11 LEU A 979 38.330 3.118 -2.728 1.00 1.00 H new ATOM 0 HD12 LEU A 979 39.460 2.698 -1.418 1.00 1.00 H new ATOM 0 HD13 LEU A 979 39.320 1.643 -2.844 1.00 1.00 H new ATOM 0 HD21 LEU A 979 36.296 1.756 -3.108 1.00 1.00 H new ATOM 0 HD22 LEU A 979 37.289 0.282 -3.202 1.00 1.00 H new ATOM 0 HD23 LEU A 979 35.934 0.370 -2.052 1.00 1.00 H new ATOM 367 N LEU A 980 37.996 1.711 2.119 1.00 1.00 N ATOM 368 CA LEU A 980 37.483 2.765 2.973 1.00 1.00 C ATOM 369 C LEU A 980 38.630 3.396 3.766 1.00 1.00 C ATOM 370 O LEU A 980 38.691 4.612 3.942 1.00 1.00 O ATOM 371 CB LEU A 980 36.421 2.207 3.924 1.00 1.00 C ATOM 372 CG LEU A 980 35.862 3.323 4.819 1.00 1.00 C ATOM 373 CD1 LEU A 980 35.251 4.441 3.968 1.00 1.00 C ATOM 374 CD2 LEU A 980 34.780 2.734 5.720 1.00 1.00 C ATOM 0 H LEU A 980 37.671 0.771 2.346 1.00 1.00 H new ATOM 0 HA LEU A 980 37.021 3.532 2.351 1.00 1.00 H new ATOM 0 HB2 LEU A 980 35.613 1.753 3.350 1.00 1.00 H new ATOM 0 HB3 LEU A 980 36.854 1.420 4.541 1.00 1.00 H new ATOM 0 HG LEU A 980 36.673 3.740 5.416 1.00 1.00 H new ATOM 0 HD11 LEU A 980 34.860 5.222 4.620 1.00 1.00 H new ATOM 0 HD12 LEU A 980 36.016 4.862 3.316 1.00 1.00 H new ATOM 0 HD13 LEU A 980 34.441 4.036 3.362 1.00 1.00 H new ATOM 0 HD21 LEU A 980 34.375 3.517 6.361 1.00 1.00 H new ATOM 0 HD22 LEU A 980 33.981 2.318 5.106 1.00 1.00 H new ATOM 0 HD23 LEU A 980 35.210 1.946 6.338 1.00 1.00 H new ATOM 386 N THR A 981 39.532 2.545 4.260 1.00 1.00 N ATOM 387 CA THR A 981 40.668 3.009 5.061 1.00 1.00 C ATOM 388 C THR A 981 41.579 3.948 4.269 1.00 1.00 C ATOM 389 O THR A 981 42.012 4.980 4.784 1.00 1.00 O ATOM 390 CB THR A 981 41.489 1.810 5.539 1.00 1.00 C ATOM 391 OG1 THR A 981 40.616 0.844 6.107 1.00 1.00 O ATOM 392 CG2 THR A 981 42.497 2.263 6.596 1.00 1.00 C ATOM 0 H THR A 981 39.499 1.535 4.121 1.00 1.00 H new ATOM 0 HA THR A 981 40.264 3.559 5.911 1.00 1.00 H new ATOM 0 HB THR A 981 42.023 1.376 4.694 1.00 1.00 H new ATOM 0 HG1 THR A 981 40.346 0.202 5.418 1.00 1.00 H new ATOM 0 HG21 THR A 981 43.080 1.406 6.934 1.00 1.00 H new ATOM 0 HG22 THR A 981 43.165 3.009 6.166 1.00 1.00 H new ATOM 0 HG23 THR A 981 41.966 2.697 7.443 1.00 1.00 H new ATOM 400 N ILE A 982 41.881 3.586 3.025 1.00 1.00 N ATOM 401 CA ILE A 982 42.761 4.413 2.207 1.00 1.00 C ATOM 402 C ILE A 982 42.147 5.789 1.963 1.00 1.00 C ATOM 403 O ILE A 982 42.840 6.802 2.060 1.00 1.00 O ATOM 404 CB ILE A 982 43.039 3.732 0.868 1.00 1.00 C ATOM 405 CG1 ILE A 982 43.903 2.486 1.099 1.00 1.00 C ATOM 406 CG2 ILE A 982 43.778 4.706 -0.051 1.00 1.00 C ATOM 407 CD1 ILE A 982 43.926 1.634 -0.173 1.00 1.00 C ATOM 0 H ILE A 982 41.537 2.741 2.568 1.00 1.00 H new ATOM 0 HA ILE A 982 43.699 4.540 2.748 1.00 1.00 H new ATOM 0 HB ILE A 982 42.098 3.438 0.404 1.00 1.00 H new ATOM 0 HG12 ILE A 982 44.917 2.779 1.371 1.00 1.00 H new ATOM 0 HG13 ILE A 982 43.506 1.905 1.931 1.00 1.00 H new ATOM 0 HG21 ILE A 982 43.978 4.223 -1.008 1.00 1.00 H new ATOM 0 HG22 ILE A 982 43.163 5.591 -0.213 1.00 1.00 H new ATOM 0 HG23 ILE A 982 44.721 4.999 0.412 1.00 1.00 H new ATOM 0 HD11 ILE A 982 44.540 0.749 -0.007 1.00 1.00 H new ATOM 0 HD12 ILE A 982 42.910 1.329 -0.425 1.00 1.00 H new ATOM 0 HD13 ILE A 982 44.344 2.217 -0.994 1.00 1.00 H new ATOM 419 N LEU A 983 40.856 5.831 1.651 1.00 1.00 N ATOM 420 CA LEU A 983 40.198 7.110 1.409 1.00 1.00 C ATOM 421 C LEU A 983 40.235 7.963 2.677 1.00 1.00 C ATOM 422 O LEU A 983 40.506 9.163 2.627 1.00 1.00 O ATOM 423 CB LEU A 983 38.741 6.886 0.985 1.00 1.00 C ATOM 424 CG LEU A 983 38.700 6.249 -0.409 1.00 1.00 C ATOM 425 CD1 LEU A 983 37.268 5.823 -0.742 1.00 1.00 C ATOM 426 CD2 LEU A 983 39.189 7.247 -1.467 1.00 1.00 C ATOM 0 H LEU A 983 40.254 5.012 1.561 1.00 1.00 H new ATOM 0 HA LEU A 983 40.726 7.628 0.608 1.00 1.00 H new ATOM 0 HB2 LEU A 983 38.238 6.241 1.705 1.00 1.00 H new ATOM 0 HB3 LEU A 983 38.204 7.835 0.978 1.00 1.00 H new ATOM 0 HG LEU A 983 39.354 5.377 -0.411 1.00 1.00 H new ATOM 0 HD11 LEU A 983 37.244 5.371 -1.734 1.00 1.00 H new ATOM 0 HD12 LEU A 983 36.923 5.098 -0.004 1.00 1.00 H new ATOM 0 HD13 LEU A 983 36.616 6.696 -0.725 1.00 1.00 H new ATOM 0 HD21 LEU A 983 39.154 6.780 -2.451 1.00 1.00 H new ATOM 0 HD22 LEU A 983 38.547 8.128 -1.460 1.00 1.00 H new ATOM 0 HD23 LEU A 983 40.214 7.543 -1.242 1.00 1.00 H new ATOM 438 N VAL A 984 39.975 7.320 3.812 1.00 1.00 N ATOM 439 CA VAL A 984 39.983 8.006 5.099 1.00 1.00 C ATOM 440 C VAL A 984 41.379 8.526 5.429 1.00 1.00 C ATOM 441 O VAL A 984 41.540 9.655 5.896 1.00 1.00 O ATOM 442 CB VAL A 984 39.517 7.051 6.199 1.00 1.00 C ATOM 443 CG1 VAL A 984 39.735 7.703 7.566 1.00 1.00 C ATOM 444 CG2 VAL A 984 38.028 6.747 6.006 1.00 1.00 C ATOM 0 H VAL A 984 39.756 6.325 3.866 1.00 1.00 H new ATOM 0 HA VAL A 984 39.302 8.855 5.039 1.00 1.00 H new ATOM 0 HB VAL A 984 40.088 6.124 6.147 1.00 1.00 H new ATOM 0 HG11 VAL A 984 39.403 7.023 8.351 1.00 1.00 H new ATOM 0 HG12 VAL A 984 40.794 7.922 7.700 1.00 1.00 H new ATOM 0 HG13 VAL A 984 39.163 8.629 7.623 1.00 1.00 H new ATOM 0 HG21 VAL A 984 37.691 6.066 6.788 1.00 1.00 H new ATOM 0 HG22 VAL A 984 37.457 7.674 6.061 1.00 1.00 H new ATOM 0 HG23 VAL A 984 37.875 6.284 5.031 1.00 1.00 H new ATOM 454 N LEU A 985 42.381 7.687 5.197 1.00 1.00 N ATOM 455 CA LEU A 985 43.767 8.051 5.484 1.00 1.00 C ATOM 456 C LEU A 985 44.212 9.249 4.646 1.00 1.00 C ATOM 457 O LEU A 985 44.890 10.147 5.149 1.00 1.00 O ATOM 458 CB LEU A 985 44.675 6.851 5.189 1.00 1.00 C ATOM 459 CG LEU A 985 46.145 7.203 5.462 1.00 1.00 C ATOM 460 CD1 LEU A 985 46.317 7.663 6.911 1.00 1.00 C ATOM 461 CD2 LEU A 985 47.008 5.961 5.228 1.00 1.00 C ATOM 0 H LEU A 985 42.262 6.750 4.811 1.00 1.00 H new ATOM 0 HA LEU A 985 43.840 8.329 6.535 1.00 1.00 H new ATOM 0 HB2 LEU A 985 44.378 6.003 5.807 1.00 1.00 H new ATOM 0 HB3 LEU A 985 44.556 6.545 4.150 1.00 1.00 H new ATOM 0 HG LEU A 985 46.450 8.007 4.792 1.00 1.00 H new ATOM 0 HD11 LEU A 985 47.363 7.910 7.093 1.00 1.00 H new ATOM 0 HD12 LEU A 985 45.700 8.544 7.089 1.00 1.00 H new ATOM 0 HD13 LEU A 985 46.010 6.863 7.585 1.00 1.00 H new ATOM 0 HD21 LEU A 985 48.053 6.203 5.420 1.00 1.00 H new ATOM 0 HD22 LEU A 985 46.690 5.165 5.901 1.00 1.00 H new ATOM 0 HD23 LEU A 985 46.896 5.629 4.196 1.00 1.00 H new ATOM 473 N ALA A 986 43.846 9.255 3.369 1.00 1.00 N ATOM 474 CA ALA A 986 44.239 10.353 2.493 1.00 1.00 C ATOM 475 C ALA A 986 43.642 11.671 2.978 1.00 1.00 C ATOM 476 O ALA A 986 44.322 12.697 2.996 1.00 1.00 O ATOM 477 CB ALA A 986 43.773 10.073 1.060 1.00 1.00 C ATOM 0 H ALA A 986 43.288 8.527 2.923 1.00 1.00 H new ATOM 0 HA ALA A 986 45.326 10.434 2.512 1.00 1.00 H new ATOM 0 HB1 ALA A 986 44.071 10.898 0.413 1.00 1.00 H new ATOM 0 HB2 ALA A 986 44.229 9.149 0.703 1.00 1.00 H new ATOM 0 HB3 ALA A 986 42.688 9.972 1.043 1.00 1.00 H new ATOM 483 N MET A 987 42.372 11.640 3.377 1.00 1.00 N ATOM 484 CA MET A 987 41.713 12.850 3.864 1.00 1.00 C ATOM 485 C MET A 987 42.351 13.326 5.170 1.00 1.00 C ATOM 486 O MET A 987 42.565 14.520 5.372 1.00 1.00 O ATOM 487 CB MET A 987 40.225 12.581 4.088 1.00 1.00 C ATOM 488 CG MET A 987 39.550 12.304 2.742 1.00 1.00 C ATOM 489 SD MET A 987 37.786 11.992 3.005 1.00 1.00 S ATOM 490 CE MET A 987 37.401 11.429 1.330 1.00 1.00 C ATOM 0 H MET A 987 41.787 10.805 3.373 1.00 1.00 H new ATOM 0 HA MET A 987 41.832 13.630 3.112 1.00 1.00 H new ATOM 0 HB2 MET A 987 40.095 11.729 4.755 1.00 1.00 H new ATOM 0 HB3 MET A 987 39.758 13.439 4.572 1.00 1.00 H new ATOM 0 HG2 MET A 987 39.684 13.155 2.074 1.00 1.00 H new ATOM 0 HG3 MET A 987 40.015 11.444 2.260 1.00 1.00 H new ATOM 0 HE1 MET A 987 36.587 12.029 0.923 1.00 1.00 H new ATOM 0 HE2 MET A 987 38.283 11.537 0.698 1.00 1.00 H new ATOM 0 HE3 MET A 987 37.101 10.381 1.358 1.00 1.00 H new ATOM 500 N TRP A 988 42.662 12.379 6.051 1.00 1.00 N ATOM 501 CA TRP A 988 43.285 12.704 7.332 1.00 1.00 C ATOM 502 C TRP A 988 44.650 13.353 7.112 1.00 1.00 C ATOM 503 O TRP A 988 45.033 14.280 7.822 1.00 1.00 O ATOM 504 CB TRP A 988 43.446 11.433 8.177 1.00 1.00 C ATOM 505 CG TRP A 988 44.313 11.707 9.371 1.00 1.00 C ATOM 506 CD1 TRP A 988 44.401 12.891 10.028 1.00 1.00 C ATOM 507 CD2 TRP A 988 45.215 10.792 10.064 1.00 1.00 C ATOM 508 NE1 TRP A 988 45.297 12.757 11.075 1.00 1.00 N ATOM 509 CE2 TRP A 988 45.827 11.484 11.136 1.00 1.00 C ATOM 510 CE3 TRP A 988 45.559 9.444 9.864 1.00 1.00 C ATOM 511 CZ2 TRP A 988 46.747 10.858 11.981 1.00 1.00 C ATOM 512 CZ3 TRP A 988 46.483 8.811 10.712 1.00 1.00 C ATOM 513 CH2 TRP A 988 47.076 9.517 11.768 1.00 1.00 C ATOM 0 H TRP A 988 42.494 11.384 5.903 1.00 1.00 H new ATOM 0 HA TRP A 988 42.642 13.407 7.861 1.00 1.00 H new ATOM 0 HB2 TRP A 988 42.468 11.079 8.503 1.00 1.00 H new ATOM 0 HB3 TRP A 988 43.887 10.640 7.573 1.00 1.00 H new ATOM 0 HD1 TRP A 988 43.860 13.791 9.775 1.00 1.00 H new ATOM 0 HE1 TRP A 988 45.536 13.508 11.723 1.00 1.00 H new ATOM 0 HE3 TRP A 988 45.110 8.891 9.053 1.00 1.00 H new ATOM 0 HZ2 TRP A 988 47.201 11.407 12.793 1.00 1.00 H new ATOM 0 HZ3 TRP A 988 46.738 7.774 10.549 1.00 1.00 H new ATOM 0 HH2 TRP A 988 47.786 9.025 12.416 1.00 1.00 H new ATOM 524 N LYS A 989 45.389 12.838 6.134 1.00 1.00 N ATOM 525 CA LYS A 989 46.729 13.346 5.842 1.00 1.00 C ATOM 526 C LYS A 989 46.667 14.764 5.267 1.00 1.00 C ATOM 527 O LYS A 989 47.688 15.439 5.161 1.00 1.00 O ATOM 528 CB LYS A 989 47.427 12.417 4.828 1.00 1.00 C ATOM 529 CG LYS A 989 48.673 11.731 5.443 1.00 1.00 C ATOM 530 CD LYS A 989 49.937 12.619 5.352 1.00 1.00 C ATOM 531 CE LYS A 989 50.031 13.586 6.541 1.00 1.00 C ATOM 532 NZ LYS A 989 51.404 14.163 6.586 1.00 1.00 N ATOM 0 H LYS A 989 45.086 12.073 5.532 1.00 1.00 H new ATOM 0 HA LYS A 989 47.293 13.373 6.774 1.00 1.00 H new ATOM 0 HB2 LYS A 989 46.724 11.657 4.487 1.00 1.00 H new ATOM 0 HB3 LYS A 989 47.724 12.993 3.951 1.00 1.00 H new ATOM 0 HG2 LYS A 989 48.475 11.491 6.488 1.00 1.00 H new ATOM 0 HG3 LYS A 989 48.857 10.788 4.929 1.00 1.00 H new ATOM 0 HD2 LYS A 989 50.825 11.988 5.324 1.00 1.00 H new ATOM 0 HD3 LYS A 989 49.919 13.186 4.421 1.00 1.00 H new ATOM 0 HE2 LYS A 989 49.291 14.380 6.440 1.00 1.00 H new ATOM 0 HE3 LYS A 989 49.812 13.062 7.471 1.00 1.00 H new ATOM 0 HZ1 LYS A 989 51.478 14.820 7.389 1.00 1.00 H new ATOM 0 HZ2 LYS A 989 52.099 13.397 6.700 1.00 1.00 H new ATOM 0 HZ3 LYS A 989 51.595 14.675 5.701 1.00 1.00 H new ATOM 546 N VAL A 990 45.474 15.217 4.896 1.00 1.00 N ATOM 547 CA VAL A 990 45.331 16.558 4.340 1.00 1.00 C ATOM 548 C VAL A 990 45.087 17.565 5.456 1.00 1.00 C ATOM 549 O VAL A 990 45.280 18.767 5.277 1.00 1.00 O ATOM 550 CB VAL A 990 44.173 16.594 3.342 1.00 1.00 C ATOM 551 CG1 VAL A 990 43.800 18.047 3.035 1.00 1.00 C ATOM 552 CG2 VAL A 990 44.600 15.894 2.053 1.00 1.00 C ATOM 0 H VAL A 990 44.606 14.686 4.968 1.00 1.00 H new ATOM 0 HA VAL A 990 46.253 16.822 3.821 1.00 1.00 H new ATOM 0 HB VAL A 990 43.309 16.085 3.769 1.00 1.00 H new ATOM 0 HG11 VAL A 990 42.975 18.068 2.323 1.00 1.00 H new ATOM 0 HG12 VAL A 990 43.499 18.548 3.955 1.00 1.00 H new ATOM 0 HG13 VAL A 990 44.661 18.561 2.607 1.00 1.00 H new ATOM 0 HG21 VAL A 990 43.778 15.916 1.337 1.00 1.00 H new ATOM 0 HG22 VAL A 990 45.464 16.406 1.630 1.00 1.00 H new ATOM 0 HG23 VAL A 990 44.863 14.859 2.271 1.00 1.00 H new ATOM 562 N GLY A 991 44.654 17.065 6.606 1.00 1.00 N ATOM 563 CA GLY A 991 44.382 17.928 7.748 1.00 1.00 C ATOM 564 C GLY A 991 43.007 18.564 7.615 1.00 1.00 C ATOM 565 O GLY A 991 42.621 19.419 8.414 1.00 1.00 O ATOM 0 H GLY A 991 44.484 16.073 6.772 1.00 1.00 H new ATOM 0 HA2 GLY A 991 44.435 17.349 8.670 1.00 1.00 H new ATOM 0 HA3 GLY A 991 45.144 18.704 7.815 1.00 1.00 H new ATOM 569 N PHE A 992 42.271 18.136 6.596 1.00 1.00 N ATOM 570 CA PHE A 992 40.934 18.665 6.357 1.00 1.00 C ATOM 571 C PHE A 992 40.016 18.366 7.537 1.00 1.00 C ATOM 572 O PHE A 992 39.230 19.216 7.956 1.00 1.00 O ATOM 573 CB PHE A 992 40.354 18.066 5.068 1.00 1.00 C ATOM 574 CG PHE A 992 38.892 18.450 4.873 1.00 1.00 C ATOM 575 CD1 PHE A 992 38.377 19.682 5.327 1.00 1.00 C ATOM 576 CD2 PHE A 992 38.044 17.546 4.220 1.00 1.00 C ATOM 577 CE1 PHE A 992 37.027 19.992 5.121 1.00 1.00 C ATOM 578 CE2 PHE A 992 36.695 17.862 4.019 1.00 1.00 C ATOM 579 CZ PHE A 992 36.188 19.085 4.469 1.00 1.00 C ATOM 0 H PHE A 992 42.575 17.429 5.926 1.00 1.00 H new ATOM 0 HA PHE A 992 41.005 19.747 6.245 1.00 1.00 H new ATOM 0 HB2 PHE A 992 40.937 18.409 4.213 1.00 1.00 H new ATOM 0 HB3 PHE A 992 40.443 16.980 5.099 1.00 1.00 H new ATOM 0 HD1 PHE A 992 39.023 20.385 5.833 1.00 1.00 H new ATOM 0 HD2 PHE A 992 38.433 16.601 3.870 1.00 1.00 H new ATOM 0 HE1 PHE A 992 36.633 20.936 5.468 1.00 1.00 H new ATOM 0 HE2 PHE A 992 36.046 17.161 3.516 1.00 1.00 H new ATOM 0 HZ PHE A 992 35.148 19.328 4.312 1.00 1.00 H new ATOM 589 N PHE A 993 40.113 17.146 8.059 1.00 1.00 N ATOM 590 CA PHE A 993 39.276 16.738 9.185 1.00 1.00 C ATOM 591 C PHE A 993 40.008 16.924 10.512 1.00 1.00 C ATOM 592 O PHE A 993 39.461 16.624 11.574 1.00 1.00 O ATOM 593 CB PHE A 993 38.870 15.271 9.034 1.00 1.00 C ATOM 594 CG PHE A 993 37.832 15.144 7.947 1.00 1.00 C ATOM 595 CD1 PHE A 993 36.475 15.297 8.252 1.00 1.00 C ATOM 596 CD2 PHE A 993 38.228 14.874 6.633 1.00 1.00 C ATOM 597 CE1 PHE A 993 35.514 15.177 7.242 1.00 1.00 C ATOM 598 CE2 PHE A 993 37.267 14.754 5.622 1.00 1.00 C ATOM 599 CZ PHE A 993 35.910 14.906 5.927 1.00 1.00 C ATOM 0 H PHE A 993 40.756 16.428 7.725 1.00 1.00 H new ATOM 0 HA PHE A 993 38.387 17.369 9.185 1.00 1.00 H new ATOM 0 HB2 PHE A 993 39.742 14.665 8.791 1.00 1.00 H new ATOM 0 HB3 PHE A 993 38.473 14.894 9.976 1.00 1.00 H new ATOM 0 HD1 PHE A 993 36.170 15.508 9.266 1.00 1.00 H new ATOM 0 HD2 PHE A 993 39.276 14.758 6.398 1.00 1.00 H new ATOM 0 HE1 PHE A 993 34.466 15.294 7.477 1.00 1.00 H new ATOM 0 HE2 PHE A 993 37.573 14.544 4.608 1.00 1.00 H new ATOM 0 HZ PHE A 993 35.168 14.814 5.148 1.00 1.00 H new ATOM 609 N LYS A 994 41.240 17.421 10.452 1.00 1.00 N ATOM 610 CA LYS A 994 42.016 17.636 11.670 1.00 1.00 C ATOM 611 C LYS A 994 41.730 19.021 12.239 1.00 1.00 C ATOM 612 O LYS A 994 41.770 20.021 11.522 1.00 1.00 O ATOM 613 CB LYS A 994 43.511 17.505 11.371 1.00 1.00 C ATOM 614 CG LYS A 994 44.308 17.634 12.670 1.00 1.00 C ATOM 615 CD LYS A 994 45.793 17.415 12.380 1.00 1.00 C ATOM 616 CE LYS A 994 46.585 17.515 13.683 1.00 1.00 C ATOM 617 NZ LYS A 994 46.531 18.913 14.193 1.00 1.00 N ATOM 0 H LYS A 994 41.717 17.679 9.588 1.00 1.00 H new ATOM 0 HA LYS A 994 41.728 16.882 12.402 1.00 1.00 H new ATOM 0 HB2 LYS A 994 43.715 16.543 10.901 1.00 1.00 H new ATOM 0 HB3 LYS A 994 43.820 18.276 10.665 1.00 1.00 H new ATOM 0 HG2 LYS A 994 44.153 18.620 13.108 1.00 1.00 H new ATOM 0 HG3 LYS A 994 43.957 16.903 13.399 1.00 1.00 H new ATOM 0 HD2 LYS A 994 45.945 16.437 11.923 1.00 1.00 H new ATOM 0 HD3 LYS A 994 46.149 18.159 11.667 1.00 1.00 H new ATOM 0 HE2 LYS A 994 46.173 16.830 14.424 1.00 1.00 H new ATOM 0 HE3 LYS A 994 47.620 17.218 13.515 1.00 1.00 H new ATOM 0 HZ1 LYS A 994 47.283 19.055 14.897 1.00 1.00 H new ATOM 0 HZ2 LYS A 994 46.667 19.576 13.403 1.00 1.00 H new ATOM 0 HZ3 LYS A 994 45.606 19.086 14.635 1.00 1.00 H new ATOM 631 N ARG A 995 41.443 19.071 13.536 1.00 1.00 N ATOM 632 CA ARG A 995 41.155 20.331 14.202 1.00 1.00 C ATOM 633 C ARG A 995 41.868 20.347 15.543 1.00 1.00 C ATOM 634 O ARG A 995 42.128 19.292 16.122 1.00 1.00 O ATOM 635 CB ARG A 995 39.643 20.484 14.425 1.00 1.00 C ATOM 636 CG ARG A 995 38.871 20.460 13.092 1.00 1.00 C ATOM 637 CD ARG A 995 39.090 21.758 12.302 1.00 1.00 C ATOM 638 NE ARG A 995 38.285 21.742 11.085 1.00 1.00 N ATOM 639 CZ ARG A 995 37.029 22.176 11.084 1.00 1.00 C ATOM 640 NH1 ARG A 995 36.485 22.608 12.189 1.00 1.00 N ATOM 641 NH2 ARG A 995 36.336 22.165 9.976 1.00 1.00 N ATOM 0 H ARG A 995 41.404 18.253 14.144 1.00 1.00 H new ATOM 0 HA ARG A 995 41.501 21.157 13.580 1.00 1.00 H new ATOM 0 HB2 ARG A 995 39.286 19.680 15.068 1.00 1.00 H new ATOM 0 HB3 ARG A 995 39.444 21.421 14.945 1.00 1.00 H new ATOM 0 HG2 ARG A 995 39.197 19.608 12.495 1.00 1.00 H new ATOM 0 HG3 ARG A 995 37.807 20.325 13.287 1.00 1.00 H new ATOM 0 HD2 ARG A 995 38.820 22.617 12.916 1.00 1.00 H new ATOM 0 HD3 ARG A 995 40.145 21.866 12.049 1.00 1.00 H new ATOM 0 HE ARG A 995 38.694 21.391 10.219 1.00 1.00 H new ATOM 0 HH11 ARG A 995 37.024 22.613 13.055 1.00 1.00 H new ATOM 0 HH12 ARG A 995 35.521 22.941 12.187 1.00 1.00 H new ATOM 0 HH21 ARG A 995 36.759 21.823 9.113 1.00 1.00 H new ATOM 0 HH22 ARG A 995 35.372 22.498 9.974 1.00 1.00 H new ATOM 808 N ASP B 692 27.163 -15.964 -12.594 1.00 1.00 N ATOM 809 CA ASP B 692 26.566 -15.639 -11.294 1.00 1.00 C ATOM 810 C ASP B 692 27.608 -15.075 -10.322 1.00 1.00 C ATOM 811 O ASP B 692 27.299 -14.164 -9.554 1.00 1.00 O ATOM 812 CB ASP B 692 25.914 -16.891 -10.675 1.00 1.00 C ATOM 813 CG ASP B 692 24.483 -17.086 -11.197 1.00 1.00 C ATOM 814 OD1 ASP B 692 23.998 -16.218 -11.906 1.00 1.00 O ATOM 815 OD2 ASP B 692 23.892 -18.104 -10.878 1.00 1.00 O ATOM 0 HA ASP B 692 25.806 -14.877 -11.465 1.00 1.00 H new ATOM 0 HB2 ASP B 692 26.513 -17.771 -10.911 1.00 1.00 H new ATOM 0 HB3 ASP B 692 25.898 -16.797 -9.589 1.00 1.00 H new ATOM 820 N ILE B 693 28.835 -15.600 -10.355 1.00 1.00 N ATOM 821 CA ILE B 693 29.893 -15.113 -9.457 1.00 1.00 C ATOM 822 C ILE B 693 30.271 -13.663 -9.787 1.00 1.00 C ATOM 823 O ILE B 693 30.500 -12.855 -8.887 1.00 1.00 O ATOM 824 CB ILE B 693 31.136 -16.016 -9.560 1.00 1.00 C ATOM 825 CG1 ILE B 693 32.130 -15.695 -8.433 1.00 1.00 C ATOM 826 CG2 ILE B 693 31.825 -15.784 -10.900 1.00 1.00 C ATOM 827 CD1 ILE B 693 33.247 -16.753 -8.401 1.00 1.00 C ATOM 0 H ILE B 693 29.121 -16.351 -10.983 1.00 1.00 H new ATOM 0 HA ILE B 693 29.511 -15.144 -8.437 1.00 1.00 H new ATOM 0 HB ILE B 693 30.816 -17.055 -9.474 1.00 1.00 H new ATOM 0 HG12 ILE B 693 32.559 -14.705 -8.586 1.00 1.00 H new ATOM 0 HG13 ILE B 693 31.611 -15.672 -7.475 1.00 1.00 H new ATOM 0 HG21 ILE B 693 32.705 -16.423 -10.972 1.00 1.00 H new ATOM 0 HG22 ILE B 693 31.135 -16.023 -11.710 1.00 1.00 H new ATOM 0 HG23 ILE B 693 32.128 -14.740 -10.977 1.00 1.00 H new ATOM 0 HD11 ILE B 693 33.947 -16.518 -7.600 1.00 1.00 H new ATOM 0 HD12 ILE B 693 32.811 -17.737 -8.226 1.00 1.00 H new ATOM 0 HD13 ILE B 693 33.774 -16.754 -9.355 1.00 1.00 H new ATOM 839 N LEU B 694 30.341 -13.340 -11.078 1.00 1.00 N ATOM 840 CA LEU B 694 30.702 -11.985 -11.493 1.00 1.00 C ATOM 841 C LEU B 694 29.660 -10.996 -10.990 1.00 1.00 C ATOM 842 O LEU B 694 29.997 -9.919 -10.502 1.00 1.00 O ATOM 843 CB LEU B 694 30.792 -11.893 -13.024 1.00 1.00 C ATOM 844 CG LEU B 694 31.997 -12.705 -13.517 1.00 1.00 C ATOM 845 CD1 LEU B 694 31.964 -12.810 -15.045 1.00 1.00 C ATOM 846 CD2 LEU B 694 33.308 -12.036 -13.079 1.00 1.00 C ATOM 0 H LEU B 694 30.156 -13.987 -11.844 1.00 1.00 H new ATOM 0 HA LEU B 694 31.676 -11.743 -11.067 1.00 1.00 H new ATOM 0 HB2 LEU B 694 29.875 -12.272 -13.476 1.00 1.00 H new ATOM 0 HB3 LEU B 694 30.892 -10.852 -13.331 1.00 1.00 H new ATOM 0 HG LEU B 694 31.945 -13.703 -13.082 1.00 1.00 H new ATOM 0 HD11 LEU B 694 32.822 -13.388 -15.389 1.00 1.00 H new ATOM 0 HD12 LEU B 694 31.045 -13.306 -15.356 1.00 1.00 H new ATOM 0 HD13 LEU B 694 32.002 -11.811 -15.479 1.00 1.00 H new ATOM 0 HD21 LEU B 694 34.154 -12.624 -13.436 1.00 1.00 H new ATOM 0 HD22 LEU B 694 33.362 -11.031 -13.498 1.00 1.00 H new ATOM 0 HD23 LEU B 694 33.341 -11.977 -11.991 1.00 1.00 H new ATOM 858 N VAL B 695 28.393 -11.376 -11.101 1.00 1.00 N ATOM 859 CA VAL B 695 27.311 -10.517 -10.638 1.00 1.00 C ATOM 860 C VAL B 695 27.418 -10.304 -9.130 1.00 1.00 C ATOM 861 O VAL B 695 27.283 -9.183 -8.639 1.00 1.00 O ATOM 862 CB VAL B 695 25.956 -11.148 -10.974 1.00 1.00 C ATOM 863 CG1 VAL B 695 24.838 -10.346 -10.301 1.00 1.00 C ATOM 864 CG2 VAL B 695 25.755 -11.132 -12.492 1.00 1.00 C ATOM 0 H VAL B 695 28.092 -12.264 -11.503 1.00 1.00 H new ATOM 0 HA VAL B 695 27.391 -9.554 -11.142 1.00 1.00 H new ATOM 0 HB VAL B 695 25.931 -12.176 -10.613 1.00 1.00 H new ATOM 0 HG11 VAL B 695 23.874 -10.795 -10.540 1.00 1.00 H new ATOM 0 HG12 VAL B 695 24.984 -10.354 -9.221 1.00 1.00 H new ATOM 0 HG13 VAL B 695 24.859 -9.318 -10.663 1.00 1.00 H new ATOM 0 HG21 VAL B 695 24.792 -11.580 -12.736 1.00 1.00 H new ATOM 0 HG22 VAL B 695 25.778 -10.103 -12.851 1.00 1.00 H new ATOM 0 HG23 VAL B 695 26.552 -11.701 -12.971 1.00 1.00 H new ATOM 874 N VAL B 696 27.669 -11.395 -8.405 1.00 1.00 N ATOM 875 CA VAL B 696 27.798 -11.338 -6.951 1.00 1.00 C ATOM 876 C VAL B 696 28.995 -10.482 -6.555 1.00 1.00 C ATOM 877 O VAL B 696 28.907 -9.657 -5.645 1.00 1.00 O ATOM 878 CB VAL B 696 27.961 -12.753 -6.383 1.00 1.00 C ATOM 879 CG1 VAL B 696 28.282 -12.674 -4.890 1.00 1.00 C ATOM 880 CG2 VAL B 696 26.656 -13.530 -6.576 1.00 1.00 C ATOM 0 H VAL B 696 27.787 -12.327 -8.802 1.00 1.00 H new ATOM 0 HA VAL B 696 26.894 -10.888 -6.540 1.00 1.00 H new ATOM 0 HB VAL B 696 28.774 -13.260 -6.904 1.00 1.00 H new ATOM 0 HG11 VAL B 696 28.397 -13.681 -4.489 1.00 1.00 H new ATOM 0 HG12 VAL B 696 29.208 -12.118 -4.746 1.00 1.00 H new ATOM 0 HG13 VAL B 696 27.470 -12.167 -4.369 1.00 1.00 H new ATOM 0 HG21 VAL B 696 26.769 -14.537 -6.173 1.00 1.00 H new ATOM 0 HG22 VAL B 696 25.847 -13.019 -6.054 1.00 1.00 H new ATOM 0 HG23 VAL B 696 26.421 -13.589 -7.639 1.00 1.00 H new ATOM 890 N LEU B 697 30.115 -10.684 -7.240 1.00 1.00 N ATOM 891 CA LEU B 697 31.327 -9.924 -6.945 1.00 1.00 C ATOM 892 C LEU B 697 31.080 -8.430 -7.179 1.00 1.00 C ATOM 893 O LEU B 697 31.494 -7.587 -6.381 1.00 1.00 O ATOM 894 CB LEU B 697 32.479 -10.407 -7.841 1.00 1.00 C ATOM 895 CG LEU B 697 33.756 -9.600 -7.559 1.00 1.00 C ATOM 896 CD1 LEU B 697 34.130 -9.726 -6.080 1.00 1.00 C ATOM 897 CD2 LEU B 697 34.907 -10.144 -8.415 1.00 1.00 C ATOM 0 H LEU B 697 30.211 -11.361 -7.997 1.00 1.00 H new ATOM 0 HA LEU B 697 31.596 -10.081 -5.900 1.00 1.00 H new ATOM 0 HB2 LEU B 697 32.665 -11.466 -7.664 1.00 1.00 H new ATOM 0 HB3 LEU B 697 32.200 -10.303 -8.890 1.00 1.00 H new ATOM 0 HG LEU B 697 33.578 -8.553 -7.804 1.00 1.00 H new ATOM 0 HD11 LEU B 697 35.036 -9.153 -5.884 1.00 1.00 H new ATOM 0 HD12 LEU B 697 33.317 -9.341 -5.465 1.00 1.00 H new ATOM 0 HD13 LEU B 697 34.304 -10.774 -5.837 1.00 1.00 H new ATOM 0 HD21 LEU B 697 35.812 -9.571 -8.214 1.00 1.00 H new ATOM 0 HD22 LEU B 697 35.079 -11.192 -8.170 1.00 1.00 H new ATOM 0 HD23 LEU B 697 34.649 -10.056 -9.470 1.00 1.00 H new ATOM 909 N LEU B 698 30.399 -8.108 -8.275 1.00 1.00 N ATOM 910 CA LEU B 698 30.096 -6.714 -8.594 1.00 1.00 C ATOM 911 C LEU B 698 29.213 -6.111 -7.497 1.00 1.00 C ATOM 912 O LEU B 698 29.387 -4.956 -7.086 1.00 1.00 O ATOM 913 CB LEU B 698 29.376 -6.635 -9.945 1.00 1.00 C ATOM 914 CG LEU B 698 29.058 -5.176 -10.303 1.00 1.00 C ATOM 915 CD1 LEU B 698 30.348 -4.352 -10.370 1.00 1.00 C ATOM 916 CD2 LEU B 698 28.360 -5.144 -11.661 1.00 1.00 C ATOM 0 H LEU B 698 30.049 -8.785 -8.952 1.00 1.00 H new ATOM 0 HA LEU B 698 31.027 -6.150 -8.653 1.00 1.00 H new ATOM 0 HB2 LEU B 698 29.999 -7.078 -10.722 1.00 1.00 H new ATOM 0 HB3 LEU B 698 28.454 -7.215 -9.906 1.00 1.00 H new ATOM 0 HG LEU B 698 28.411 -4.748 -9.538 1.00 1.00 H new ATOM 0 HD11 LEU B 698 30.108 -3.320 -10.625 1.00 1.00 H new ATOM 0 HD12 LEU B 698 30.848 -4.380 -9.402 1.00 1.00 H new ATOM 0 HD13 LEU B 698 31.007 -4.769 -11.131 1.00 1.00 H new ATOM 0 HD21 LEU B 698 28.129 -4.113 -11.927 1.00 1.00 H new ATOM 0 HD22 LEU B 698 29.016 -5.575 -12.417 1.00 1.00 H new ATOM 0 HD23 LEU B 698 27.437 -5.721 -11.609 1.00 1.00 H new ATOM 928 N SER B 699 28.261 -6.907 -7.032 1.00 1.00 N ATOM 929 CA SER B 699 27.356 -6.448 -5.975 1.00 1.00 C ATOM 930 C SER B 699 28.144 -6.153 -4.694 1.00 1.00 C ATOM 931 O SER B 699 27.872 -5.178 -3.985 1.00 1.00 O ATOM 932 CB SER B 699 26.287 -7.499 -5.689 1.00 1.00 C ATOM 933 OG SER B 699 25.513 -7.707 -6.861 1.00 1.00 O ATOM 0 H SER B 699 28.092 -7.858 -7.359 1.00 1.00 H new ATOM 0 HA SER B 699 26.869 -5.534 -6.316 1.00 1.00 H new ATOM 0 HB2 SER B 699 26.753 -8.433 -5.376 1.00 1.00 H new ATOM 0 HB3 SER B 699 25.647 -7.171 -4.870 1.00 1.00 H new ATOM 0 HG SER B 699 26.043 -8.202 -7.520 1.00 1.00 H new ATOM 939 N VAL B 700 29.123 -7.010 -4.402 1.00 1.00 N ATOM 940 CA VAL B 700 29.946 -6.842 -3.208 1.00 1.00 C ATOM 941 C VAL B 700 30.730 -5.539 -3.280 1.00 1.00 C ATOM 942 O VAL B 700 30.795 -4.790 -2.308 1.00 1.00 O ATOM 943 CB VAL B 700 30.922 -8.010 -3.057 1.00 1.00 C ATOM 944 CG1 VAL B 700 31.916 -7.697 -1.936 1.00 1.00 C ATOM 945 CG2 VAL B 700 30.150 -9.284 -2.697 1.00 1.00 C ATOM 0 H VAL B 700 29.363 -7.821 -4.972 1.00 1.00 H new ATOM 0 HA VAL B 700 29.282 -6.816 -2.344 1.00 1.00 H new ATOM 0 HB VAL B 700 31.455 -8.158 -3.996 1.00 1.00 H new ATOM 0 HG11 VAL B 700 32.613 -8.528 -1.826 1.00 1.00 H new ATOM 0 HG12 VAL B 700 32.468 -6.790 -2.182 1.00 1.00 H new ATOM 0 HG13 VAL B 700 31.375 -7.550 -1.001 1.00 1.00 H new ATOM 0 HG21 VAL B 700 30.848 -10.114 -2.590 1.00 1.00 H new ATOM 0 HG22 VAL B 700 29.618 -9.134 -1.758 1.00 1.00 H new ATOM 0 HG23 VAL B 700 29.434 -9.511 -3.487 1.00 1.00 H new ATOM 955 N MET B 701 31.328 -5.275 -4.437 1.00 1.00 N ATOM 956 CA MET B 701 32.111 -4.057 -4.614 1.00 1.00 C ATOM 957 C MET B 701 31.224 -2.823 -4.474 1.00 1.00 C ATOM 958 O MET B 701 31.624 -1.831 -3.866 1.00 1.00 O ATOM 959 CB MET B 701 32.772 -4.058 -5.995 1.00 1.00 C ATOM 960 CG MET B 701 33.953 -5.031 -5.991 1.00 1.00 C ATOM 961 SD MET B 701 34.675 -5.117 -7.649 1.00 1.00 S ATOM 962 CE MET B 701 35.358 -3.442 -7.701 1.00 1.00 C ATOM 0 H MET B 701 31.287 -5.880 -5.257 1.00 1.00 H new ATOM 0 HA MET B 701 32.880 -4.027 -3.842 1.00 1.00 H new ATOM 0 HB2 MET B 701 32.049 -4.349 -6.757 1.00 1.00 H new ATOM 0 HB3 MET B 701 33.114 -3.054 -6.248 1.00 1.00 H new ATOM 0 HG2 MET B 701 34.705 -4.703 -5.273 1.00 1.00 H new ATOM 0 HG3 MET B 701 33.621 -6.020 -5.676 1.00 1.00 H new ATOM 0 HE1 MET B 701 36.172 -3.403 -8.425 1.00 1.00 H new ATOM 0 HE2 MET B 701 34.578 -2.740 -7.994 1.00 1.00 H new ATOM 0 HE3 MET B 701 35.736 -3.173 -6.715 1.00 1.00 H new ATOM 972 N GLY B 702 30.019 -2.889 -5.033 1.00 1.00 N ATOM 973 CA GLY B 702 29.093 -1.765 -4.953 1.00 1.00 C ATOM 974 C GLY B 702 28.672 -1.502 -3.510 1.00 1.00 C ATOM 975 O GLY B 702 28.542 -0.349 -3.089 1.00 1.00 O ATOM 0 H GLY B 702 29.664 -3.699 -5.541 1.00 1.00 H new ATOM 0 HA2 GLY B 702 29.563 -0.873 -5.366 1.00 1.00 H new ATOM 0 HA3 GLY B 702 28.212 -1.972 -5.560 1.00 1.00 H new ATOM 979 N ALA B 703 28.454 -2.576 -2.750 1.00 1.00 N ATOM 980 CA ALA B 703 28.042 -2.428 -1.356 1.00 1.00 C ATOM 981 C ALA B 703 29.114 -1.705 -0.547 1.00 1.00 C ATOM 982 O ALA B 703 28.806 -0.864 0.303 1.00 1.00 O ATOM 983 CB ALA B 703 27.775 -3.803 -0.739 1.00 1.00 C ATOM 0 H ALA B 703 28.554 -3.540 -3.069 1.00 1.00 H new ATOM 0 HA ALA B 703 27.128 -1.835 -1.333 1.00 1.00 H new ATOM 0 HB1 ALA B 703 27.469 -3.682 0.300 1.00 1.00 H new ATOM 0 HB2 ALA B 703 26.983 -4.304 -1.295 1.00 1.00 H new ATOM 0 HB3 ALA B 703 28.684 -4.404 -0.782 1.00 1.00 H new ATOM 989 N ILE B 704 30.375 -2.037 -0.814 1.00 1.00 N ATOM 990 CA ILE B 704 31.484 -1.414 -0.101 1.00 1.00 C ATOM 991 C ILE B 704 31.540 0.087 -0.384 1.00 1.00 C ATOM 992 O ILE B 704 31.745 0.894 0.522 1.00 1.00 O ATOM 993 CB ILE B 704 32.807 -2.047 -0.533 1.00 1.00 C ATOM 994 CG1 ILE B 704 32.889 -3.512 -0.058 1.00 1.00 C ATOM 995 CG2 ILE B 704 33.971 -1.233 0.036 1.00 1.00 C ATOM 996 CD1 ILE B 704 32.824 -3.614 1.476 1.00 1.00 C ATOM 0 H ILE B 704 30.651 -2.727 -1.512 1.00 1.00 H new ATOM 0 HA ILE B 704 31.326 -1.571 0.966 1.00 1.00 H new ATOM 0 HB ILE B 704 32.865 -2.043 -1.621 1.00 1.00 H new ATOM 0 HG12 ILE B 704 32.071 -4.084 -0.496 1.00 1.00 H new ATOM 0 HG13 ILE B 704 33.817 -3.959 -0.414 1.00 1.00 H new ATOM 0 HG21 ILE B 704 34.915 -1.684 -0.271 1.00 1.00 H new ATOM 0 HG22 ILE B 704 33.918 -0.211 -0.339 1.00 1.00 H new ATOM 0 HG23 ILE B 704 33.911 -1.224 1.124 1.00 1.00 H new ATOM 0 HD11 ILE B 704 32.885 -4.661 1.774 1.00 1.00 H new ATOM 0 HD12 ILE B 704 33.657 -3.064 1.913 1.00 1.00 H new ATOM 0 HD13 ILE B 704 31.884 -3.190 1.829 1.00 1.00 H new ATOM 1008 N LEU B 705 31.376 0.456 -1.645 1.00 1.00 N ATOM 1009 CA LEU B 705 31.419 1.863 -2.023 1.00 1.00 C ATOM 1010 C LEU B 705 30.277 2.654 -1.390 1.00 1.00 C ATOM 1011 O LEU B 705 30.479 3.780 -0.942 1.00 1.00 O ATOM 1012 CB LEU B 705 31.376 2.003 -3.548 1.00 1.00 C ATOM 1013 CG LEU B 705 32.696 1.501 -4.152 1.00 1.00 C ATOM 1014 CD1 LEU B 705 32.553 1.410 -5.674 1.00 1.00 C ATOM 1015 CD2 LEU B 705 33.848 2.460 -3.805 1.00 1.00 C ATOM 0 H LEU B 705 31.214 -0.190 -2.418 1.00 1.00 H new ATOM 0 HA LEU B 705 32.356 2.277 -1.649 1.00 1.00 H new ATOM 0 HB2 LEU B 705 30.540 1.432 -3.952 1.00 1.00 H new ATOM 0 HB3 LEU B 705 31.212 3.045 -3.823 1.00 1.00 H new ATOM 0 HG LEU B 705 32.921 0.518 -3.738 1.00 1.00 H new ATOM 0 HD11 LEU B 705 33.488 1.054 -6.107 1.00 1.00 H new ATOM 0 HD12 LEU B 705 31.750 0.716 -5.923 1.00 1.00 H new ATOM 0 HD13 LEU B 705 32.319 2.395 -6.077 1.00 1.00 H new ATOM 0 HD21 LEU B 705 34.775 2.088 -4.241 1.00 1.00 H new ATOM 0 HD22 LEU B 705 33.630 3.450 -4.205 1.00 1.00 H new ATOM 0 HD23 LEU B 705 33.956 2.522 -2.722 1.00 1.00 H new ATOM 1027 N LEU B 706 29.077 2.077 -1.371 1.00 1.00 N ATOM 1028 CA LEU B 706 27.926 2.781 -0.809 1.00 1.00 C ATOM 1029 C LEU B 706 28.112 3.076 0.680 1.00 1.00 C ATOM 1030 O LEU B 706 27.832 4.185 1.134 1.00 1.00 O ATOM 1031 CB LEU B 706 26.663 1.940 -1.004 1.00 1.00 C ATOM 1032 CG LEU B 706 26.294 1.894 -2.491 1.00 1.00 C ATOM 1033 CD1 LEU B 706 25.173 0.878 -2.699 1.00 1.00 C ATOM 1034 CD2 LEU B 706 25.825 3.276 -2.969 1.00 1.00 C ATOM 0 H LEU B 706 28.878 1.143 -1.730 1.00 1.00 H new ATOM 0 HA LEU B 706 27.831 3.732 -1.333 1.00 1.00 H new ATOM 0 HB2 LEU B 706 26.826 0.930 -0.629 1.00 1.00 H new ATOM 0 HB3 LEU B 706 25.840 2.364 -0.429 1.00 1.00 H new ATOM 0 HG LEU B 706 27.173 1.603 -3.066 1.00 1.00 H new ATOM 0 HD11 LEU B 706 24.907 0.841 -3.755 1.00 1.00 H new ATOM 0 HD12 LEU B 706 25.510 -0.107 -2.375 1.00 1.00 H new ATOM 0 HD13 LEU B 706 24.301 1.173 -2.115 1.00 1.00 H new ATOM 0 HD21 LEU B 706 25.567 3.227 -4.027 1.00 1.00 H new ATOM 0 HD22 LEU B 706 24.950 3.582 -2.396 1.00 1.00 H new ATOM 0 HD23 LEU B 706 26.625 4.002 -2.824 1.00 1.00 H new ATOM 1046 N ILE B 707 28.598 2.095 1.437 1.00 1.00 N ATOM 1047 CA ILE B 707 28.817 2.304 2.865 1.00 1.00 C ATOM 1048 C ILE B 707 29.988 3.257 3.102 1.00 1.00 C ATOM 1049 O ILE B 707 29.934 4.107 3.990 1.00 1.00 O ATOM 1050 CB ILE B 707 29.032 0.969 3.601 1.00 1.00 C ATOM 1051 CG1 ILE B 707 29.064 1.218 5.111 1.00 1.00 C ATOM 1052 CG2 ILE B 707 30.335 0.314 3.159 1.00 1.00 C ATOM 1053 CD1 ILE B 707 28.983 -0.119 5.851 1.00 1.00 C ATOM 0 H ILE B 707 28.843 1.166 1.094 1.00 1.00 H new ATOM 0 HA ILE B 707 27.918 2.764 3.275 1.00 1.00 H new ATOM 0 HB ILE B 707 28.208 0.298 3.357 1.00 1.00 H new ATOM 0 HG12 ILE B 707 29.980 1.742 5.384 1.00 1.00 H new ATOM 0 HG13 ILE B 707 28.231 1.858 5.402 1.00 1.00 H new ATOM 0 HG21 ILE B 707 30.468 -0.628 3.691 1.00 1.00 H new ATOM 0 HG22 ILE B 707 30.301 0.123 2.086 1.00 1.00 H new ATOM 0 HG23 ILE B 707 31.170 0.978 3.383 1.00 1.00 H new ATOM 0 HD11 ILE B 707 29.006 0.058 6.926 1.00 1.00 H new ATOM 0 HD12 ILE B 707 28.055 -0.626 5.586 1.00 1.00 H new ATOM 0 HD13 ILE B 707 29.831 -0.743 5.568 1.00 1.00 H new ATOM 1065 N GLY B 708 31.050 3.114 2.306 1.00 1.00 N ATOM 1066 CA GLY B 708 32.219 3.977 2.460 1.00 1.00 C ATOM 1067 C GLY B 708 31.840 5.437 2.234 1.00 1.00 C ATOM 1068 O GLY B 708 32.252 6.323 2.985 1.00 1.00 O ATOM 0 H GLY B 708 31.124 2.421 1.561 1.00 1.00 H new ATOM 0 HA2 GLY B 708 32.639 3.855 3.458 1.00 1.00 H new ATOM 0 HA3 GLY B 708 32.992 3.682 1.750 1.00 1.00 H new ATOM 1072 N LEU B 709 31.037 5.678 1.206 1.00 1.00 N ATOM 1073 CA LEU B 709 30.583 7.028 0.895 1.00 1.00 C ATOM 1074 C LEU B 709 29.713 7.577 2.024 1.00 1.00 C ATOM 1075 O LEU B 709 29.809 8.751 2.381 1.00 1.00 O ATOM 1076 CB LEU B 709 29.799 7.024 -0.416 1.00 1.00 C ATOM 1077 CG LEU B 709 30.755 6.768 -1.587 1.00 1.00 C ATOM 1078 CD1 LEU B 709 29.947 6.515 -2.861 1.00 1.00 C ATOM 1079 CD2 LEU B 709 31.673 7.980 -1.802 1.00 1.00 C ATOM 0 H LEU B 709 30.687 4.958 0.574 1.00 1.00 H new ATOM 0 HA LEU B 709 31.456 7.672 0.788 1.00 1.00 H new ATOM 0 HB2 LEU B 709 29.028 6.254 -0.388 1.00 1.00 H new ATOM 0 HB3 LEU B 709 29.291 7.979 -0.550 1.00 1.00 H new ATOM 0 HG LEU B 709 31.366 5.895 -1.356 1.00 1.00 H new ATOM 0 HD11 LEU B 709 30.627 6.333 -3.693 1.00 1.00 H new ATOM 0 HD12 LEU B 709 29.307 5.645 -2.719 1.00 1.00 H new ATOM 0 HD13 LEU B 709 29.331 7.387 -3.080 1.00 1.00 H new ATOM 0 HD21 LEU B 709 32.346 7.783 -2.637 1.00 1.00 H new ATOM 0 HD22 LEU B 709 31.068 8.860 -2.023 1.00 1.00 H new ATOM 0 HD23 LEU B 709 32.257 8.159 -0.899 1.00 1.00 H new ATOM 1091 N ALA B 710 28.851 6.723 2.571 1.00 1.00 N ATOM 1092 CA ALA B 710 27.958 7.138 3.647 1.00 1.00 C ATOM 1093 C ALA B 710 28.758 7.585 4.866 1.00 1.00 C ATOM 1094 O ALA B 710 28.401 8.562 5.526 1.00 1.00 O ATOM 1095 CB ALA B 710 27.034 5.982 4.036 1.00 1.00 C ATOM 0 H ALA B 710 28.753 5.748 2.289 1.00 1.00 H new ATOM 0 HA ALA B 710 27.359 7.977 3.292 1.00 1.00 H new ATOM 0 HB1 ALA B 710 26.371 6.301 4.840 1.00 1.00 H new ATOM 0 HB2 ALA B 710 26.440 5.685 3.172 1.00 1.00 H new ATOM 0 HB3 ALA B 710 27.632 5.136 4.373 1.00 1.00 H new ATOM 1101 N ALA B 711 29.846 6.879 5.158 1.00 1.00 N ATOM 1102 CA ALA B 711 30.680 7.241 6.296 1.00 1.00 C ATOM 1103 C ALA B 711 31.289 8.621 6.066 1.00 1.00 C ATOM 1104 O ALA B 711 31.387 9.434 6.985 1.00 1.00 O ATOM 1105 CB ALA B 711 31.793 6.208 6.485 1.00 1.00 C ATOM 0 H ALA B 711 30.166 6.066 4.631 1.00 1.00 H new ATOM 0 HA ALA B 711 30.064 7.262 7.195 1.00 1.00 H new ATOM 0 HB1 ALA B 711 32.410 6.490 7.339 1.00 1.00 H new ATOM 0 HB2 ALA B 711 31.353 5.227 6.663 1.00 1.00 H new ATOM 0 HB3 ALA B 711 32.411 6.171 5.588 1.00 1.00 H new ATOM 1111 N LEU B 712 31.682 8.877 4.822 1.00 1.00 N ATOM 1112 CA LEU B 712 32.269 10.163 4.457 1.00 1.00 C ATOM 1113 C LEU B 712 31.256 11.285 4.661 1.00 1.00 C ATOM 1114 O LEU B 712 31.597 12.361 5.149 1.00 1.00 O ATOM 1115 CB LEU B 712 32.720 10.130 2.990 1.00 1.00 C ATOM 1116 CG LEU B 712 33.307 11.487 2.576 1.00 1.00 C ATOM 1117 CD1 LEU B 712 34.471 11.861 3.495 1.00 1.00 C ATOM 1118 CD2 LEU B 712 33.813 11.397 1.136 1.00 1.00 C ATOM 0 H LEU B 712 31.605 8.213 4.051 1.00 1.00 H new ATOM 0 HA LEU B 712 33.132 10.349 5.096 1.00 1.00 H new ATOM 0 HB2 LEU B 712 33.465 9.347 2.850 1.00 1.00 H new ATOM 0 HB3 LEU B 712 31.874 9.883 2.349 1.00 1.00 H new ATOM 0 HG LEU B 712 32.532 12.249 2.654 1.00 1.00 H new ATOM 0 HD11 LEU B 712 34.879 12.825 3.191 1.00 1.00 H new ATOM 0 HD12 LEU B 712 34.116 11.925 4.524 1.00 1.00 H new ATOM 0 HD13 LEU B 712 35.248 11.100 3.426 1.00 1.00 H new ATOM 0 HD21 LEU B 712 34.231 12.358 0.837 1.00 1.00 H new ATOM 0 HD22 LEU B 712 34.584 10.629 1.068 1.00 1.00 H new ATOM 0 HD23 LEU B 712 32.985 11.140 0.475 1.00 1.00 H new ATOM 1130 N LEU B 713 30.014 11.026 4.267 1.00 1.00 N ATOM 1131 CA LEU B 713 28.956 12.022 4.395 1.00 1.00 C ATOM 1132 C LEU B 713 28.726 12.384 5.859 1.00 1.00 C ATOM 1133 O LEU B 713 28.564 13.555 6.195 1.00 1.00 O ATOM 1134 CB LEU B 713 27.658 11.479 3.782 1.00 1.00 C ATOM 1135 CG LEU B 713 26.524 12.506 3.924 1.00 1.00 C ATOM 1136 CD1 LEU B 713 26.925 13.825 3.260 1.00 1.00 C ATOM 1137 CD2 LEU B 713 25.266 11.962 3.245 1.00 1.00 C ATOM 0 H LEU B 713 29.716 10.140 3.859 1.00 1.00 H new ATOM 0 HA LEU B 713 29.262 12.923 3.863 1.00 1.00 H new ATOM 0 HB2 LEU B 713 27.816 11.246 2.729 1.00 1.00 H new ATOM 0 HB3 LEU B 713 27.378 10.548 4.275 1.00 1.00 H new ATOM 0 HG LEU B 713 26.330 12.683 4.982 1.00 1.00 H new ATOM 0 HD11 LEU B 713 26.115 14.547 3.366 1.00 1.00 H new ATOM 0 HD12 LEU B 713 27.823 14.215 3.739 1.00 1.00 H new ATOM 0 HD13 LEU B 713 27.123 13.654 2.202 1.00 1.00 H new ATOM 0 HD21 LEU B 713 24.458 12.687 3.343 1.00 1.00 H new ATOM 0 HD22 LEU B 713 25.470 11.786 2.189 1.00 1.00 H new ATOM 0 HD23 LEU B 713 24.973 11.025 3.719 1.00 1.00 H new ATOM 1149 N ILE B 714 28.718 11.380 6.729 1.00 1.00 N ATOM 1150 CA ILE B 714 28.509 11.629 8.150 1.00 1.00 C ATOM 1151 C ILE B 714 29.649 12.478 8.704 1.00 1.00 C ATOM 1152 O ILE B 714 29.425 13.429 9.453 1.00 1.00 O ATOM 1153 CB ILE B 714 28.437 10.303 8.908 1.00 1.00 C ATOM 1154 CG1 ILE B 714 27.161 9.560 8.504 1.00 1.00 C ATOM 1155 CG2 ILE B 714 28.413 10.576 10.414 1.00 1.00 C ATOM 1156 CD1 ILE B 714 27.214 8.126 9.034 1.00 1.00 C ATOM 0 H ILE B 714 28.852 10.400 6.480 1.00 1.00 H new ATOM 0 HA ILE B 714 27.569 12.166 8.279 1.00 1.00 H new ATOM 0 HB ILE B 714 29.308 9.695 8.665 1.00 1.00 H new ATOM 0 HG12 ILE B 714 26.287 10.074 8.903 1.00 1.00 H new ATOM 0 HG13 ILE B 714 27.059 9.554 7.419 1.00 1.00 H new ATOM 0 HG21 ILE B 714 28.362 9.631 10.954 1.00 1.00 H new ATOM 0 HG22 ILE B 714 29.319 11.110 10.702 1.00 1.00 H new ATOM 0 HG23 ILE B 714 27.541 11.182 10.660 1.00 1.00 H new ATOM 0 HD11 ILE B 714 26.305 7.598 8.746 1.00 1.00 H new ATOM 0 HD12 ILE B 714 28.080 7.614 8.613 1.00 1.00 H new ATOM 0 HD13 ILE B 714 27.295 8.143 10.121 1.00 1.00 H new ATOM 1168 N TRP B 715 30.870 12.132 8.317 1.00 1.00 N ATOM 1169 CA TRP B 715 32.046 12.869 8.764 1.00 1.00 C ATOM 1170 C TRP B 715 31.951 14.316 8.271 1.00 1.00 C ATOM 1171 O TRP B 715 32.199 15.263 9.016 1.00 1.00 O ATOM 1172 CB TRP B 715 33.306 12.204 8.197 1.00 1.00 C ATOM 1173 CG TRP B 715 34.473 12.408 9.116 1.00 1.00 C ATOM 1174 CD1 TRP B 715 34.672 13.474 9.928 1.00 1.00 C ATOM 1175 CD2 TRP B 715 35.608 11.519 9.330 1.00 1.00 C ATOM 1176 NE1 TRP B 715 35.857 13.295 10.619 1.00 1.00 N ATOM 1177 CE2 TRP B 715 36.470 12.105 10.285 1.00 1.00 C ATOM 1178 CE3 TRP B 715 35.968 10.272 8.789 1.00 1.00 C ATOM 1179 CZ2 TRP B 715 37.648 11.478 10.691 1.00 1.00 C ATOM 1180 CZ3 TRP B 715 37.152 9.636 9.195 1.00 1.00 C ATOM 1181 CH2 TRP B 715 37.991 10.237 10.144 1.00 1.00 C ATOM 0 H TRP B 715 31.072 11.348 7.696 1.00 1.00 H new ATOM 0 HA TRP B 715 32.097 12.863 9.853 1.00 1.00 H new ATOM 0 HB2 TRP B 715 33.129 11.138 8.058 1.00 1.00 H new ATOM 0 HB3 TRP B 715 33.533 12.621 7.216 1.00 1.00 H new ATOM 0 HD1 TRP B 715 34.013 14.325 10.021 1.00 1.00 H new ATOM 0 HE1 TRP B 715 36.232 13.962 11.294 1.00 1.00 H new ATOM 0 HE3 TRP B 715 35.330 9.800 8.056 1.00 1.00 H new ATOM 0 HZ2 TRP B 715 38.290 11.947 11.422 1.00 1.00 H new ATOM 0 HZ3 TRP B 715 37.418 8.678 8.774 1.00 1.00 H new ATOM 0 HH2 TRP B 715 38.900 9.743 10.452 1.00 1.00 H new ATOM 1192 N LYS B 716 31.579 14.469 7.002 1.00 1.00 N ATOM 1193 CA LYS B 716 31.449 15.793 6.400 1.00 1.00 C ATOM 1194 C LYS B 716 30.370 16.592 7.134 1.00 1.00 C ATOM 1195 O LYS B 716 30.525 17.785 7.395 1.00 1.00 O ATOM 1196 CB LYS B 716 31.051 15.641 4.919 1.00 1.00 C ATOM 1197 CG LYS B 716 32.217 16.009 3.977 1.00 1.00 C ATOM 1198 CD LYS B 716 32.173 17.499 3.594 1.00 1.00 C ATOM 1199 CE LYS B 716 32.571 18.363 4.791 1.00 1.00 C ATOM 1200 NZ LYS B 716 32.789 19.767 4.343 1.00 1.00 N ATOM 0 H LYS B 716 31.363 13.696 6.373 1.00 1.00 H new ATOM 0 HA LYS B 716 32.401 16.319 6.475 1.00 1.00 H new ATOM 0 HB2 LYS B 716 30.739 14.614 4.729 1.00 1.00 H new ATOM 0 HB3 LYS B 716 30.194 16.279 4.705 1.00 1.00 H new ATOM 0 HG2 LYS B 716 33.166 15.784 4.463 1.00 1.00 H new ATOM 0 HG3 LYS B 716 32.167 15.397 3.076 1.00 1.00 H new ATOM 0 HD2 LYS B 716 32.848 17.688 2.759 1.00 1.00 H new ATOM 0 HD3 LYS B 716 31.171 17.767 3.260 1.00 1.00 H new ATOM 0 HE2 LYS B 716 31.791 18.330 5.552 1.00 1.00 H new ATOM 0 HE3 LYS B 716 33.479 17.971 5.249 1.00 1.00 H new ATOM 0 HZ1 LYS B 716 33.236 20.310 5.109 1.00 1.00 H new ATOM 0 HZ2 LYS B 716 33.408 19.773 3.508 1.00 1.00 H new ATOM 0 HZ3 LYS B 716 31.875 20.200 4.099 1.00 1.00 H new ATOM 1214 N LEU B 717 29.273 15.930 7.461 1.00 1.00 N ATOM 1215 CA LEU B 717 28.179 16.593 8.160 1.00 1.00 C ATOM 1216 C LEU B 717 28.614 17.071 9.548 1.00 1.00 C ATOM 1217 O LEU B 717 28.258 18.172 9.969 1.00 1.00 O ATOM 1218 CB LEU B 717 26.994 15.626 8.291 1.00 1.00 C ATOM 1219 CG LEU B 717 25.827 16.293 9.033 1.00 1.00 C ATOM 1220 CD1 LEU B 717 25.398 17.567 8.301 1.00 1.00 C ATOM 1221 CD2 LEU B 717 24.646 15.324 9.090 1.00 1.00 C ATOM 0 H LEU B 717 29.114 14.943 7.257 1.00 1.00 H new ATOM 0 HA LEU B 717 27.882 17.467 7.580 1.00 1.00 H new ATOM 0 HB2 LEU B 717 26.667 15.308 7.301 1.00 1.00 H new ATOM 0 HB3 LEU B 717 27.307 14.730 8.827 1.00 1.00 H new ATOM 0 HG LEU B 717 26.147 16.551 10.043 1.00 1.00 H new ATOM 0 HD11 LEU B 717 24.570 18.032 8.835 1.00 1.00 H new ATOM 0 HD12 LEU B 717 26.237 18.261 8.257 1.00 1.00 H new ATOM 0 HD13 LEU B 717 25.081 17.316 7.289 1.00 1.00 H new ATOM 0 HD21 LEU B 717 23.815 15.794 9.616 1.00 1.00 H new ATOM 0 HD22 LEU B 717 24.336 15.068 8.077 1.00 1.00 H new ATOM 0 HD23 LEU B 717 24.944 14.418 9.618 1.00 1.00 H new ATOM 1233 N LEU B 718 29.355 16.227 10.264 1.00 1.00 N ATOM 1234 CA LEU B 718 29.796 16.565 11.620 1.00 1.00 C ATOM 1235 C LEU B 718 30.719 17.788 11.646 1.00 1.00 C ATOM 1236 O LEU B 718 30.552 18.674 12.487 1.00 1.00 O ATOM 1237 CB LEU B 718 30.521 15.357 12.232 1.00 1.00 C ATOM 1238 CG LEU B 718 31.009 15.673 13.653 1.00 1.00 C ATOM 1239 CD1 LEU B 718 29.828 16.084 14.536 1.00 1.00 C ATOM 1240 CD2 LEU B 718 31.664 14.423 14.244 1.00 1.00 C ATOM 0 H LEU B 718 29.661 15.312 9.934 1.00 1.00 H new ATOM 0 HA LEU B 718 28.910 16.816 12.204 1.00 1.00 H new ATOM 0 HB2 LEU B 718 29.849 14.499 12.256 1.00 1.00 H new ATOM 0 HB3 LEU B 718 31.369 15.081 11.605 1.00 1.00 H new ATOM 0 HG LEU B 718 31.727 16.492 13.612 1.00 1.00 H new ATOM 0 HD11 LEU B 718 30.185 16.306 15.542 1.00 1.00 H new ATOM 0 HD12 LEU B 718 29.351 16.970 14.117 1.00 1.00 H new ATOM 0 HD13 LEU B 718 29.105 15.269 14.579 1.00 1.00 H new ATOM 0 HD21 LEU B 718 32.014 14.638 15.254 1.00 1.00 H new ATOM 0 HD22 LEU B 718 30.936 13.612 14.277 1.00 1.00 H new ATOM 0 HD23 LEU B 718 32.509 14.127 13.623 1.00 1.00 H new ATOM 1252 N ILE B 719 31.688 17.839 10.733 1.00 1.00 N ATOM 1253 CA ILE B 719 32.616 18.971 10.692 1.00 1.00 C ATOM 1254 C ILE B 719 31.904 20.242 10.233 1.00 1.00 C ATOM 1255 O ILE B 719 32.171 21.334 10.735 1.00 1.00 O ATOM 1256 CB ILE B 719 33.823 18.664 9.794 1.00 1.00 C ATOM 1257 CG1 ILE B 719 34.870 19.776 9.939 1.00 1.00 C ATOM 1258 CG2 ILE B 719 33.389 18.556 8.335 1.00 1.00 C ATOM 1259 CD1 ILE B 719 36.181 19.341 9.274 1.00 1.00 C ATOM 0 H ILE B 719 31.851 17.125 10.023 1.00 1.00 H new ATOM 0 HA ILE B 719 32.986 19.137 11.704 1.00 1.00 H new ATOM 0 HB ILE B 719 34.256 17.712 10.102 1.00 1.00 H new ATOM 0 HG12 ILE B 719 34.505 20.695 9.479 1.00 1.00 H new ATOM 0 HG13 ILE B 719 35.040 19.993 10.993 1.00 1.00 H new ATOM 0 HG21 ILE B 719 34.257 18.338 7.712 1.00 1.00 H new ATOM 0 HG22 ILE B 719 32.658 17.754 8.231 1.00 1.00 H new ATOM 0 HG23 ILE B 719 32.942 19.498 8.018 1.00 1.00 H new ATOM 0 HD11 ILE B 719 36.922 20.133 9.379 1.00 1.00 H new ATOM 0 HD12 ILE B 719 36.549 18.434 9.754 1.00 1.00 H new ATOM 0 HD13 ILE B 719 36.005 19.146 8.216 1.00 1.00 H new ATOM 1271 N THR B 720 30.998 20.094 9.273 1.00 1.00 N ATOM 1272 CA THR B 720 30.259 21.243 8.753 1.00 1.00 C ATOM 1273 C THR B 720 29.436 21.895 9.865 1.00 1.00 C ATOM 1274 O THR B 720 29.413 23.120 9.993 1.00 1.00 O ATOM 1275 CB THR B 720 29.331 20.804 7.622 1.00 1.00 C ATOM 1276 OG1 THR B 720 30.104 20.269 6.556 1.00 1.00 O ATOM 1277 CG2 THR B 720 28.529 22.005 7.124 1.00 1.00 C ATOM 0 H THR B 720 30.758 19.201 8.842 1.00 1.00 H new ATOM 0 HA THR B 720 30.976 21.968 8.369 1.00 1.00 H new ATOM 0 HB THR B 720 28.645 20.041 7.989 1.00 1.00 H new ATOM 0 HG1 THR B 720 30.208 19.302 6.680 1.00 1.00 H new ATOM 0 HG21 THR B 720 27.867 21.691 6.317 1.00 1.00 H new ATOM 0 HG22 THR B 720 27.935 22.411 7.943 1.00 1.00 H new ATOM 0 HG23 THR B 720 29.212 22.771 6.756 1.00 1.00 H new ATOM 1285 N ILE B 721 28.761 21.075 10.665 1.00 1.00 N ATOM 1286 CA ILE B 721 27.948 21.596 11.760 1.00 1.00 C ATOM 1287 C ILE B 721 28.827 22.316 12.782 1.00 1.00 C ATOM 1288 O ILE B 721 28.477 23.395 13.270 1.00 1.00 O ATOM 1289 CB ILE B 721 27.183 20.453 12.442 1.00 1.00 C ATOM 1290 CG1 ILE B 721 26.125 19.902 11.478 1.00 1.00 C ATOM 1291 CG2 ILE B 721 26.488 20.984 13.696 1.00 1.00 C ATOM 1292 CD1 ILE B 721 25.551 18.590 12.020 1.00 1.00 C ATOM 0 H ILE B 721 28.760 20.059 10.578 1.00 1.00 H new ATOM 0 HA ILE B 721 27.232 22.308 11.350 1.00 1.00 H new ATOM 0 HB ILE B 721 27.881 19.662 12.715 1.00 1.00 H new ATOM 0 HG12 ILE B 721 25.325 20.631 11.348 1.00 1.00 H new ATOM 0 HG13 ILE B 721 26.568 19.736 10.496 1.00 1.00 H new ATOM 0 HG21 ILE B 721 25.944 20.174 14.181 1.00 1.00 H new ATOM 0 HG22 ILE B 721 27.233 21.384 14.383 1.00 1.00 H new ATOM 0 HG23 ILE B 721 25.790 21.774 13.418 1.00 1.00 H new ATOM 0 HD11 ILE B 721 24.801 18.208 11.328 1.00 1.00 H new ATOM 0 HD12 ILE B 721 26.352 17.859 12.127 1.00 1.00 H new ATOM 0 HD13 ILE B 721 25.091 18.768 12.992 1.00 1.00 H new ATOM 1304 N HIS B 722 29.960 21.710 13.111 1.00 1.00 N ATOM 1305 CA HIS B 722 30.869 22.300 14.082 1.00 1.00 C ATOM 1306 C HIS B 722 31.425 23.630 13.565 1.00 1.00 C ATOM 1307 O HIS B 722 31.581 24.589 14.326 1.00 1.00 O ATOM 1308 CB HIS B 722 32.028 21.345 14.354 1.00 1.00 C ATOM 1309 CG HIS B 722 31.685 20.463 15.522 1.00 1.00 C ATOM 1310 ND1 HIS B 722 30.934 19.307 15.375 1.00 1.00 N ATOM 1311 CD2 HIS B 722 31.982 20.548 16.860 1.00 1.00 C ATOM 1312 CE1 HIS B 722 30.805 18.747 16.591 1.00 1.00 C ATOM 1313 NE2 HIS B 722 31.426 19.462 17.533 1.00 1.00 N ATOM 0 H HIS B 722 30.269 20.818 12.724 1.00 1.00 H new ATOM 0 HA HIS B 722 30.315 22.481 15.003 1.00 1.00 H new ATOM 0 HB2 HIS B 722 32.228 20.737 13.471 1.00 1.00 H new ATOM 0 HB3 HIS B 722 32.937 21.909 14.565 1.00 1.00 H new ATOM 0 HD1 HIS B 722 30.549 18.946 14.502 1.00 1.00 H new ATOM 0 HD2 HIS B 722 32.559 21.337 17.321 1.00 1.00 H new ATOM 0 HE1 HIS B 722 30.265 17.831 16.782 1.00 1.00 H new ATOM 1321 N ASP B 723 31.719 23.686 12.271 1.00 1.00 N ATOM 1322 CA ASP B 723 32.248 24.914 11.681 1.00 1.00 C ATOM 1323 C ASP B 723 31.195 26.021 11.749 1.00 1.00 C ATOM 1324 O ASP B 723 31.501 27.184 12.041 1.00 1.00 O ATOM 1325 CB ASP B 723 32.626 24.662 10.224 1.00 1.00 C ATOM 1326 CG ASP B 723 34.035 24.083 10.136 1.00 1.00 C ATOM 1327 OD1 ASP B 723 34.689 23.980 11.162 1.00 1.00 O ATOM 1328 OD2 ASP B 723 34.433 23.729 9.041 1.00 1.00 O ATOM 0 H ASP B 723 31.603 22.911 11.618 1.00 1.00 H new ATOM 0 HA ASP B 723 33.132 25.224 12.239 1.00 1.00 H new ATOM 0 HB2 ASP B 723 31.913 23.973 9.770 1.00 1.00 H new ATOM 0 HB3 ASP B 723 32.572 25.594 9.661 1.00 1.00 H new