USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1007 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1876 ASN : amide:sc= 0.962 K(o=1.8,f=-2.8) USER MOD Set 1.2: A1947 LYS NZ :NH3+ 174:sc= 0.886 (180deg=-0.447) USER MOD Set 2.1: A1874 LYS NZ :NH3+ 153:sc= 1.19 (180deg=1.04) USER MOD Set 2.2: A1877 THR OG1 : rot 78:sc= 0.597 USER MOD Set 2.3: A1878 SER OG : rot -174:sc= 0.566 USER MOD Set 3.1: A1867 THR OG1 : rot 74:sc= 2.08 USER MOD Set 3.2: A1888 GLN : amide:sc= 0.989 K(o=3.1,f=1.1) USER MOD Set 4.1: A1833 GLN : amide:sc= -0.733 K(o=-0.5,f=-1.8!) USER MOD Set 4.2: A1837 GLN : amide:sc= 0.231 K(o=-0.5,f=-2) USER MOD Single : A1830 SER OG : rot 180:sc= 0 USER MOD Single : A1832 THR OG1 : rot 74:sc= 1.03 USER MOD Single : A1836 ASN : amide:sc= 0.818 K(o=0.82,f=0) USER MOD Single : A1853 TYR OH : rot 180:sc= 0 USER MOD Single : A1854 GLN : amide:sc= -0.458 K(o=-0.46,f=-1.9) USER MOD Single : A1855 THR OG1 : rot 169:sc= 0.549 USER MOD Single : A1856 THR OG1 : rot 70:sc= 1.22 USER MOD Single : A1857 MET CE :methyl 171:sc= -0.929 (180deg=-1.24) USER MOD Single : A1860 THR OG1 : rot 77:sc= 0.0364 USER MOD Single : A1862 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1869 GLN :FLIP amide:sc= -0.0835 F(o=-0.82!,f=-0.083) USER MOD Single : A1871 MET CE :methyl -161:sc= -1.51 (180deg=-2.18!) USER MOD Single : A1873 THR OG1 : rot 96:sc= 0.941 USER MOD Single : A1875 SER OG : rot 72:sc= 1.11 USER MOD Single : A1887 ASN : amide:sc=-0.00159 X(o=-0.0016,f=-0.4) USER MOD Single : A1890 THR OG1 : rot 66:sc= 1.28 USER MOD Single : A1891 SER OG : rot 180:sc= -0.476 USER MOD Single : A1893 TYR OH : rot 13:sc= 0.824 USER MOD Single : A1898 SER OG : rot 71:sc= 1.28 USER MOD Single : A1899 GLN : amide:sc= -1.36 X(o=-1.4,f=-1.4) USER MOD Single : A1901 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1909 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A1915 HIS : no HD1:sc= -1.47 K(o=-1.5,f=-2.6!) USER MOD Single : A1917 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1918 HIS : no HD1:sc= 0 X(o=0,f=-0.0099) USER MOD Single : A1921 GLN :FLIP amide:sc= -1.46 F(o=-3.3!,f=-1.5) USER MOD Single : A1925 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1927 CYS SG : rot 172:sc= -4.04! USER MOD Single : A1928 SER OG : rot 180:sc= -0.633 USER MOD Single : A1932 THR OG1 : rot 180:sc= 0 USER MOD Single : A1933 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1938 GLN : amide:sc= -0.78 X(o=-0.78,f=-1.1!) USER MOD Single : A1939 CYS SG : rot 180:sc= 0 USER MOD Single : A1940 SER OG : rot 180:sc= -0.0041 USER MOD Single : A1942 SER OG : rot -29:sc= 0.371 USER MOD Single : A1945 TYR OH : rot 180:sc= 0 USER MOD Single : A1946 THR OG1 : rot 70:sc= 1.31 USER MOD Single : A1948 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1953 CYS SG : rot 72:sc= 1.92 USER MOD Single : A1958 SER OG : rot 180:sc= 0 USER MOD Single : A1960 LYS NZ :NH3+ 164:sc= 1.24 (180deg=1.04) USER MOD Single : A1962 SER OG : rot 180:sc= 0 USER MOD Single : A1963 HIS : no HE2:sc= 0.372 K(o=0.37,f=-3.1!) USER MOD Single : A1969 GLN : amide:sc= -0.899 X(o=-0.9,f=-0.41) USER MOD ----------------------------------------------------------------- ATOM 239 N VAL A1828 6.471 5.403 5.555 1.00 0.67 N ATOM 240 CA VAL A1828 5.907 4.399 6.451 1.00 0.65 C ATOM 241 C VAL A1828 4.995 5.042 7.502 1.00 0.57 C ATOM 242 O VAL A1828 4.002 4.448 7.934 1.00 0.57 O ATOM 243 CB VAL A1828 7.024 3.570 7.134 1.00 0.71 C ATOM 244 CG1 VAL A1828 7.858 4.423 8.077 1.00 0.71 C ATOM 245 CG2 VAL A1828 6.438 2.376 7.864 1.00 0.74 C ATOM 0 HA VAL A1828 5.302 3.723 5.846 1.00 0.65 H new ATOM 0 HB VAL A1828 7.687 3.203 6.350 1.00 0.71 H new ATOM 0 HG11 VAL A1828 8.631 3.807 8.537 1.00 0.71 H new ATOM 0 HG12 VAL A1828 8.325 5.233 7.518 1.00 0.71 H new ATOM 0 HG13 VAL A1828 7.217 4.841 8.853 1.00 0.71 H new ATOM 0 HG21 VAL A1828 7.240 1.808 8.336 1.00 0.74 H new ATOM 0 HG22 VAL A1828 5.741 2.722 8.627 1.00 0.74 H new ATOM 0 HG23 VAL A1828 5.911 1.738 7.154 1.00 0.74 H new ATOM 255 N ASP A1829 5.320 6.272 7.885 1.00 0.56 N ATOM 256 CA ASP A1829 4.500 7.024 8.825 1.00 0.57 C ATOM 257 C ASP A1829 3.157 7.372 8.195 1.00 0.51 C ATOM 258 O ASP A1829 2.102 7.223 8.815 1.00 0.52 O ATOM 259 CB ASP A1829 5.220 8.302 9.252 1.00 0.69 C ATOM 260 CG ASP A1829 4.369 9.177 10.149 1.00 0.78 C ATOM 261 OD1 ASP A1829 4.159 8.810 11.324 1.00 0.85 O ATOM 262 OD2 ASP A1829 3.918 10.247 9.687 1.00 0.87 O ATOM 0 H ASP A1829 6.148 6.770 7.557 1.00 0.56 H new ATOM 0 HA ASP A1829 4.327 6.404 9.705 1.00 0.57 H new ATOM 0 HB2 ASP A1829 6.140 8.039 9.774 1.00 0.69 H new ATOM 0 HB3 ASP A1829 5.507 8.867 8.365 1.00 0.69 H new ATOM 267 N SER A1830 3.210 7.820 6.951 1.00 0.48 N ATOM 268 CA SER A1830 2.011 8.176 6.207 1.00 0.45 C ATOM 269 C SER A1830 1.126 6.949 5.970 1.00 0.38 C ATOM 270 O SER A1830 -0.100 7.032 6.052 1.00 0.40 O ATOM 271 CB SER A1830 2.408 8.819 4.879 1.00 0.46 C ATOM 272 OG SER A1830 3.343 9.866 5.090 1.00 0.97 O ATOM 0 H SER A1830 4.078 7.947 6.431 1.00 0.48 H new ATOM 0 HA SER A1830 1.433 8.890 6.793 1.00 0.45 H new ATOM 0 HB2 SER A1830 2.840 8.066 4.219 1.00 0.46 H new ATOM 0 HB3 SER A1830 1.522 9.211 4.379 1.00 0.46 H new ATOM 0 HG SER A1830 3.587 10.265 4.229 1.00 0.97 H new ATOM 278 N ILE A1831 1.760 5.808 5.695 1.00 0.32 N ATOM 279 CA ILE A1831 1.041 4.548 5.504 1.00 0.28 C ATOM 280 C ILE A1831 0.261 4.178 6.764 1.00 0.31 C ATOM 281 O ILE A1831 -0.907 3.794 6.700 1.00 0.30 O ATOM 282 CB ILE A1831 2.013 3.396 5.154 1.00 0.27 C ATOM 283 CG1 ILE A1831 2.750 3.700 3.848 1.00 0.27 C ATOM 284 CG2 ILE A1831 1.269 2.069 5.049 1.00 0.28 C ATOM 285 CD1 ILE A1831 3.790 2.664 3.490 1.00 0.30 C ATOM 0 H ILE A1831 2.773 5.731 5.599 1.00 0.32 H new ATOM 0 HA ILE A1831 0.348 4.691 4.674 1.00 0.28 H new ATOM 0 HB ILE A1831 2.745 3.312 5.957 1.00 0.27 H new ATOM 0 HG12 ILE A1831 2.024 3.770 3.038 1.00 0.27 H new ATOM 0 HG13 ILE A1831 3.232 4.674 3.930 1.00 0.27 H new ATOM 0 HG21 ILE A1831 1.974 1.275 4.802 1.00 0.28 H new ATOM 0 HG22 ILE A1831 0.789 1.845 6.002 1.00 0.28 H new ATOM 0 HG23 ILE A1831 0.512 2.137 4.268 1.00 0.28 H new ATOM 0 HD11 ILE A1831 4.273 2.942 2.553 1.00 0.30 H new ATOM 0 HD12 ILE A1831 4.537 2.610 4.282 1.00 0.30 H new ATOM 0 HD13 ILE A1831 3.311 1.692 3.376 1.00 0.30 H new ATOM 297 N THR A1832 0.912 4.321 7.909 1.00 0.36 N ATOM 298 CA THR A1832 0.303 3.982 9.186 1.00 0.41 C ATOM 299 C THR A1832 -0.892 4.894 9.489 1.00 0.39 C ATOM 300 O THR A1832 -1.879 4.466 10.097 1.00 0.39 O ATOM 301 CB THR A1832 1.342 4.069 10.319 1.00 0.52 C ATOM 302 OG1 THR A1832 2.484 3.265 9.983 1.00 0.57 O ATOM 303 CG2 THR A1832 0.755 3.588 11.639 1.00 0.61 C ATOM 0 H THR A1832 1.867 4.672 7.979 1.00 0.36 H new ATOM 0 HA THR A1832 -0.061 2.957 9.121 1.00 0.41 H new ATOM 0 HB THR A1832 1.639 5.112 10.434 1.00 0.52 H new ATOM 0 HG1 THR A1832 3.009 3.716 9.289 1.00 0.57 H new ATOM 0 HG21 THR A1832 1.511 3.660 12.421 1.00 0.61 H new ATOM 0 HG22 THR A1832 -0.102 4.208 11.904 1.00 0.61 H new ATOM 0 HG23 THR A1832 0.435 2.551 11.539 1.00 0.61 H new ATOM 311 N GLN A1833 -0.814 6.143 9.043 1.00 0.40 N ATOM 312 CA GLN A1833 -1.917 7.083 9.213 1.00 0.43 C ATOM 313 C GLN A1833 -3.124 6.616 8.401 1.00 0.35 C ATOM 314 O GLN A1833 -4.266 6.696 8.860 1.00 0.36 O ATOM 315 CB GLN A1833 -1.479 8.497 8.791 1.00 0.53 C ATOM 316 CG GLN A1833 -2.529 9.580 9.025 1.00 0.98 C ATOM 317 CD GLN A1833 -3.559 9.668 7.913 1.00 1.72 C ATOM 318 OE1 GLN A1833 -3.261 9.400 6.747 1.00 2.49 O ATOM 319 NE2 GLN A1833 -4.781 10.033 8.267 1.00 2.33 N ATOM 0 H GLN A1833 -0.001 6.528 8.562 1.00 0.40 H new ATOM 0 HA GLN A1833 -2.203 7.119 10.264 1.00 0.43 H new ATOM 0 HB2 GLN A1833 -0.574 8.762 9.338 1.00 0.53 H new ATOM 0 HB3 GLN A1833 -1.219 8.483 7.732 1.00 0.53 H new ATOM 0 HG2 GLN A1833 -3.039 9.384 9.968 1.00 0.98 H new ATOM 0 HG3 GLN A1833 -2.030 10.544 9.126 1.00 0.98 H new ATOM 0 HE21 GLN A1833 -4.987 10.246 9.243 1.00 2.33 H new ATOM 0 HE22 GLN A1833 -5.517 10.101 7.564 1.00 2.33 H new ATOM 328 N ALA A1834 -2.854 6.098 7.208 1.00 0.30 N ATOM 329 CA ALA A1834 -3.901 5.612 6.318 1.00 0.29 C ATOM 330 C ALA A1834 -4.666 4.450 6.948 1.00 0.28 C ATOM 331 O ALA A1834 -5.867 4.287 6.724 1.00 0.34 O ATOM 332 CB ALA A1834 -3.298 5.196 4.986 1.00 0.31 C ATOM 0 H ALA A1834 -1.910 6.004 6.833 1.00 0.30 H new ATOM 0 HA ALA A1834 -4.610 6.422 6.148 1.00 0.29 H new ATOM 0 HB1 ALA A1834 -4.087 4.834 4.327 1.00 0.31 H new ATOM 0 HB2 ALA A1834 -2.805 6.053 4.526 1.00 0.31 H new ATOM 0 HB3 ALA A1834 -2.569 4.402 5.149 1.00 0.31 H new ATOM 338 N ILE A1835 -3.967 3.651 7.744 1.00 0.27 N ATOM 339 CA ILE A1835 -4.597 2.546 8.452 1.00 0.30 C ATOM 340 C ILE A1835 -5.608 3.072 9.462 1.00 0.33 C ATOM 341 O ILE A1835 -6.772 2.667 9.465 1.00 0.40 O ATOM 342 CB ILE A1835 -3.560 1.678 9.199 1.00 0.34 C ATOM 343 CG1 ILE A1835 -2.495 1.164 8.235 1.00 0.38 C ATOM 344 CG2 ILE A1835 -4.241 0.510 9.904 1.00 0.36 C ATOM 345 CD1 ILE A1835 -1.490 0.248 8.894 1.00 0.49 C ATOM 0 H ILE A1835 -2.966 3.748 7.915 1.00 0.27 H new ATOM 0 HA ILE A1835 -5.096 1.931 7.703 1.00 0.30 H new ATOM 0 HB ILE A1835 -3.076 2.301 9.951 1.00 0.34 H new ATOM 0 HG12 ILE A1835 -2.981 0.632 7.417 1.00 0.38 H new ATOM 0 HG13 ILE A1835 -1.971 2.013 7.796 1.00 0.38 H new ATOM 0 HG21 ILE A1835 -3.492 -0.088 10.424 1.00 0.36 H new ATOM 0 HG22 ILE A1835 -4.964 0.892 10.625 1.00 0.36 H new ATOM 0 HG23 ILE A1835 -4.754 -0.110 9.169 1.00 0.36 H new ATOM 0 HD11 ILE A1835 -0.760 -0.083 8.155 1.00 0.49 H new ATOM 0 HD12 ILE A1835 -0.979 0.784 9.694 1.00 0.49 H new ATOM 0 HD13 ILE A1835 -2.005 -0.619 9.309 1.00 0.49 H new ATOM 357 N ASN A1836 -5.161 4.005 10.288 1.00 0.36 N ATOM 358 CA ASN A1836 -5.962 4.505 11.399 1.00 0.42 C ATOM 359 C ASN A1836 -7.200 5.262 10.925 1.00 0.44 C ATOM 360 O ASN A1836 -8.229 5.252 11.601 1.00 0.53 O ATOM 361 CB ASN A1836 -5.114 5.401 12.311 1.00 0.48 C ATOM 362 CG ASN A1836 -4.168 4.609 13.201 1.00 0.52 C ATOM 363 OD1 ASN A1836 -4.526 4.223 14.313 1.00 0.72 O ATOM 364 ND2 ASN A1836 -2.955 4.364 12.725 1.00 0.61 N ATOM 0 H ASN A1836 -4.240 4.436 10.210 1.00 0.36 H new ATOM 0 HA ASN A1836 -6.305 3.637 11.962 1.00 0.42 H new ATOM 0 HB2 ASN A1836 -4.536 6.092 11.698 1.00 0.48 H new ATOM 0 HB3 ASN A1836 -5.773 6.004 12.935 1.00 0.48 H new ATOM 0 HD21 ASN A1836 -2.283 3.840 13.286 1.00 0.61 H new ATOM 0 HD22 ASN A1836 -2.693 4.700 11.798 1.00 0.61 H new ATOM 371 N GLN A1837 -7.117 5.902 9.761 1.00 0.44 N ATOM 372 CA GLN A1837 -8.241 6.689 9.259 1.00 0.50 C ATOM 373 C GLN A1837 -9.382 5.782 8.789 1.00 0.50 C ATOM 374 O GLN A1837 -10.554 6.122 8.932 1.00 0.60 O ATOM 375 CB GLN A1837 -7.801 7.633 8.128 1.00 0.54 C ATOM 376 CG GLN A1837 -7.488 6.940 6.811 1.00 0.49 C ATOM 377 CD GLN A1837 -7.112 7.910 5.708 1.00 0.58 C ATOM 378 OE1 GLN A1837 -6.530 8.967 5.957 1.00 1.00 O ATOM 379 NE2 GLN A1837 -7.453 7.567 4.476 1.00 0.67 N ATOM 0 H GLN A1837 -6.296 5.892 9.155 1.00 0.44 H new ATOM 0 HA GLN A1837 -8.608 7.299 10.084 1.00 0.50 H new ATOM 0 HB2 GLN A1837 -8.588 8.368 7.959 1.00 0.54 H new ATOM 0 HB3 GLN A1837 -6.917 8.182 8.454 1.00 0.54 H new ATOM 0 HG2 GLN A1837 -6.670 6.235 6.962 1.00 0.49 H new ATOM 0 HG3 GLN A1837 -8.355 6.359 6.497 1.00 0.49 H new ATOM 0 HE21 GLN A1837 -7.934 6.684 4.307 1.00 0.67 H new ATOM 0 HE22 GLN A1837 -7.235 8.186 3.695 1.00 0.67 H new ATOM 388 N LEU A1838 -9.035 4.627 8.229 1.00 0.44 N ATOM 389 CA LEU A1838 -10.038 3.673 7.768 1.00 0.48 C ATOM 390 C LEU A1838 -10.590 2.856 8.924 1.00 0.64 C ATOM 391 O LEU A1838 -11.770 2.501 8.940 1.00 0.79 O ATOM 392 CB LEU A1838 -9.451 2.736 6.719 1.00 0.41 C ATOM 393 CG LEU A1838 -9.128 3.387 5.380 1.00 0.40 C ATOM 394 CD1 LEU A1838 -8.526 2.362 4.437 1.00 0.50 C ATOM 395 CD2 LEU A1838 -10.382 4.005 4.776 1.00 0.53 C ATOM 0 H LEU A1838 -8.070 4.330 8.084 1.00 0.44 H new ATOM 0 HA LEU A1838 -10.852 4.245 7.322 1.00 0.48 H new ATOM 0 HB2 LEU A1838 -8.539 2.293 7.119 1.00 0.41 H new ATOM 0 HB3 LEU A1838 -10.154 1.920 6.549 1.00 0.41 H new ATOM 0 HG LEU A1838 -8.399 4.182 5.539 1.00 0.40 H new ATOM 0 HD11 LEU A1838 -8.298 2.836 3.482 1.00 0.50 H new ATOM 0 HD12 LEU A1838 -7.610 1.962 4.871 1.00 0.50 H new ATOM 0 HD13 LEU A1838 -9.237 1.551 4.279 1.00 0.50 H new ATOM 0 HD21 LEU A1838 -10.136 4.466 3.820 1.00 0.53 H new ATOM 0 HD22 LEU A1838 -11.132 3.229 4.622 1.00 0.53 H new ATOM 0 HD23 LEU A1838 -10.777 4.762 5.453 1.00 0.53 H new ATOM 538 N PHE A1850 -20.403 4.750 -5.583 1.00 0.67 N ATOM 539 CA PHE A1850 -19.662 3.532 -5.281 1.00 0.57 C ATOM 540 C PHE A1850 -18.871 3.080 -6.502 1.00 0.52 C ATOM 541 O PHE A1850 -17.678 2.804 -6.407 1.00 0.50 O ATOM 542 CB PHE A1850 -20.610 2.420 -4.820 1.00 0.60 C ATOM 543 CG PHE A1850 -19.923 1.104 -4.575 1.00 0.57 C ATOM 544 CD1 PHE A1850 -19.138 0.916 -3.448 1.00 0.60 C ATOM 545 CD2 PHE A1850 -20.066 0.054 -5.469 1.00 0.63 C ATOM 546 CE1 PHE A1850 -18.507 -0.292 -3.218 1.00 0.65 C ATOM 547 CE2 PHE A1850 -19.438 -1.156 -5.243 1.00 0.68 C ATOM 548 CZ PHE A1850 -18.652 -1.328 -4.125 1.00 0.68 C ATOM 0 HA PHE A1850 -18.966 3.746 -4.470 1.00 0.57 H new ATOM 0 HB2 PHE A1850 -21.108 2.736 -3.904 1.00 0.60 H new ATOM 0 HB3 PHE A1850 -21.386 2.280 -5.573 1.00 0.60 H new ATOM 0 HD1 PHE A1850 -19.018 1.723 -2.741 1.00 0.60 H new ATOM 0 HD2 PHE A1850 -20.675 0.183 -6.352 1.00 0.63 H new ATOM 0 HE1 PHE A1850 -17.903 -0.427 -2.333 1.00 0.65 H new ATOM 0 HE2 PHE A1850 -19.564 -1.968 -5.944 1.00 0.68 H new ATOM 0 HZ PHE A1850 -18.150 -2.269 -3.956 1.00 0.68 H new ATOM 558 N VAL A1851 -19.539 3.035 -7.651 1.00 0.57 N ATOM 559 CA VAL A1851 -18.896 2.636 -8.898 1.00 0.60 C ATOM 560 C VAL A1851 -17.771 3.605 -9.274 1.00 0.56 C ATOM 561 O VAL A1851 -16.728 3.188 -9.779 1.00 0.55 O ATOM 562 CB VAL A1851 -19.920 2.535 -10.057 1.00 0.71 C ATOM 563 CG1 VAL A1851 -20.682 3.839 -10.238 1.00 0.76 C ATOM 564 CG2 VAL A1851 -19.231 2.141 -11.353 1.00 0.79 C ATOM 0 H VAL A1851 -20.527 3.270 -7.744 1.00 0.57 H new ATOM 0 HA VAL A1851 -18.465 1.648 -8.735 1.00 0.60 H new ATOM 0 HB VAL A1851 -20.638 1.758 -9.795 1.00 0.71 H new ATOM 0 HG11 VAL A1851 -21.392 3.735 -11.059 1.00 0.76 H new ATOM 0 HG12 VAL A1851 -21.220 4.076 -9.320 1.00 0.76 H new ATOM 0 HG13 VAL A1851 -19.981 4.642 -10.465 1.00 0.76 H new ATOM 0 HG21 VAL A1851 -19.969 2.076 -12.152 1.00 0.79 H new ATOM 0 HG22 VAL A1851 -18.483 2.891 -11.610 1.00 0.79 H new ATOM 0 HG23 VAL A1851 -18.746 1.173 -11.228 1.00 0.79 H new ATOM 574 N ASP A1852 -17.973 4.890 -8.996 1.00 0.57 N ATOM 575 CA ASP A1852 -16.987 5.914 -9.333 1.00 0.58 C ATOM 576 C ASP A1852 -15.695 5.684 -8.554 1.00 0.50 C ATOM 577 O ASP A1852 -14.601 5.684 -9.122 1.00 0.52 O ATOM 578 CB ASP A1852 -17.541 7.310 -9.035 1.00 0.67 C ATOM 579 CG ASP A1852 -16.642 8.418 -9.548 1.00 1.10 C ATOM 580 OD1 ASP A1852 -15.629 8.719 -8.879 1.00 1.71 O ATOM 581 OD2 ASP A1852 -16.932 8.980 -10.619 1.00 1.16 O ATOM 0 H ASP A1852 -18.811 5.248 -8.538 1.00 0.57 H new ATOM 0 HA ASP A1852 -16.770 5.846 -10.399 1.00 0.58 H new ATOM 0 HB2 ASP A1852 -18.528 7.409 -9.488 1.00 0.67 H new ATOM 0 HB3 ASP A1852 -17.671 7.423 -7.959 1.00 0.67 H new ATOM 586 N TYR A1853 -15.830 5.473 -7.253 1.00 0.43 N ATOM 587 CA TYR A1853 -14.681 5.171 -6.412 1.00 0.38 C ATOM 588 C TYR A1853 -14.106 3.806 -6.757 1.00 0.33 C ATOM 589 O TYR A1853 -12.892 3.641 -6.846 1.00 0.33 O ATOM 590 CB TYR A1853 -15.060 5.218 -4.933 1.00 0.40 C ATOM 591 CG TYR A1853 -15.185 6.619 -4.393 1.00 0.53 C ATOM 592 CD1 TYR A1853 -14.052 7.352 -4.072 1.00 0.66 C ATOM 593 CD2 TYR A1853 -16.425 7.213 -4.211 1.00 0.67 C ATOM 594 CE1 TYR A1853 -14.149 8.636 -3.585 1.00 0.83 C ATOM 595 CE2 TYR A1853 -16.531 8.498 -3.722 1.00 0.83 C ATOM 596 CZ TYR A1853 -15.388 9.205 -3.412 1.00 0.89 C ATOM 597 OH TYR A1853 -15.483 10.488 -2.933 1.00 1.07 O ATOM 0 H TYR A1853 -16.721 5.505 -6.758 1.00 0.43 H new ATOM 0 HA TYR A1853 -13.922 5.930 -6.600 1.00 0.38 H new ATOM 0 HB2 TYR A1853 -16.006 4.696 -4.791 1.00 0.40 H new ATOM 0 HB3 TYR A1853 -14.309 4.679 -4.355 1.00 0.40 H new ATOM 0 HD1 TYR A1853 -13.077 6.908 -4.206 1.00 0.66 H new ATOM 0 HD2 TYR A1853 -17.321 6.661 -4.456 1.00 0.67 H new ATOM 0 HE1 TYR A1853 -13.257 9.193 -3.340 1.00 0.83 H new ATOM 0 HE2 TYR A1853 -17.503 8.948 -3.583 1.00 0.83 H new ATOM 0 HH TYR A1853 -16.427 10.744 -2.869 1.00 1.07 H new ATOM 607 N GLN A1854 -14.990 2.844 -6.965 1.00 0.34 N ATOM 608 CA GLN A1854 -14.599 1.481 -7.293 1.00 0.33 C ATOM 609 C GLN A1854 -13.715 1.439 -8.534 1.00 0.30 C ATOM 610 O GLN A1854 -12.599 0.918 -8.490 1.00 0.30 O ATOM 611 CB GLN A1854 -15.841 0.633 -7.526 1.00 0.39 C ATOM 612 CG GLN A1854 -15.541 -0.809 -7.876 1.00 0.43 C ATOM 613 CD GLN A1854 -16.786 -1.559 -8.274 1.00 0.54 C ATOM 614 OE1 GLN A1854 -17.714 -0.984 -8.841 1.00 0.99 O ATOM 615 NE2 GLN A1854 -16.821 -2.844 -7.978 1.00 0.81 N ATOM 0 H GLN A1854 -15.999 2.985 -6.911 1.00 0.34 H new ATOM 0 HA GLN A1854 -14.028 1.083 -6.454 1.00 0.33 H new ATOM 0 HB2 GLN A1854 -16.460 0.658 -6.629 1.00 0.39 H new ATOM 0 HB3 GLN A1854 -16.427 1.078 -8.330 1.00 0.39 H new ATOM 0 HG2 GLN A1854 -14.820 -0.842 -8.693 1.00 0.43 H new ATOM 0 HG3 GLN A1854 -15.078 -1.302 -7.021 1.00 0.43 H new ATOM 0 HE21 GLN A1854 -16.029 -3.281 -7.507 1.00 0.81 H new ATOM 0 HE22 GLN A1854 -17.640 -3.401 -8.220 1.00 0.81 H new ATOM 624 N THR A1855 -14.212 2.003 -9.633 1.00 0.32 N ATOM 625 CA THR A1855 -13.489 1.980 -10.901 1.00 0.34 C ATOM 626 C THR A1855 -12.142 2.685 -10.765 1.00 0.31 C ATOM 627 O THR A1855 -11.187 2.351 -11.453 1.00 0.37 O ATOM 628 CB THR A1855 -14.319 2.625 -12.042 1.00 0.39 C ATOM 629 OG1 THR A1855 -13.725 2.343 -13.317 1.00 1.40 O ATOM 630 CG2 THR A1855 -14.440 4.134 -11.874 1.00 1.46 C ATOM 0 H THR A1855 -15.112 2.481 -9.670 1.00 0.32 H new ATOM 0 HA THR A1855 -13.316 0.936 -11.161 1.00 0.34 H new ATOM 0 HB THR A1855 -15.317 2.191 -11.993 1.00 0.39 H new ATOM 0 HG1 THR A1855 -14.345 2.600 -14.031 1.00 1.40 H new ATOM 0 HG21 THR A1855 -15.029 4.545 -12.694 1.00 1.46 H new ATOM 0 HG22 THR A1855 -14.932 4.356 -10.927 1.00 1.46 H new ATOM 0 HG23 THR A1855 -13.446 4.582 -11.881 1.00 1.46 H new ATOM 638 N THR A1856 -12.072 3.640 -9.852 1.00 0.29 N ATOM 639 CA THR A1856 -10.839 4.365 -9.592 1.00 0.31 C ATOM 640 C THR A1856 -9.886 3.528 -8.739 1.00 0.29 C ATOM 641 O THR A1856 -8.726 3.323 -9.103 1.00 0.38 O ATOM 642 CB THR A1856 -11.134 5.699 -8.879 1.00 0.36 C ATOM 643 OG1 THR A1856 -12.101 6.445 -9.635 1.00 0.39 O ATOM 644 CG2 THR A1856 -9.868 6.528 -8.705 1.00 0.42 C ATOM 0 H THR A1856 -12.861 3.933 -9.275 1.00 0.29 H new ATOM 0 HA THR A1856 -10.365 4.571 -10.552 1.00 0.31 H new ATOM 0 HB THR A1856 -11.530 5.475 -7.888 1.00 0.36 H new ATOM 0 HG1 THR A1856 -12.973 6.002 -9.578 1.00 0.39 H new ATOM 0 HG21 THR A1856 -10.111 7.462 -8.199 1.00 0.42 H new ATOM 0 HG22 THR A1856 -9.146 5.970 -8.109 1.00 0.42 H new ATOM 0 HG23 THR A1856 -9.439 6.746 -9.683 1.00 0.42 H new ATOM 652 N MET A1857 -10.395 3.022 -7.621 1.00 0.24 N ATOM 653 CA MET A1857 -9.580 2.276 -6.669 1.00 0.23 C ATOM 654 C MET A1857 -8.971 1.030 -7.291 1.00 0.21 C ATOM 655 O MET A1857 -7.806 0.722 -7.046 1.00 0.24 O ATOM 656 CB MET A1857 -10.398 1.886 -5.438 1.00 0.26 C ATOM 657 CG MET A1857 -10.715 3.054 -4.520 1.00 0.32 C ATOM 658 SD MET A1857 -11.603 2.542 -3.039 1.00 0.71 S ATOM 659 CE MET A1857 -10.425 1.395 -2.327 1.00 0.34 C ATOM 0 H MET A1857 -11.374 3.116 -7.351 1.00 0.24 H new ATOM 0 HA MET A1857 -8.767 2.937 -6.368 1.00 0.23 H new ATOM 0 HB2 MET A1857 -11.332 1.428 -5.764 1.00 0.26 H new ATOM 0 HB3 MET A1857 -9.851 1.130 -4.874 1.00 0.26 H new ATOM 0 HG2 MET A1857 -9.787 3.548 -4.231 1.00 0.32 H new ATOM 0 HG3 MET A1857 -11.311 3.788 -5.063 1.00 0.32 H new ATOM 0 HE1 MET A1857 -10.753 1.111 -1.327 1.00 0.34 H new ATOM 0 HE2 MET A1857 -10.359 0.505 -2.953 1.00 0.34 H new ATOM 0 HE3 MET A1857 -9.446 1.870 -2.267 1.00 0.34 H new ATOM 669 N VAL A1858 -9.743 0.313 -8.097 1.00 0.20 N ATOM 670 CA VAL A1858 -9.241 -0.915 -8.702 1.00 0.22 C ATOM 671 C VAL A1858 -8.058 -0.629 -9.624 1.00 0.24 C ATOM 672 O VAL A1858 -7.146 -1.440 -9.733 1.00 0.29 O ATOM 673 CB VAL A1858 -10.331 -1.700 -9.469 1.00 0.25 C ATOM 674 CG1 VAL A1858 -11.447 -2.116 -8.527 1.00 0.28 C ATOM 675 CG2 VAL A1858 -10.886 -0.900 -10.636 1.00 0.25 C ATOM 0 H VAL A1858 -10.703 0.554 -8.344 1.00 0.20 H new ATOM 0 HA VAL A1858 -8.910 -1.545 -7.876 1.00 0.22 H new ATOM 0 HB VAL A1858 -9.865 -2.596 -9.880 1.00 0.25 H new ATOM 0 HG11 VAL A1858 -12.206 -2.667 -9.083 1.00 0.28 H new ATOM 0 HG12 VAL A1858 -11.041 -2.751 -7.740 1.00 0.28 H new ATOM 0 HG13 VAL A1858 -11.897 -1.229 -8.081 1.00 0.28 H new ATOM 0 HG21 VAL A1858 -11.649 -1.486 -11.149 1.00 0.25 H new ATOM 0 HG22 VAL A1858 -11.327 0.025 -10.266 1.00 0.25 H new ATOM 0 HG23 VAL A1858 -10.080 -0.665 -11.332 1.00 0.25 H new ATOM 685 N ARG A1859 -8.056 0.545 -10.253 1.00 0.24 N ATOM 686 CA ARG A1859 -6.958 0.937 -11.131 1.00 0.28 C ATOM 687 C ARG A1859 -5.711 1.232 -10.311 1.00 0.29 C ATOM 688 O ARG A1859 -4.606 0.813 -10.662 1.00 0.35 O ATOM 689 CB ARG A1859 -7.330 2.171 -11.951 1.00 0.32 C ATOM 690 CG ARG A1859 -8.570 1.986 -12.796 1.00 0.37 C ATOM 691 CD ARG A1859 -8.899 3.248 -13.569 1.00 0.47 C ATOM 692 NE ARG A1859 -10.318 3.329 -13.891 1.00 1.43 N ATOM 693 CZ ARG A1859 -10.801 3.817 -15.027 1.00 1.88 C ATOM 694 NH1 ARG A1859 -9.975 4.172 -16.006 1.00 1.64 N ATOM 695 NH2 ARG A1859 -12.114 3.923 -15.191 1.00 3.02 N ATOM 0 H ARG A1859 -8.800 1.238 -10.171 1.00 0.24 H new ATOM 0 HA ARG A1859 -6.759 0.110 -11.812 1.00 0.28 H new ATOM 0 HB2 ARG A1859 -7.483 3.013 -11.276 1.00 0.32 H new ATOM 0 HB3 ARG A1859 -6.494 2.431 -12.600 1.00 0.32 H new ATOM 0 HG2 ARG A1859 -8.420 1.159 -13.491 1.00 0.37 H new ATOM 0 HG3 ARG A1859 -9.412 1.717 -12.158 1.00 0.37 H new ATOM 0 HD2 ARG A1859 -8.609 4.120 -12.983 1.00 0.47 H new ATOM 0 HD3 ARG A1859 -8.315 3.274 -14.489 1.00 0.47 H new ATOM 0 HE ARG A1859 -10.984 2.988 -13.198 1.00 1.43 H new ATOM 0 HH11 ARG A1859 -8.967 4.070 -15.885 1.00 1.64 H new ATOM 0 HH12 ARG A1859 -10.349 4.547 -16.878 1.00 1.64 H new ATOM 0 HH21 ARG A1859 -12.746 3.630 -14.446 1.00 3.02 H new ATOM 0 HH22 ARG A1859 -12.491 4.297 -16.062 1.00 3.02 H new ATOM 709 N THR A1860 -5.902 1.953 -9.216 1.00 0.25 N ATOM 710 CA THR A1860 -4.811 2.294 -8.320 1.00 0.27 C ATOM 711 C THR A1860 -4.254 1.042 -7.644 1.00 0.26 C ATOM 712 O THR A1860 -3.052 0.931 -7.407 1.00 0.29 O ATOM 713 CB THR A1860 -5.285 3.305 -7.260 1.00 0.28 C ATOM 714 OG1 THR A1860 -5.892 4.427 -7.914 1.00 0.35 O ATOM 715 CG2 THR A1860 -4.128 3.788 -6.403 1.00 0.32 C ATOM 0 H THR A1860 -6.811 2.315 -8.927 1.00 0.25 H new ATOM 0 HA THR A1860 -4.015 2.750 -8.909 1.00 0.27 H new ATOM 0 HB THR A1860 -6.007 2.809 -6.612 1.00 0.28 H new ATOM 0 HG1 THR A1860 -6.793 4.183 -8.213 1.00 0.35 H new ATOM 0 HG21 THR A1860 -4.495 4.501 -5.664 1.00 0.32 H new ATOM 0 HG22 THR A1860 -3.673 2.939 -5.893 1.00 0.32 H new ATOM 0 HG23 THR A1860 -3.384 4.272 -7.036 1.00 0.32 H new ATOM 723 N ALA A1861 -5.131 0.086 -7.355 1.00 0.23 N ATOM 724 CA ALA A1861 -4.708 -1.183 -6.781 1.00 0.23 C ATOM 725 C ALA A1861 -3.784 -1.921 -7.743 1.00 0.24 C ATOM 726 O ALA A1861 -2.756 -2.458 -7.338 1.00 0.25 O ATOM 727 CB ALA A1861 -5.915 -2.039 -6.427 1.00 0.23 C ATOM 0 H ALA A1861 -6.136 0.167 -7.509 1.00 0.23 H new ATOM 0 HA ALA A1861 -4.155 -0.981 -5.864 1.00 0.23 H new ATOM 0 HB1 ALA A1861 -5.578 -2.983 -5.999 1.00 0.23 H new ATOM 0 HB2 ALA A1861 -6.534 -1.512 -5.701 1.00 0.23 H new ATOM 0 HB3 ALA A1861 -6.498 -2.235 -7.327 1.00 0.23 H new ATOM 733 N LYS A1862 -4.145 -1.932 -9.022 1.00 0.28 N ATOM 734 CA LYS A1862 -3.295 -2.526 -10.048 1.00 0.31 C ATOM 735 C LYS A1862 -1.959 -1.786 -10.115 1.00 0.32 C ATOM 736 O LYS A1862 -0.907 -2.385 -10.349 1.00 0.35 O ATOM 737 CB LYS A1862 -3.980 -2.464 -11.415 1.00 0.41 C ATOM 738 CG LYS A1862 -5.384 -3.042 -11.421 1.00 0.47 C ATOM 739 CD LYS A1862 -6.037 -2.911 -12.788 1.00 0.64 C ATOM 740 CE LYS A1862 -7.529 -3.203 -12.725 1.00 0.69 C ATOM 741 NZ LYS A1862 -8.175 -3.083 -14.060 1.00 1.31 N ATOM 0 H LYS A1862 -5.018 -1.538 -9.372 1.00 0.28 H new ATOM 0 HA LYS A1862 -3.120 -3.569 -9.786 1.00 0.31 H new ATOM 0 HB2 LYS A1862 -4.023 -1.425 -11.743 1.00 0.41 H new ATOM 0 HB3 LYS A1862 -3.372 -3.003 -12.141 1.00 0.41 H new ATOM 0 HG2 LYS A1862 -5.347 -4.093 -11.134 1.00 0.47 H new ATOM 0 HG3 LYS A1862 -5.992 -2.529 -10.676 1.00 0.47 H new ATOM 0 HD2 LYS A1862 -5.879 -1.904 -13.173 1.00 0.64 H new ATOM 0 HD3 LYS A1862 -5.560 -3.598 -13.487 1.00 0.64 H new ATOM 0 HE2 LYS A1862 -7.686 -4.209 -12.335 1.00 0.69 H new ATOM 0 HE3 LYS A1862 -8.005 -2.513 -12.028 1.00 0.69 H new ATOM 0 HZ1 LYS A1862 -9.191 -3.290 -13.974 1.00 1.31 H new ATOM 0 HZ2 LYS A1862 -8.048 -2.116 -14.422 1.00 1.31 H new ATOM 0 HZ3 LYS A1862 -7.739 -3.759 -14.719 1.00 1.31 H new ATOM 755 N ALA A1863 -2.014 -0.475 -9.888 1.00 0.33 N ATOM 756 CA ALA A1863 -0.827 0.370 -9.932 1.00 0.37 C ATOM 757 C ALA A1863 0.118 0.065 -8.775 1.00 0.33 C ATOM 758 O ALA A1863 1.333 -0.007 -8.960 1.00 0.40 O ATOM 759 CB ALA A1863 -1.220 1.841 -9.925 1.00 0.41 C ATOM 0 H ALA A1863 -2.875 0.026 -9.670 1.00 0.33 H new ATOM 0 HA ALA A1863 -0.298 0.152 -10.860 1.00 0.37 H new ATOM 0 HB1 ALA A1863 -0.322 2.458 -9.958 1.00 0.41 H new ATOM 0 HB2 ALA A1863 -1.840 2.056 -10.795 1.00 0.41 H new ATOM 0 HB3 ALA A1863 -1.780 2.064 -9.017 1.00 0.41 H new ATOM 765 N ILE A1864 -0.425 -0.118 -7.579 1.00 0.26 N ATOM 766 CA ILE A1864 0.411 -0.468 -6.438 1.00 0.25 C ATOM 767 C ILE A1864 0.887 -1.913 -6.574 1.00 0.21 C ATOM 768 O ILE A1864 1.951 -2.277 -6.077 1.00 0.21 O ATOM 769 CB ILE A1864 -0.305 -0.256 -5.074 1.00 0.25 C ATOM 770 CG1 ILE A1864 -1.375 -1.317 -4.813 1.00 0.23 C ATOM 771 CG2 ILE A1864 -0.926 1.128 -5.006 1.00 0.28 C ATOM 772 CD1 ILE A1864 -0.948 -2.363 -3.808 1.00 0.26 C ATOM 0 H ILE A1864 -1.421 -0.032 -7.375 1.00 0.26 H new ATOM 0 HA ILE A1864 1.267 0.207 -6.444 1.00 0.25 H new ATOM 0 HB ILE A1864 0.455 -0.351 -4.298 1.00 0.25 H new ATOM 0 HG12 ILE A1864 -2.281 -0.829 -4.456 1.00 0.23 H new ATOM 0 HG13 ILE A1864 -1.627 -1.808 -5.753 1.00 0.23 H new ATOM 0 HG21 ILE A1864 -1.422 1.257 -4.044 1.00 0.28 H new ATOM 0 HG22 ILE A1864 -0.147 1.882 -5.117 1.00 0.28 H new ATOM 0 HG23 ILE A1864 -1.655 1.239 -5.808 1.00 0.28 H new ATOM 0 HD11 ILE A1864 -1.753 -3.085 -3.670 1.00 0.26 H new ATOM 0 HD12 ILE A1864 -0.059 -2.877 -4.173 1.00 0.26 H new ATOM 0 HD13 ILE A1864 -0.724 -1.882 -2.856 1.00 0.26 H new ATOM 784 N ALA A1865 0.105 -2.718 -7.292 1.00 0.18 N ATOM 785 CA ALA A1865 0.443 -4.113 -7.533 1.00 0.17 C ATOM 786 C ALA A1865 1.651 -4.238 -8.454 1.00 0.17 C ATOM 787 O ALA A1865 2.518 -5.085 -8.239 1.00 0.20 O ATOM 788 CB ALA A1865 -0.746 -4.853 -8.118 1.00 0.18 C ATOM 0 H ALA A1865 -0.773 -2.421 -7.718 1.00 0.18 H new ATOM 0 HA ALA A1865 0.702 -4.565 -6.576 1.00 0.17 H new ATOM 0 HB1 ALA A1865 -0.476 -5.895 -8.292 1.00 0.18 H new ATOM 0 HB2 ALA A1865 -1.583 -4.806 -7.421 1.00 0.18 H new ATOM 0 HB3 ALA A1865 -1.034 -4.390 -9.062 1.00 0.18 H new ATOM 794 N VAL A1866 1.717 -3.400 -9.479 1.00 0.16 N ATOM 795 CA VAL A1866 2.871 -3.416 -10.362 1.00 0.18 C ATOM 796 C VAL A1866 4.071 -2.786 -9.658 1.00 0.17 C ATOM 797 O VAL A1866 5.217 -3.136 -9.924 1.00 0.20 O ATOM 798 CB VAL A1866 2.594 -2.714 -11.715 1.00 0.24 C ATOM 799 CG1 VAL A1866 2.314 -1.237 -11.525 1.00 0.73 C ATOM 800 CG2 VAL A1866 3.753 -2.921 -12.674 1.00 0.68 C ATOM 0 H VAL A1866 1.000 -2.714 -9.716 1.00 0.16 H new ATOM 0 HA VAL A1866 3.093 -4.458 -10.594 1.00 0.18 H new ATOM 0 HB VAL A1866 1.702 -3.168 -12.147 1.00 0.24 H new ATOM 0 HG11 VAL A1866 2.124 -0.775 -12.494 1.00 0.73 H new ATOM 0 HG12 VAL A1866 1.440 -1.112 -10.886 1.00 0.73 H new ATOM 0 HG13 VAL A1866 3.176 -0.760 -11.059 1.00 0.73 H new ATOM 0 HG21 VAL A1866 3.538 -2.420 -13.618 1.00 0.68 H new ATOM 0 HG22 VAL A1866 4.662 -2.504 -12.241 1.00 0.68 H new ATOM 0 HG23 VAL A1866 3.892 -3.987 -12.853 1.00 0.68 H new ATOM 810 N THR A1867 3.792 -1.884 -8.725 1.00 0.18 N ATOM 811 CA THR A1867 4.838 -1.292 -7.908 1.00 0.20 C ATOM 812 C THR A1867 5.496 -2.354 -7.026 1.00 0.19 C ATOM 813 O THR A1867 6.719 -2.484 -7.005 1.00 0.24 O ATOM 814 CB THR A1867 4.292 -0.160 -7.017 1.00 0.20 C ATOM 815 OG1 THR A1867 3.646 0.835 -7.821 1.00 0.25 O ATOM 816 CG2 THR A1867 5.414 0.480 -6.213 1.00 0.23 C ATOM 0 H THR A1867 2.851 -1.549 -8.517 1.00 0.18 H new ATOM 0 HA THR A1867 5.577 -0.871 -8.589 1.00 0.20 H new ATOM 0 HB THR A1867 3.567 -0.590 -6.326 1.00 0.20 H new ATOM 0 HG1 THR A1867 2.783 0.492 -8.135 1.00 0.25 H new ATOM 0 HG21 THR A1867 5.007 1.277 -5.591 1.00 0.23 H new ATOM 0 HG22 THR A1867 5.882 -0.273 -5.579 1.00 0.23 H new ATOM 0 HG23 THR A1867 6.158 0.895 -6.893 1.00 0.23 H new ATOM 824 N VAL A1868 4.682 -3.124 -6.310 1.00 0.17 N ATOM 825 CA VAL A1868 5.204 -4.156 -5.426 1.00 0.18 C ATOM 826 C VAL A1868 5.892 -5.270 -6.218 1.00 0.21 C ATOM 827 O VAL A1868 6.932 -5.784 -5.794 1.00 0.28 O ATOM 828 CB VAL A1868 4.112 -4.747 -4.497 1.00 0.17 C ATOM 829 CG1 VAL A1868 2.878 -5.168 -5.272 1.00 0.18 C ATOM 830 CG2 VAL A1868 4.662 -5.923 -3.715 1.00 0.23 C ATOM 0 H VAL A1868 3.665 -3.052 -6.325 1.00 0.17 H new ATOM 0 HA VAL A1868 5.945 -3.672 -4.790 1.00 0.18 H new ATOM 0 HB VAL A1868 3.816 -3.961 -3.803 1.00 0.17 H new ATOM 0 HG11 VAL A1868 2.138 -5.576 -4.584 1.00 0.18 H new ATOM 0 HG12 VAL A1868 2.458 -4.303 -5.785 1.00 0.18 H new ATOM 0 HG13 VAL A1868 3.150 -5.928 -6.005 1.00 0.18 H new ATOM 0 HG21 VAL A1868 3.883 -6.326 -3.068 1.00 0.23 H new ATOM 0 HG22 VAL A1868 4.995 -6.696 -4.407 1.00 0.23 H new ATOM 0 HG23 VAL A1868 5.504 -5.593 -3.107 1.00 0.23 H new ATOM 840 N GLN A1869 5.342 -5.622 -7.380 1.00 0.19 N ATOM 841 CA GLN A1869 5.956 -6.652 -8.212 1.00 0.23 C ATOM 842 C GLN A1869 7.298 -6.156 -8.740 1.00 0.24 C ATOM 843 O GLN A1869 8.198 -6.948 -9.022 1.00 0.27 O ATOM 844 CB GLN A1869 5.025 -7.078 -9.365 1.00 0.24 C ATOM 845 CG GLN A1869 5.041 -6.178 -10.594 1.00 0.24 C ATOM 846 CD GLN A1869 5.840 -6.739 -11.756 1.00 0.43 C ATOM 847 OE1 GLN A1869 6.946 -7.396 -11.467 1.00 0.91 O flip ATOM 848 NE2 GLN A1869 5.475 -6.547 -12.916 1.00 0.29 N flip ATOM 0 H GLN A1869 4.487 -5.216 -7.760 1.00 0.19 H new ATOM 0 HA GLN A1869 6.125 -7.537 -7.598 1.00 0.23 H new ATOM 0 HB2 GLN A1869 5.297 -8.088 -9.673 1.00 0.24 H new ATOM 0 HB3 GLN A1869 4.004 -7.125 -8.985 1.00 0.24 H new ATOM 0 HG2 GLN A1869 4.015 -6.007 -10.920 1.00 0.24 H new ATOM 0 HG3 GLN A1869 5.454 -5.208 -10.317 1.00 0.24 H new ATOM 0 HE21 GLN A1869 4.613 -6.034 -13.101 1.00 0.29 H new ATOM 0 HE22 GLN A1869 6.035 -6.901 -13.692 1.00 0.29 H new ATOM 857 N GLU A1870 7.428 -4.843 -8.865 1.00 0.23 N ATOM 858 CA GLU A1870 8.673 -4.247 -9.277 1.00 0.25 C ATOM 859 C GLU A1870 9.649 -4.231 -8.103 1.00 0.26 C ATOM 860 O GLU A1870 10.812 -4.583 -8.254 1.00 0.27 O ATOM 861 CB GLU A1870 8.434 -2.828 -9.794 1.00 0.26 C ATOM 862 CG GLU A1870 9.642 -2.238 -10.480 1.00 0.31 C ATOM 863 CD GLU A1870 9.885 -2.829 -11.850 1.00 0.39 C ATOM 864 OE1 GLU A1870 10.303 -4.001 -11.933 1.00 0.45 O ATOM 865 OE2 GLU A1870 9.672 -2.117 -12.853 1.00 0.57 O ATOM 0 H GLU A1870 6.679 -4.175 -8.684 1.00 0.23 H new ATOM 0 HA GLU A1870 9.103 -4.839 -10.085 1.00 0.25 H new ATOM 0 HB2 GLU A1870 7.596 -2.838 -10.491 1.00 0.26 H new ATOM 0 HB3 GLU A1870 8.148 -2.187 -8.960 1.00 0.26 H new ATOM 0 HG2 GLU A1870 9.511 -1.160 -10.573 1.00 0.31 H new ATOM 0 HG3 GLU A1870 10.522 -2.400 -9.858 1.00 0.31 H new ATOM 872 N MET A1871 9.149 -3.861 -6.925 1.00 0.29 N ATOM 873 CA MET A1871 9.979 -3.745 -5.723 1.00 0.35 C ATOM 874 C MET A1871 10.675 -5.061 -5.392 1.00 0.34 C ATOM 875 O MET A1871 11.883 -5.089 -5.151 1.00 0.35 O ATOM 876 CB MET A1871 9.128 -3.288 -4.535 1.00 0.51 C ATOM 877 CG MET A1871 8.718 -1.826 -4.612 1.00 0.63 C ATOM 878 SD MET A1871 9.899 -0.720 -3.818 1.00 1.25 S ATOM 879 CE MET A1871 9.603 -1.089 -2.093 1.00 0.34 C ATOM 0 H MET A1871 8.166 -3.635 -6.775 1.00 0.29 H new ATOM 0 HA MET A1871 10.749 -3.000 -5.923 1.00 0.35 H new ATOM 0 HB2 MET A1871 8.232 -3.906 -4.480 1.00 0.51 H new ATOM 0 HB3 MET A1871 9.686 -3.453 -3.613 1.00 0.51 H new ATOM 0 HG2 MET A1871 8.608 -1.540 -5.658 1.00 0.63 H new ATOM 0 HG3 MET A1871 7.742 -1.703 -4.143 1.00 0.63 H new ATOM 0 HE1 MET A1871 9.990 -0.278 -1.476 1.00 0.34 H new ATOM 0 HE2 MET A1871 8.532 -1.196 -1.922 1.00 0.34 H new ATOM 0 HE3 MET A1871 10.107 -2.018 -1.828 1.00 0.34 H new ATOM 889 N VAL A1872 9.916 -6.152 -5.403 1.00 0.38 N ATOM 890 CA VAL A1872 10.470 -7.471 -5.104 1.00 0.43 C ATOM 891 C VAL A1872 11.568 -7.831 -6.103 1.00 0.41 C ATOM 892 O VAL A1872 12.559 -8.477 -5.762 1.00 0.50 O ATOM 893 CB VAL A1872 9.368 -8.558 -5.121 1.00 0.50 C ATOM 894 CG1 VAL A1872 8.781 -8.752 -6.510 1.00 0.51 C ATOM 895 CG2 VAL A1872 9.895 -9.874 -4.572 1.00 0.59 C ATOM 0 H VAL A1872 8.918 -6.151 -5.615 1.00 0.38 H new ATOM 0 HA VAL A1872 10.899 -7.430 -4.103 1.00 0.43 H new ATOM 0 HB VAL A1872 8.564 -8.210 -4.473 1.00 0.50 H new ATOM 0 HG11 VAL A1872 8.012 -9.524 -6.475 1.00 0.51 H new ATOM 0 HG12 VAL A1872 8.341 -7.816 -6.853 1.00 0.51 H new ATOM 0 HG13 VAL A1872 9.569 -9.056 -7.199 1.00 0.51 H new ATOM 0 HG21 VAL A1872 9.102 -10.621 -4.595 1.00 0.59 H new ATOM 0 HG22 VAL A1872 10.731 -10.214 -5.183 1.00 0.59 H new ATOM 0 HG23 VAL A1872 10.230 -9.732 -3.545 1.00 0.59 H new ATOM 905 N THR A1873 11.390 -7.370 -7.324 1.00 0.34 N ATOM 906 CA THR A1873 12.304 -7.658 -8.406 1.00 0.37 C ATOM 907 C THR A1873 13.534 -6.747 -8.352 1.00 0.34 C ATOM 908 O THR A1873 14.670 -7.217 -8.427 1.00 0.43 O ATOM 909 CB THR A1873 11.570 -7.488 -9.747 1.00 0.38 C ATOM 910 OG1 THR A1873 10.486 -8.426 -9.821 1.00 0.44 O ATOM 911 CG2 THR A1873 12.506 -7.685 -10.928 1.00 0.44 C ATOM 0 H THR A1873 10.602 -6.781 -7.593 1.00 0.34 H new ATOM 0 HA THR A1873 12.652 -8.686 -8.306 1.00 0.37 H new ATOM 0 HB THR A1873 11.185 -6.469 -9.796 1.00 0.38 H new ATOM 0 HG1 THR A1873 9.655 -7.989 -9.540 1.00 0.44 H new ATOM 0 HG21 THR A1873 11.951 -7.557 -11.857 1.00 0.44 H new ATOM 0 HG22 THR A1873 13.310 -6.951 -10.881 1.00 0.44 H new ATOM 0 HG23 THR A1873 12.929 -8.689 -10.893 1.00 0.44 H new ATOM 919 N LYS A1874 13.296 -5.449 -8.188 1.00 0.28 N ATOM 920 CA LYS A1874 14.364 -4.455 -8.187 1.00 0.29 C ATOM 921 C LYS A1874 15.330 -4.671 -7.033 1.00 0.30 C ATOM 922 O LYS A1874 16.498 -4.342 -7.145 1.00 0.33 O ATOM 923 CB LYS A1874 13.786 -3.039 -8.104 1.00 0.29 C ATOM 924 CG LYS A1874 12.957 -2.621 -9.311 1.00 0.33 C ATOM 925 CD LYS A1874 13.786 -1.897 -10.366 1.00 0.41 C ATOM 926 CE LYS A1874 14.750 -2.824 -11.087 1.00 0.57 C ATOM 927 NZ LYS A1874 15.489 -2.116 -12.167 1.00 1.40 N ATOM 0 H LYS A1874 12.363 -5.059 -8.053 1.00 0.28 H new ATOM 0 HA LYS A1874 14.910 -4.571 -9.123 1.00 0.29 H new ATOM 0 HB2 LYS A1874 13.166 -2.966 -7.211 1.00 0.29 H new ATOM 0 HB3 LYS A1874 14.607 -2.332 -7.981 1.00 0.29 H new ATOM 0 HG2 LYS A1874 12.499 -3.504 -9.757 1.00 0.33 H new ATOM 0 HG3 LYS A1874 12.145 -1.972 -8.983 1.00 0.33 H new ATOM 0 HD2 LYS A1874 13.119 -1.435 -11.094 1.00 0.41 H new ATOM 0 HD3 LYS A1874 14.347 -1.092 -9.892 1.00 0.41 H new ATOM 0 HE2 LYS A1874 15.460 -3.239 -10.372 1.00 0.57 H new ATOM 0 HE3 LYS A1874 14.199 -3.663 -11.512 1.00 0.57 H new ATOM 0 HZ1 LYS A1874 16.406 -2.582 -12.323 1.00 1.40 H new ATOM 0 HZ2 LYS A1874 14.932 -2.144 -13.045 1.00 1.40 H new ATOM 0 HZ3 LYS A1874 15.647 -1.126 -11.889 1.00 1.40 H new ATOM 941 N SER A1875 14.852 -5.236 -5.935 1.00 0.32 N ATOM 942 CA SER A1875 15.707 -5.493 -4.779 1.00 0.37 C ATOM 943 C SER A1875 16.906 -6.363 -5.159 1.00 0.40 C ATOM 944 O SER A1875 17.952 -6.326 -4.506 1.00 0.44 O ATOM 945 CB SER A1875 14.897 -6.160 -3.666 1.00 0.41 C ATOM 946 OG SER A1875 13.817 -5.337 -3.263 1.00 1.11 O ATOM 0 H SER A1875 13.881 -5.525 -5.817 1.00 0.32 H new ATOM 0 HA SER A1875 16.088 -4.537 -4.419 1.00 0.37 H new ATOM 0 HB2 SER A1875 14.517 -7.121 -4.013 1.00 0.41 H new ATOM 0 HB3 SER A1875 15.543 -6.363 -2.812 1.00 0.41 H new ATOM 0 HG SER A1875 13.135 -5.325 -3.966 1.00 1.11 H new ATOM 952 N ASN A1876 16.752 -7.129 -6.230 1.00 0.42 N ATOM 953 CA ASN A1876 17.801 -8.026 -6.689 1.00 0.48 C ATOM 954 C ASN A1876 18.857 -7.290 -7.511 1.00 0.51 C ATOM 955 O ASN A1876 20.048 -7.576 -7.398 1.00 0.65 O ATOM 956 CB ASN A1876 17.203 -9.163 -7.520 1.00 0.52 C ATOM 957 CG ASN A1876 16.398 -10.140 -6.683 1.00 0.56 C ATOM 958 OD1 ASN A1876 16.951 -11.060 -6.079 1.00 0.76 O ATOM 959 ND2 ASN A1876 15.085 -9.960 -6.653 1.00 0.62 N ATOM 0 H ASN A1876 15.906 -7.146 -6.799 1.00 0.42 H new ATOM 0 HA ASN A1876 18.287 -8.437 -5.804 1.00 0.48 H new ATOM 0 HB2 ASN A1876 16.563 -8.743 -8.296 1.00 0.52 H new ATOM 0 HB3 ASN A1876 18.006 -9.700 -8.025 1.00 0.52 H new ATOM 0 HD21 ASN A1876 14.495 -10.596 -6.116 1.00 0.62 H new ATOM 0 HD22 ASN A1876 14.665 -9.186 -7.167 1.00 0.62 H new ATOM 966 N THR A1877 18.425 -6.347 -8.339 1.00 0.48 N ATOM 967 CA THR A1877 19.331 -5.694 -9.278 1.00 0.55 C ATOM 968 C THR A1877 19.631 -4.247 -8.893 1.00 0.48 C ATOM 969 O THR A1877 20.732 -3.747 -9.130 1.00 0.57 O ATOM 970 CB THR A1877 18.737 -5.694 -10.699 1.00 0.69 C ATOM 971 OG1 THR A1877 17.540 -4.904 -10.726 1.00 1.32 O ATOM 972 CG2 THR A1877 18.418 -7.107 -11.156 1.00 0.94 C ATOM 0 H THR A1877 17.460 -6.018 -8.380 1.00 0.48 H new ATOM 0 HA THR A1877 20.258 -6.266 -9.247 1.00 0.55 H new ATOM 0 HB THR A1877 19.477 -5.268 -11.376 1.00 0.69 H new ATOM 0 HG1 THR A1877 17.776 -3.953 -10.747 1.00 1.32 H new ATOM 0 HG21 THR A1877 18.000 -7.078 -12.162 1.00 0.94 H new ATOM 0 HG22 THR A1877 19.331 -7.703 -11.159 1.00 0.94 H new ATOM 0 HG23 THR A1877 17.694 -7.555 -10.475 1.00 0.94 H new ATOM 980 N SER A1878 18.652 -3.585 -8.298 1.00 0.40 N ATOM 981 CA SER A1878 18.675 -2.141 -8.145 1.00 0.40 C ATOM 982 C SER A1878 18.026 -1.720 -6.826 1.00 0.37 C ATOM 983 O SER A1878 16.845 -1.374 -6.792 1.00 0.38 O ATOM 984 CB SER A1878 17.915 -1.514 -9.311 1.00 0.47 C ATOM 985 OG SER A1878 18.328 -2.071 -10.550 1.00 1.17 O ATOM 0 H SER A1878 17.822 -4.032 -7.909 1.00 0.40 H new ATOM 0 HA SER A1878 19.711 -1.801 -8.138 1.00 0.40 H new ATOM 0 HB2 SER A1878 16.845 -1.671 -9.177 1.00 0.47 H new ATOM 0 HB3 SER A1878 18.081 -0.437 -9.320 1.00 0.47 H new ATOM 0 HG SER A1878 17.896 -1.589 -11.286 1.00 1.17 H new ATOM 991 N PRO A1879 18.782 -1.756 -5.721 1.00 0.38 N ATOM 992 CA PRO A1879 18.252 -1.418 -4.397 1.00 0.39 C ATOM 993 C PRO A1879 17.838 0.046 -4.291 1.00 0.38 C ATOM 994 O PRO A1879 16.896 0.383 -3.580 1.00 0.39 O ATOM 995 CB PRO A1879 19.419 -1.716 -3.451 1.00 0.46 C ATOM 996 CG PRO A1879 20.635 -1.655 -4.310 1.00 0.67 C ATOM 997 CD PRO A1879 20.206 -2.133 -5.668 1.00 0.44 C ATOM 0 HA PRO A1879 17.349 -1.984 -4.168 1.00 0.39 H new ATOM 0 HB2 PRO A1879 19.469 -0.986 -2.643 1.00 0.46 H new ATOM 0 HB3 PRO A1879 19.311 -2.697 -2.988 1.00 0.46 H new ATOM 0 HG2 PRO A1879 21.027 -0.639 -4.360 1.00 0.67 H new ATOM 0 HG3 PRO A1879 21.429 -2.284 -3.908 1.00 0.67 H new ATOM 0 HD2 PRO A1879 20.779 -1.656 -6.463 1.00 0.44 H new ATOM 0 HD3 PRO A1879 20.343 -3.209 -5.778 1.00 0.44 H new ATOM 1005 N GLU A1880 18.530 0.910 -5.022 1.00 0.42 N ATOM 1006 CA GLU A1880 18.271 2.343 -4.958 1.00 0.46 C ATOM 1007 C GLU A1880 16.915 2.697 -5.569 1.00 0.38 C ATOM 1008 O GLU A1880 16.279 3.669 -5.158 1.00 0.41 O ATOM 1009 CB GLU A1880 19.390 3.118 -5.658 1.00 0.62 C ATOM 1010 CG GLU A1880 19.658 2.664 -7.085 1.00 1.05 C ATOM 1011 CD GLU A1880 20.750 3.471 -7.756 1.00 1.39 C ATOM 1012 OE1 GLU A1880 21.940 3.236 -7.454 1.00 1.44 O ATOM 1013 OE2 GLU A1880 20.425 4.335 -8.598 1.00 2.24 O ATOM 0 H GLU A1880 19.275 0.644 -5.666 1.00 0.42 H new ATOM 0 HA GLU A1880 18.246 2.629 -3.907 1.00 0.46 H new ATOM 0 HB2 GLU A1880 19.134 4.177 -5.667 1.00 0.62 H new ATOM 0 HB3 GLU A1880 20.307 3.017 -5.077 1.00 0.62 H new ATOM 0 HG2 GLU A1880 19.940 1.611 -7.081 1.00 1.05 H new ATOM 0 HG3 GLU A1880 18.740 2.746 -7.667 1.00 1.05 H new ATOM 1020 N GLU A1881 16.458 1.892 -6.527 1.00 0.36 N ATOM 1021 CA GLU A1881 15.186 2.152 -7.199 1.00 0.35 C ATOM 1022 C GLU A1881 14.008 1.833 -6.286 1.00 0.30 C ATOM 1023 O GLU A1881 12.868 2.186 -6.584 1.00 0.32 O ATOM 1024 CB GLU A1881 15.069 1.349 -8.497 1.00 0.45 C ATOM 1025 CG GLU A1881 16.076 1.753 -9.558 1.00 0.57 C ATOM 1026 CD GLU A1881 15.765 1.154 -10.915 1.00 1.06 C ATOM 1027 OE1 GLU A1881 14.844 1.647 -11.590 1.00 1.39 O ATOM 1028 OE2 GLU A1881 16.430 0.174 -11.310 1.00 1.89 O ATOM 0 H GLU A1881 16.947 1.059 -6.854 1.00 0.36 H new ATOM 0 HA GLU A1881 15.162 3.214 -7.444 1.00 0.35 H new ATOM 0 HB2 GLU A1881 15.197 0.290 -8.272 1.00 0.45 H new ATOM 0 HB3 GLU A1881 14.063 1.470 -8.899 1.00 0.45 H new ATOM 0 HG2 GLU A1881 16.095 2.840 -9.640 1.00 0.57 H new ATOM 0 HG3 GLU A1881 17.072 1.439 -9.246 1.00 0.57 H new ATOM 1035 N LEU A1882 14.293 1.181 -5.169 1.00 0.28 N ATOM 1036 CA LEU A1882 13.264 0.838 -4.199 1.00 0.29 C ATOM 1037 C LEU A1882 12.716 2.091 -3.529 1.00 0.31 C ATOM 1038 O LEU A1882 11.576 2.111 -3.080 1.00 0.32 O ATOM 1039 CB LEU A1882 13.823 -0.114 -3.144 1.00 0.30 C ATOM 1040 CG LEU A1882 14.232 -1.489 -3.668 1.00 0.31 C ATOM 1041 CD1 LEU A1882 14.943 -2.280 -2.581 1.00 0.34 C ATOM 1042 CD2 LEU A1882 13.013 -2.247 -4.171 1.00 0.34 C ATOM 0 H LEU A1882 15.232 0.878 -4.911 1.00 0.28 H new ATOM 0 HA LEU A1882 12.451 0.342 -4.728 1.00 0.29 H new ATOM 0 HB2 LEU A1882 14.690 0.353 -2.678 1.00 0.30 H new ATOM 0 HB3 LEU A1882 13.074 -0.247 -2.363 1.00 0.30 H new ATOM 0 HG LEU A1882 14.922 -1.354 -4.501 1.00 0.31 H new ATOM 0 HD11 LEU A1882 15.228 -3.258 -2.970 1.00 0.34 H new ATOM 0 HD12 LEU A1882 15.836 -1.741 -2.264 1.00 0.34 H new ATOM 0 HD13 LEU A1882 14.275 -2.409 -1.729 1.00 0.34 H new ATOM 0 HD21 LEU A1882 13.320 -3.225 -4.541 1.00 0.34 H new ATOM 0 HD22 LEU A1882 12.302 -2.375 -3.355 1.00 0.34 H new ATOM 0 HD23 LEU A1882 12.542 -1.685 -4.978 1.00 0.34 H new ATOM 1054 N GLY A1883 13.529 3.140 -3.480 1.00 0.35 N ATOM 1055 CA GLY A1883 13.100 4.374 -2.844 1.00 0.38 C ATOM 1056 C GLY A1883 11.961 5.054 -3.590 1.00 0.34 C ATOM 1057 O GLY A1883 10.909 5.311 -3.003 1.00 0.35 O ATOM 0 H GLY A1883 14.473 3.160 -3.867 1.00 0.35 H new ATOM 0 HA2 GLY A1883 12.784 4.161 -1.823 1.00 0.38 H new ATOM 0 HA3 GLY A1883 13.946 5.058 -2.780 1.00 0.38 H new ATOM 1061 N PRO A1884 12.134 5.352 -4.893 1.00 0.33 N ATOM 1062 CA PRO A1884 11.069 5.932 -5.722 1.00 0.32 C ATOM 1063 C PRO A1884 9.822 5.052 -5.782 1.00 0.29 C ATOM 1064 O PRO A1884 8.697 5.551 -5.739 1.00 0.31 O ATOM 1065 CB PRO A1884 11.709 6.039 -7.109 1.00 0.37 C ATOM 1066 CG PRO A1884 13.172 6.077 -6.849 1.00 0.58 C ATOM 1067 CD PRO A1884 13.392 5.207 -5.648 1.00 0.36 C ATOM 0 HA PRO A1884 10.724 6.884 -5.320 1.00 0.32 H new ATOM 0 HB2 PRO A1884 11.440 5.188 -7.735 1.00 0.37 H new ATOM 0 HB3 PRO A1884 11.376 6.937 -7.630 1.00 0.37 H new ATOM 0 HG2 PRO A1884 13.732 5.708 -7.708 1.00 0.58 H new ATOM 0 HG3 PRO A1884 13.510 7.096 -6.662 1.00 0.58 H new ATOM 0 HD2 PRO A1884 13.575 4.170 -5.930 1.00 0.36 H new ATOM 0 HD3 PRO A1884 14.252 5.536 -5.065 1.00 0.36 H new ATOM 1075 N LEU A1885 10.023 3.743 -5.873 1.00 0.26 N ATOM 1076 CA LEU A1885 8.905 2.812 -5.961 1.00 0.26 C ATOM 1077 C LEU A1885 8.153 2.748 -4.648 1.00 0.27 C ATOM 1078 O LEU A1885 6.926 2.760 -4.635 1.00 0.27 O ATOM 1079 CB LEU A1885 9.384 1.414 -6.355 1.00 0.28 C ATOM 1080 CG LEU A1885 10.068 1.301 -7.717 1.00 0.35 C ATOM 1081 CD1 LEU A1885 10.715 -0.067 -7.864 1.00 0.36 C ATOM 1082 CD2 LEU A1885 9.068 1.532 -8.841 1.00 0.37 C ATOM 0 H LEU A1885 10.944 3.304 -5.888 1.00 0.26 H new ATOM 0 HA LEU A1885 8.231 3.179 -6.735 1.00 0.26 H new ATOM 0 HB2 LEU A1885 10.077 1.060 -5.592 1.00 0.28 H new ATOM 0 HB3 LEU A1885 8.527 0.741 -6.344 1.00 0.28 H new ATOM 0 HG LEU A1885 10.840 2.068 -7.781 1.00 0.35 H new ATOM 0 HD11 LEU A1885 11.200 -0.138 -8.838 1.00 0.36 H new ATOM 0 HD12 LEU A1885 11.458 -0.205 -7.078 1.00 0.36 H new ATOM 0 HD13 LEU A1885 9.952 -0.841 -7.782 1.00 0.36 H new ATOM 0 HD21 LEU A1885 9.575 1.447 -9.802 1.00 0.37 H new ATOM 0 HD22 LEU A1885 8.275 0.786 -8.782 1.00 0.37 H new ATOM 0 HD23 LEU A1885 8.636 2.528 -8.745 1.00 0.37 H new ATOM 1094 N ALA A1886 8.885 2.683 -3.548 1.00 0.29 N ATOM 1095 CA ALA A1886 8.268 2.729 -2.235 1.00 0.32 C ATOM 1096 C ALA A1886 7.436 3.987 -2.089 1.00 0.30 C ATOM 1097 O ALA A1886 6.385 3.982 -1.454 1.00 0.33 O ATOM 1098 CB ALA A1886 9.317 2.682 -1.145 1.00 0.36 C ATOM 0 H ALA A1886 9.901 2.599 -3.539 1.00 0.29 H new ATOM 0 HA ALA A1886 7.621 1.857 -2.135 1.00 0.32 H new ATOM 0 HB1 ALA A1886 8.831 2.718 -0.170 1.00 0.36 H new ATOM 0 HB2 ALA A1886 9.890 1.759 -1.231 1.00 0.36 H new ATOM 0 HB3 ALA A1886 9.987 3.536 -1.248 1.00 0.36 H new ATOM 1104 N ASN A1887 7.911 5.064 -2.701 1.00 0.28 N ATOM 1105 CA ASN A1887 7.230 6.341 -2.625 1.00 0.28 C ATOM 1106 C ASN A1887 5.918 6.294 -3.393 1.00 0.25 C ATOM 1107 O ASN A1887 4.884 6.747 -2.902 1.00 0.25 O ATOM 1108 CB ASN A1887 8.118 7.461 -3.168 1.00 0.32 C ATOM 1109 CG ASN A1887 7.879 8.782 -2.462 1.00 0.77 C ATOM 1110 OD1 ASN A1887 6.781 9.058 -1.974 1.00 1.43 O ATOM 1111 ND2 ASN A1887 8.909 9.609 -2.399 1.00 1.04 N ATOM 0 H ASN A1887 8.767 5.074 -3.255 1.00 0.28 H new ATOM 0 HA ASN A1887 7.014 6.547 -1.577 1.00 0.28 H new ATOM 0 HB2 ASN A1887 9.165 7.177 -3.057 1.00 0.32 H new ATOM 0 HB3 ASN A1887 7.932 7.584 -4.235 1.00 0.32 H new ATOM 0 HD21 ASN A1887 8.811 10.512 -1.934 1.00 1.04 H new ATOM 0 HD22 ASN A1887 9.802 9.344 -2.815 1.00 1.04 H new ATOM 1118 N GLN A1888 5.961 5.723 -4.590 1.00 0.27 N ATOM 1119 CA GLN A1888 4.765 5.568 -5.409 1.00 0.28 C ATOM 1120 C GLN A1888 3.802 4.576 -4.765 1.00 0.25 C ATOM 1121 O GLN A1888 2.595 4.801 -4.735 1.00 0.26 O ATOM 1122 CB GLN A1888 5.144 5.099 -6.813 1.00 0.34 C ATOM 1123 CG GLN A1888 3.961 4.978 -7.757 1.00 0.44 C ATOM 1124 CD GLN A1888 4.357 4.427 -9.109 1.00 0.59 C ATOM 1125 OE1 GLN A1888 4.706 5.175 -10.020 1.00 1.07 O ATOM 1126 NE2 GLN A1888 4.297 3.116 -9.253 1.00 0.78 N ATOM 0 H GLN A1888 6.813 5.359 -5.016 1.00 0.27 H new ATOM 0 HA GLN A1888 4.268 6.535 -5.483 1.00 0.28 H new ATOM 0 HB2 GLN A1888 5.866 5.797 -7.237 1.00 0.34 H new ATOM 0 HB3 GLN A1888 5.641 4.131 -6.741 1.00 0.34 H new ATOM 0 HG2 GLN A1888 3.208 4.330 -7.310 1.00 0.44 H new ATOM 0 HG3 GLN A1888 3.502 5.958 -7.887 1.00 0.44 H new ATOM 0 HE21 GLN A1888 4.002 2.530 -8.472 1.00 0.78 H new ATOM 0 HE22 GLN A1888 4.545 2.689 -10.145 1.00 0.78 H new ATOM 1135 N LEU A1889 4.350 3.483 -4.241 1.00 0.22 N ATOM 1136 CA LEU A1889 3.560 2.496 -3.514 1.00 0.19 C ATOM 1137 C LEU A1889 2.844 3.167 -2.354 1.00 0.20 C ATOM 1138 O LEU A1889 1.686 2.882 -2.072 1.00 0.25 O ATOM 1139 CB LEU A1889 4.467 1.381 -2.984 1.00 0.18 C ATOM 1140 CG LEU A1889 3.755 0.251 -2.237 1.00 0.18 C ATOM 1141 CD1 LEU A1889 2.838 -0.519 -3.174 1.00 0.21 C ATOM 1142 CD2 LEU A1889 4.771 -0.681 -1.596 1.00 0.18 C ATOM 0 H LEU A1889 5.343 3.259 -4.307 1.00 0.22 H new ATOM 0 HA LEU A1889 2.825 2.063 -4.192 1.00 0.19 H new ATOM 0 HB2 LEU A1889 5.013 0.950 -3.824 1.00 0.18 H new ATOM 0 HB3 LEU A1889 5.206 1.824 -2.317 1.00 0.18 H new ATOM 0 HG LEU A1889 3.143 0.691 -1.449 1.00 0.18 H new ATOM 0 HD11 LEU A1889 2.342 -1.318 -2.623 1.00 0.21 H new ATOM 0 HD12 LEU A1889 2.089 0.157 -3.587 1.00 0.21 H new ATOM 0 HD13 LEU A1889 3.425 -0.949 -3.986 1.00 0.21 H new ATOM 0 HD21 LEU A1889 4.250 -1.480 -1.068 1.00 0.18 H new ATOM 0 HD22 LEU A1889 5.408 -1.112 -2.369 1.00 0.18 H new ATOM 0 HD23 LEU A1889 5.385 -0.120 -0.891 1.00 0.18 H new ATOM 1154 N THR A1890 3.551 4.077 -1.703 1.00 0.20 N ATOM 1155 CA THR A1890 3.023 4.802 -0.561 1.00 0.22 C ATOM 1156 C THR A1890 1.949 5.811 -0.975 1.00 0.23 C ATOM 1157 O THR A1890 0.900 5.910 -0.333 1.00 0.24 O ATOM 1158 CB THR A1890 4.160 5.531 0.179 1.00 0.23 C ATOM 1159 OG1 THR A1890 5.060 4.570 0.744 1.00 0.25 O ATOM 1160 CG2 THR A1890 3.624 6.446 1.269 1.00 0.28 C ATOM 0 H THR A1890 4.506 4.333 -1.952 1.00 0.20 H new ATOM 0 HA THR A1890 2.561 4.072 0.104 1.00 0.22 H new ATOM 0 HB THR A1890 4.690 6.152 -0.543 1.00 0.23 H new ATOM 0 HG1 THR A1890 5.508 4.078 0.024 1.00 0.25 H new ATOM 0 HG21 THR A1890 4.456 6.943 1.769 1.00 0.28 H new ATOM 0 HG22 THR A1890 2.968 7.195 0.825 1.00 0.28 H new ATOM 0 HG23 THR A1890 3.064 5.857 1.995 1.00 0.28 H new ATOM 1168 N SER A1891 2.202 6.547 -2.047 1.00 0.23 N ATOM 1169 CA SER A1891 1.289 7.596 -2.469 1.00 0.26 C ATOM 1170 C SER A1891 0.020 7.008 -3.064 1.00 0.26 C ATOM 1171 O SER A1891 -1.089 7.361 -2.659 1.00 0.28 O ATOM 1172 CB SER A1891 1.983 8.513 -3.465 1.00 0.30 C ATOM 1173 OG SER A1891 2.517 7.785 -4.556 1.00 1.17 O ATOM 0 H SER A1891 3.027 6.438 -2.637 1.00 0.23 H new ATOM 0 HA SER A1891 1.001 8.181 -1.595 1.00 0.26 H new ATOM 0 HB2 SER A1891 1.274 9.255 -3.833 1.00 0.30 H new ATOM 0 HB3 SER A1891 2.783 9.058 -2.963 1.00 0.30 H new ATOM 0 HG SER A1891 2.955 8.403 -5.178 1.00 1.17 H new ATOM 1179 N ASP A1892 0.188 6.101 -4.015 1.00 0.26 N ATOM 1180 CA ASP A1892 -0.949 5.402 -4.610 1.00 0.28 C ATOM 1181 C ASP A1892 -1.758 4.669 -3.538 1.00 0.24 C ATOM 1182 O ASP A1892 -2.990 4.666 -3.579 1.00 0.25 O ATOM 1183 CB ASP A1892 -0.495 4.422 -5.701 1.00 0.33 C ATOM 1184 CG ASP A1892 -0.443 5.055 -7.082 1.00 0.50 C ATOM 1185 OD1 ASP A1892 -1.487 5.078 -7.769 1.00 0.73 O ATOM 1186 OD2 ASP A1892 0.634 5.531 -7.492 1.00 0.80 O ATOM 0 H ASP A1892 1.096 5.830 -4.392 1.00 0.26 H new ATOM 0 HA ASP A1892 -1.588 6.152 -5.076 1.00 0.28 H new ATOM 0 HB2 ASP A1892 0.492 4.035 -5.447 1.00 0.33 H new ATOM 0 HB3 ASP A1892 -1.175 3.570 -5.723 1.00 0.33 H new ATOM 1191 N TYR A1893 -1.074 4.068 -2.564 1.00 0.24 N ATOM 1192 CA TYR A1893 -1.761 3.417 -1.451 1.00 0.23 C ATOM 1193 C TYR A1893 -2.538 4.434 -0.623 1.00 0.22 C ATOM 1194 O TYR A1893 -3.681 4.188 -0.238 1.00 0.23 O ATOM 1195 CB TYR A1893 -0.789 2.664 -0.539 1.00 0.24 C ATOM 1196 CG TYR A1893 -1.435 2.226 0.755 1.00 0.22 C ATOM 1197 CD1 TYR A1893 -2.385 1.218 0.765 1.00 0.26 C ATOM 1198 CD2 TYR A1893 -1.125 2.850 1.958 1.00 0.26 C ATOM 1199 CE1 TYR A1893 -3.010 0.844 1.935 1.00 0.28 C ATOM 1200 CE2 TYR A1893 -1.741 2.474 3.134 1.00 0.27 C ATOM 1201 CZ TYR A1893 -2.686 1.473 3.116 1.00 0.25 C ATOM 1202 OH TYR A1893 -3.318 1.104 4.280 1.00 0.31 O ATOM 0 H TYR A1893 -0.056 4.019 -2.523 1.00 0.24 H new ATOM 0 HA TYR A1893 -2.452 2.696 -1.889 1.00 0.23 H new ATOM 0 HB2 TYR A1893 -0.405 1.790 -1.065 1.00 0.24 H new ATOM 0 HB3 TYR A1893 0.066 3.303 -0.317 1.00 0.24 H new ATOM 0 HD1 TYR A1893 -2.640 0.718 -0.158 1.00 0.26 H new ATOM 0 HD2 TYR A1893 -0.390 3.642 1.972 1.00 0.26 H new ATOM 0 HE1 TYR A1893 -3.752 0.059 1.925 1.00 0.28 H new ATOM 0 HE2 TYR A1893 -1.484 2.962 4.063 1.00 0.27 H new ATOM 0 HH TYR A1893 -3.801 0.264 4.137 1.00 0.31 H new ATOM 1212 N GLY A1894 -1.908 5.569 -0.342 1.00 0.25 N ATOM 1213 CA GLY A1894 -2.567 6.620 0.409 1.00 0.29 C ATOM 1214 C GLY A1894 -3.840 7.074 -0.268 1.00 0.29 C ATOM 1215 O GLY A1894 -4.841 7.358 0.387 1.00 0.31 O ATOM 0 H GLY A1894 -0.950 5.780 -0.622 1.00 0.25 H new ATOM 0 HA2 GLY A1894 -2.796 6.262 1.413 1.00 0.29 H new ATOM 0 HA3 GLY A1894 -1.891 7.468 0.519 1.00 0.29 H new ATOM 1219 N ARG A1895 -3.801 7.121 -1.591 1.00 0.33 N ATOM 1220 CA ARG A1895 -4.968 7.462 -2.384 1.00 0.37 C ATOM 1221 C ARG A1895 -6.037 6.386 -2.233 1.00 0.36 C ATOM 1222 O ARG A1895 -7.210 6.693 -2.024 1.00 0.40 O ATOM 1223 CB ARG A1895 -4.574 7.620 -3.848 1.00 0.47 C ATOM 1224 CG ARG A1895 -3.599 8.759 -4.087 1.00 0.87 C ATOM 1225 CD ARG A1895 -3.069 8.748 -5.507 1.00 0.91 C ATOM 1226 NE ARG A1895 -4.138 8.918 -6.484 1.00 1.56 N ATOM 1227 CZ ARG A1895 -4.270 8.176 -7.578 1.00 2.06 C ATOM 1228 NH1 ARG A1895 -3.427 7.182 -7.821 1.00 1.98 N ATOM 1229 NH2 ARG A1895 -5.255 8.431 -8.427 1.00 3.04 N ATOM 0 H ARG A1895 -2.964 6.925 -2.141 1.00 0.33 H new ATOM 0 HA ARG A1895 -5.376 8.408 -2.028 1.00 0.37 H new ATOM 0 HB2 ARG A1895 -4.128 6.689 -4.200 1.00 0.47 H new ATOM 0 HB3 ARG A1895 -5.472 7.788 -4.443 1.00 0.47 H new ATOM 0 HG2 ARG A1895 -4.094 9.710 -3.890 1.00 0.87 H new ATOM 0 HG3 ARG A1895 -2.768 8.681 -3.387 1.00 0.87 H new ATOM 0 HD2 ARG A1895 -2.336 9.545 -5.628 1.00 0.91 H new ATOM 0 HD3 ARG A1895 -2.551 7.808 -5.695 1.00 0.91 H new ATOM 0 HE ARG A1895 -4.827 9.652 -6.317 1.00 1.56 H new ATOM 0 HH11 ARG A1895 -2.671 6.983 -7.166 1.00 1.98 H new ATOM 0 HH12 ARG A1895 -3.534 6.616 -8.663 1.00 1.98 H new ATOM 0 HH21 ARG A1895 -5.906 9.193 -8.239 1.00 3.04 H new ATOM 0 HH22 ARG A1895 -5.362 7.865 -9.269 1.00 3.04 H new ATOM 1243 N LEU A1896 -5.618 5.128 -2.329 1.00 0.35 N ATOM 1244 CA LEU A1896 -6.510 3.999 -2.090 1.00 0.39 C ATOM 1245 C LEU A1896 -7.198 4.141 -0.742 1.00 0.36 C ATOM 1246 O LEU A1896 -8.419 4.075 -0.650 1.00 0.43 O ATOM 1247 CB LEU A1896 -5.733 2.682 -2.125 1.00 0.43 C ATOM 1248 CG LEU A1896 -5.365 2.173 -3.516 1.00 0.41 C ATOM 1249 CD1 LEU A1896 -4.480 0.941 -3.414 1.00 0.86 C ATOM 1250 CD2 LEU A1896 -6.626 1.859 -4.304 1.00 0.72 C ATOM 0 H LEU A1896 -4.663 4.864 -2.572 1.00 0.35 H new ATOM 0 HA LEU A1896 -7.262 3.992 -2.879 1.00 0.39 H new ATOM 0 HB2 LEU A1896 -4.816 2.806 -1.548 1.00 0.43 H new ATOM 0 HB3 LEU A1896 -6.325 1.917 -1.622 1.00 0.43 H new ATOM 0 HG LEU A1896 -4.809 2.951 -4.039 1.00 0.41 H new ATOM 0 HD11 LEU A1896 -4.227 0.591 -4.415 1.00 0.86 H new ATOM 0 HD12 LEU A1896 -3.566 1.193 -2.876 1.00 0.86 H new ATOM 0 HD13 LEU A1896 -5.012 0.155 -2.878 1.00 0.86 H new ATOM 0 HD21 LEU A1896 -6.355 1.496 -5.295 1.00 0.72 H new ATOM 0 HD22 LEU A1896 -7.200 1.093 -3.782 1.00 0.72 H new ATOM 0 HD23 LEU A1896 -7.229 2.762 -4.400 1.00 0.72 H new ATOM 1262 N ALA A1897 -6.399 4.363 0.294 1.00 0.32 N ATOM 1263 CA ALA A1897 -6.910 4.491 1.650 1.00 0.37 C ATOM 1264 C ALA A1897 -7.833 5.696 1.796 1.00 0.38 C ATOM 1265 O ALA A1897 -8.758 5.680 2.606 1.00 0.49 O ATOM 1266 CB ALA A1897 -5.757 4.588 2.636 1.00 0.42 C ATOM 0 H ALA A1897 -5.386 4.459 0.218 1.00 0.32 H new ATOM 0 HA ALA A1897 -7.497 3.599 1.869 1.00 0.37 H new ATOM 0 HB1 ALA A1897 -6.151 4.684 3.648 1.00 0.42 H new ATOM 0 HB2 ALA A1897 -5.144 3.689 2.568 1.00 0.42 H new ATOM 0 HB3 ALA A1897 -5.149 5.461 2.400 1.00 0.42 H new ATOM 1272 N SER A1898 -7.579 6.740 1.020 1.00 0.34 N ATOM 1273 CA SER A1898 -8.403 7.938 1.070 1.00 0.40 C ATOM 1274 C SER A1898 -9.778 7.675 0.458 1.00 0.35 C ATOM 1275 O SER A1898 -10.794 7.795 1.137 1.00 0.42 O ATOM 1276 CB SER A1898 -7.708 9.097 0.351 1.00 0.50 C ATOM 1277 OG SER A1898 -6.448 9.379 0.941 1.00 1.38 O ATOM 0 H SER A1898 -6.811 6.781 0.350 1.00 0.34 H new ATOM 0 HA SER A1898 -8.542 8.214 2.115 1.00 0.40 H new ATOM 0 HB2 SER A1898 -7.573 8.848 -0.702 1.00 0.50 H new ATOM 0 HB3 SER A1898 -8.339 9.985 0.390 1.00 0.50 H new ATOM 0 HG SER A1898 -5.818 8.659 0.727 1.00 1.38 H new ATOM 1283 N GLN A1899 -9.800 7.297 -0.818 1.00 0.32 N ATOM 1284 CA GLN A1899 -11.046 7.029 -1.522 1.00 0.33 C ATOM 1285 C GLN A1899 -11.816 5.851 -0.918 1.00 0.28 C ATOM 1286 O GLN A1899 -13.036 5.771 -1.059 1.00 0.32 O ATOM 1287 CB GLN A1899 -10.772 6.774 -3.007 1.00 0.41 C ATOM 1288 CG GLN A1899 -10.462 8.041 -3.792 1.00 0.56 C ATOM 1289 CD GLN A1899 -9.050 8.552 -3.605 1.00 0.76 C ATOM 1290 OE1 GLN A1899 -8.776 9.341 -2.701 1.00 1.56 O ATOM 1291 NE2 GLN A1899 -8.147 8.123 -4.470 1.00 1.15 N ATOM 0 H GLN A1899 -8.962 7.170 -1.386 1.00 0.32 H new ATOM 0 HA GLN A1899 -11.673 7.914 -1.414 1.00 0.33 H new ATOM 0 HB2 GLN A1899 -9.934 6.083 -3.101 1.00 0.41 H new ATOM 0 HB3 GLN A1899 -11.639 6.284 -3.450 1.00 0.41 H new ATOM 0 HG2 GLN A1899 -10.631 7.850 -4.852 1.00 0.56 H new ATOM 0 HG3 GLN A1899 -11.162 8.821 -3.494 1.00 0.56 H new ATOM 0 HE21 GLN A1899 -8.415 7.469 -5.205 1.00 1.15 H new ATOM 0 HE22 GLN A1899 -7.182 8.446 -4.402 1.00 1.15 H new ATOM 1300 N ALA A1900 -11.108 4.952 -0.242 1.00 0.26 N ATOM 1301 CA ALA A1900 -11.730 3.774 0.359 1.00 0.28 C ATOM 1302 C ALA A1900 -12.743 4.147 1.436 1.00 0.30 C ATOM 1303 O ALA A1900 -13.732 3.442 1.641 1.00 0.34 O ATOM 1304 CB ALA A1900 -10.671 2.860 0.954 1.00 0.33 C ATOM 0 H ALA A1900 -10.101 5.016 -0.096 1.00 0.26 H new ATOM 0 HA ALA A1900 -12.261 3.253 -0.437 1.00 0.28 H new ATOM 0 HB1 ALA A1900 -11.151 1.988 1.398 1.00 0.33 H new ATOM 0 HB2 ALA A1900 -9.986 2.538 0.170 1.00 0.33 H new ATOM 0 HB3 ALA A1900 -10.116 3.398 1.722 1.00 0.33 H new ATOM 1310 N LYS A1901 -12.502 5.259 2.116 1.00 0.34 N ATOM 1311 CA LYS A1901 -13.341 5.649 3.239 1.00 0.42 C ATOM 1312 C LYS A1901 -14.739 6.085 2.768 1.00 0.41 C ATOM 1313 O LYS A1901 -15.740 5.535 3.233 1.00 0.46 O ATOM 1314 CB LYS A1901 -12.660 6.745 4.067 1.00 0.52 C ATOM 1315 CG LYS A1901 -13.233 6.874 5.465 1.00 0.79 C ATOM 1316 CD LYS A1901 -12.507 7.930 6.283 1.00 1.18 C ATOM 1317 CE LYS A1901 -13.132 8.083 7.660 1.00 1.69 C ATOM 1318 NZ LYS A1901 -12.384 9.039 8.512 1.00 2.27 N ATOM 0 H LYS A1901 -11.738 5.903 1.911 1.00 0.34 H new ATOM 0 HA LYS A1901 -13.475 4.778 3.881 1.00 0.42 H new ATOM 0 HB2 LYS A1901 -11.593 6.531 4.136 1.00 0.52 H new ATOM 0 HB3 LYS A1901 -12.761 7.699 3.550 1.00 0.52 H new ATOM 0 HG2 LYS A1901 -14.291 7.129 5.401 1.00 0.79 H new ATOM 0 HG3 LYS A1901 -13.167 5.912 5.974 1.00 0.79 H new ATOM 0 HD2 LYS A1901 -11.457 7.656 6.386 1.00 1.18 H new ATOM 0 HD3 LYS A1901 -12.538 8.885 5.758 1.00 1.18 H new ATOM 0 HE2 LYS A1901 -14.162 8.423 7.554 1.00 1.69 H new ATOM 0 HE3 LYS A1901 -13.166 7.111 8.152 1.00 1.69 H new ATOM 0 HZ1 LYS A1901 -12.846 9.111 9.441 1.00 2.27 H new ATOM 0 HZ2 LYS A1901 -11.408 8.703 8.636 1.00 2.27 H new ATOM 0 HZ3 LYS A1901 -12.373 9.974 8.057 1.00 2.27 H new ATOM 1332 N PRO A1902 -14.848 7.070 1.842 1.00 0.41 N ATOM 1333 CA PRO A1902 -16.140 7.449 1.262 1.00 0.46 C ATOM 1334 C PRO A1902 -16.756 6.318 0.436 1.00 0.42 C ATOM 1335 O PRO A1902 -17.975 6.216 0.329 1.00 0.48 O ATOM 1336 CB PRO A1902 -15.815 8.653 0.370 1.00 0.51 C ATOM 1337 CG PRO A1902 -14.354 8.563 0.112 1.00 0.60 C ATOM 1338 CD PRO A1902 -13.756 7.917 1.326 1.00 0.43 C ATOM 0 HA PRO A1902 -16.875 7.675 2.035 1.00 0.46 H new ATOM 0 HB2 PRO A1902 -16.382 8.618 -0.560 1.00 0.51 H new ATOM 0 HB3 PRO A1902 -16.071 9.590 0.865 1.00 0.51 H new ATOM 0 HG2 PRO A1902 -14.152 7.974 -0.782 1.00 0.60 H new ATOM 0 HG3 PRO A1902 -13.926 9.552 -0.054 1.00 0.60 H new ATOM 0 HD2 PRO A1902 -12.876 7.326 1.073 1.00 0.43 H new ATOM 0 HD3 PRO A1902 -13.442 8.658 2.061 1.00 0.43 H new ATOM 1346 N ALA A1903 -15.909 5.471 -0.147 1.00 0.35 N ATOM 1347 CA ALA A1903 -16.387 4.311 -0.897 1.00 0.35 C ATOM 1348 C ALA A1903 -17.150 3.366 0.019 1.00 0.35 C ATOM 1349 O ALA A1903 -18.162 2.782 -0.373 1.00 0.39 O ATOM 1350 CB ALA A1903 -15.226 3.575 -1.552 1.00 0.32 C ATOM 0 H ALA A1903 -14.894 5.565 -0.115 1.00 0.35 H new ATOM 0 HA ALA A1903 -17.058 4.666 -1.679 1.00 0.35 H new ATOM 0 HB1 ALA A1903 -15.605 2.715 -2.105 1.00 0.32 H new ATOM 0 HB2 ALA A1903 -14.709 4.247 -2.237 1.00 0.32 H new ATOM 0 HB3 ALA A1903 -14.531 3.235 -0.784 1.00 0.32 H new ATOM 1356 N ALA A1904 -16.661 3.240 1.246 1.00 0.35 N ATOM 1357 CA ALA A1904 -17.266 2.362 2.234 1.00 0.38 C ATOM 1358 C ALA A1904 -18.690 2.797 2.571 1.00 0.43 C ATOM 1359 O ALA A1904 -19.591 1.965 2.672 1.00 0.46 O ATOM 1360 CB ALA A1904 -16.409 2.320 3.494 1.00 0.41 C ATOM 0 H ALA A1904 -15.838 3.741 1.581 1.00 0.35 H new ATOM 0 HA ALA A1904 -17.319 1.361 1.807 1.00 0.38 H new ATOM 0 HB1 ALA A1904 -16.872 1.659 4.227 1.00 0.41 H new ATOM 0 HB2 ALA A1904 -15.415 1.947 3.246 1.00 0.41 H new ATOM 0 HB3 ALA A1904 -16.326 3.324 3.911 1.00 0.41 H new ATOM 1366 N VAL A1905 -18.890 4.098 2.754 1.00 0.47 N ATOM 1367 CA VAL A1905 -20.213 4.621 3.077 1.00 0.54 C ATOM 1368 C VAL A1905 -21.111 4.666 1.836 1.00 0.54 C ATOM 1369 O VAL A1905 -22.334 4.573 1.939 1.00 0.61 O ATOM 1370 CB VAL A1905 -20.138 6.021 3.732 1.00 0.63 C ATOM 1371 CG1 VAL A1905 -19.656 7.072 2.748 1.00 1.25 C ATOM 1372 CG2 VAL A1905 -21.484 6.409 4.320 1.00 1.26 C ATOM 0 H VAL A1905 -18.159 4.806 2.685 1.00 0.47 H new ATOM 0 HA VAL A1905 -20.653 3.935 3.801 1.00 0.54 H new ATOM 0 HB VAL A1905 -19.409 5.970 4.541 1.00 0.63 H new ATOM 0 HG11 VAL A1905 -19.616 8.042 3.243 1.00 1.25 H new ATOM 0 HG12 VAL A1905 -18.662 6.806 2.390 1.00 1.25 H new ATOM 0 HG13 VAL A1905 -20.344 7.123 1.904 1.00 1.25 H new ATOM 0 HG21 VAL A1905 -21.411 7.396 4.776 1.00 1.26 H new ATOM 0 HG22 VAL A1905 -22.234 6.429 3.530 1.00 1.26 H new ATOM 0 HG23 VAL A1905 -21.774 5.680 5.077 1.00 1.26 H new ATOM 1382 N ALA A1906 -20.494 4.797 0.663 1.00 0.50 N ATOM 1383 CA ALA A1906 -21.236 4.839 -0.593 1.00 0.52 C ATOM 1384 C ALA A1906 -21.878 3.488 -0.885 1.00 0.54 C ATOM 1385 O ALA A1906 -22.933 3.409 -1.523 1.00 0.64 O ATOM 1386 CB ALA A1906 -20.323 5.252 -1.738 1.00 0.52 C ATOM 0 H ALA A1906 -19.483 4.876 0.557 1.00 0.50 H new ATOM 0 HA ALA A1906 -22.028 5.581 -0.497 1.00 0.52 H new ATOM 0 HB1 ALA A1906 -20.893 5.278 -2.667 1.00 0.52 H new ATOM 0 HB2 ALA A1906 -19.912 6.241 -1.537 1.00 0.52 H new ATOM 0 HB3 ALA A1906 -19.509 4.533 -1.832 1.00 0.52 H new ATOM 1392 N ALA A1907 -21.241 2.432 -0.403 1.00 0.51 N ATOM 1393 CA ALA A1907 -21.762 1.082 -0.563 1.00 0.61 C ATOM 1394 C ALA A1907 -23.034 0.914 0.254 1.00 0.79 C ATOM 1395 O ALA A1907 -23.182 1.527 1.310 1.00 0.85 O ATOM 1396 CB ALA A1907 -20.717 0.060 -0.141 1.00 0.54 C ATOM 0 H ALA A1907 -20.358 2.484 0.105 1.00 0.51 H new ATOM 0 HA ALA A1907 -21.999 0.917 -1.614 1.00 0.61 H new ATOM 0 HB1 ALA A1907 -21.120 -0.945 -0.266 1.00 0.54 H new ATOM 0 HB2 ALA A1907 -19.827 0.173 -0.759 1.00 0.54 H new ATOM 0 HB3 ALA A1907 -20.455 0.218 0.905 1.00 0.54 H new ATOM 1402 N GLU A1908 -23.951 0.087 -0.229 1.00 0.97 N ATOM 1403 CA GLU A1908 -25.223 -0.098 0.453 1.00 1.19 C ATOM 1404 C GLU A1908 -25.091 -1.137 1.555 1.00 1.13 C ATOM 1405 O GLU A1908 -25.851 -1.130 2.522 1.00 1.25 O ATOM 1406 CB GLU A1908 -26.322 -0.497 -0.528 1.00 1.45 C ATOM 1407 CG GLU A1908 -26.670 0.596 -1.523 1.00 1.66 C ATOM 1408 CD GLU A1908 -27.914 0.274 -2.322 1.00 2.12 C ATOM 1409 OE1 GLU A1908 -29.029 0.517 -1.816 1.00 2.66 O ATOM 1410 OE2 GLU A1908 -27.785 -0.226 -3.458 1.00 2.67 O ATOM 0 H GLU A1908 -23.840 -0.461 -1.082 1.00 0.97 H new ATOM 0 HA GLU A1908 -25.504 0.854 0.903 1.00 1.19 H new ATOM 0 HB2 GLU A1908 -26.007 -1.387 -1.073 1.00 1.45 H new ATOM 0 HB3 GLU A1908 -27.218 -0.767 0.032 1.00 1.45 H new ATOM 0 HG2 GLU A1908 -26.817 1.535 -0.990 1.00 1.66 H new ATOM 0 HG3 GLU A1908 -25.832 0.744 -2.204 1.00 1.66 H new ATOM 1417 N ASN A1909 -24.124 -2.026 1.407 1.00 1.07 N ATOM 1418 CA ASN A1909 -23.831 -2.999 2.448 1.00 1.04 C ATOM 1419 C ASN A1909 -22.666 -2.511 3.295 1.00 0.92 C ATOM 1420 O ASN A1909 -21.581 -2.246 2.773 1.00 0.83 O ATOM 1421 CB ASN A1909 -23.496 -4.371 1.855 1.00 1.07 C ATOM 1422 CG ASN A1909 -24.662 -5.018 1.128 1.00 1.51 C ATOM 1423 OD1 ASN A1909 -25.823 -4.766 1.441 1.00 2.18 O ATOM 1424 ND2 ASN A1909 -24.356 -5.872 0.164 1.00 1.92 N ATOM 0 H ASN A1909 -23.530 -2.095 0.581 1.00 1.07 H new ATOM 0 HA ASN A1909 -24.721 -3.106 3.068 1.00 1.04 H new ATOM 0 HB2 ASN A1909 -22.661 -4.265 1.163 1.00 1.07 H new ATOM 0 HB3 ASN A1909 -23.165 -5.033 2.655 1.00 1.07 H new ATOM 0 HD21 ASN A1909 -25.097 -6.348 -0.350 1.00 1.92 H new ATOM 0 HD22 ASN A1909 -23.379 -6.054 -0.065 1.00 1.92 H new ATOM 1431 N GLU A1910 -22.893 -2.396 4.598 1.00 0.98 N ATOM 1432 CA GLU A1910 -21.852 -1.969 5.529 1.00 0.93 C ATOM 1433 C GLU A1910 -20.677 -2.942 5.476 1.00 0.79 C ATOM 1434 O GLU A1910 -19.516 -2.546 5.586 1.00 0.69 O ATOM 1435 CB GLU A1910 -22.416 -1.893 6.955 1.00 1.11 C ATOM 1436 CG GLU A1910 -21.413 -1.422 8.000 1.00 1.19 C ATOM 1437 CD GLU A1910 -21.030 0.039 7.846 1.00 1.53 C ATOM 1438 OE1 GLU A1910 -20.285 0.370 6.902 1.00 2.24 O ATOM 1439 OE2 GLU A1910 -21.459 0.860 8.685 1.00 1.92 O ATOM 0 H GLU A1910 -23.792 -2.593 5.037 1.00 0.98 H new ATOM 0 HA GLU A1910 -21.502 -0.978 5.240 1.00 0.93 H new ATOM 0 HB2 GLU A1910 -23.272 -1.218 6.959 1.00 1.11 H new ATOM 0 HB3 GLU A1910 -22.785 -2.878 7.240 1.00 1.11 H new ATOM 0 HG2 GLU A1910 -21.833 -1.578 8.994 1.00 1.19 H new ATOM 0 HG3 GLU A1910 -20.514 -2.035 7.934 1.00 1.19 H new ATOM 1446 N GLU A1911 -20.993 -4.219 5.288 1.00 0.82 N ATOM 1447 CA GLU A1911 -19.977 -5.259 5.182 1.00 0.74 C ATOM 1448 C GLU A1911 -19.083 -5.022 3.973 1.00 0.62 C ATOM 1449 O GLU A1911 -17.892 -5.315 4.017 1.00 0.53 O ATOM 1450 CB GLU A1911 -20.609 -6.647 5.076 1.00 0.87 C ATOM 1451 CG GLU A1911 -21.697 -6.912 6.103 1.00 1.06 C ATOM 1452 CD GLU A1911 -23.046 -6.379 5.662 1.00 1.80 C ATOM 1453 OE1 GLU A1911 -23.731 -7.070 4.880 1.00 2.49 O ATOM 1454 OE2 GLU A1911 -23.417 -5.260 6.072 1.00 2.32 O ATOM 0 H GLU A1911 -21.951 -4.560 5.206 1.00 0.82 H new ATOM 0 HA GLU A1911 -19.376 -5.214 6.090 1.00 0.74 H new ATOM 0 HB2 GLU A1911 -21.029 -6.768 4.078 1.00 0.87 H new ATOM 0 HB3 GLU A1911 -19.828 -7.400 5.187 1.00 0.87 H new ATOM 0 HG2 GLU A1911 -21.773 -7.985 6.280 1.00 1.06 H new ATOM 0 HG3 GLU A1911 -21.419 -6.451 7.051 1.00 1.06 H new ATOM 1461 N ILE A1912 -19.661 -4.497 2.896 1.00 0.68 N ATOM 1462 CA ILE A1912 -18.891 -4.169 1.704 1.00 0.63 C ATOM 1463 C ILE A1912 -17.929 -3.034 2.017 1.00 0.52 C ATOM 1464 O ILE A1912 -16.744 -3.105 1.696 1.00 0.49 O ATOM 1465 CB ILE A1912 -19.796 -3.762 0.517 1.00 0.73 C ATOM 1466 CG1 ILE A1912 -20.713 -4.922 0.114 1.00 0.89 C ATOM 1467 CG2 ILE A1912 -18.957 -3.311 -0.674 1.00 0.70 C ATOM 1468 CD1 ILE A1912 -19.974 -6.155 -0.357 1.00 0.83 C ATOM 0 H ILE A1912 -20.657 -4.291 2.826 1.00 0.68 H new ATOM 0 HA ILE A1912 -18.342 -5.064 1.411 1.00 0.63 H new ATOM 0 HB ILE A1912 -20.416 -2.925 0.837 1.00 0.73 H new ATOM 0 HG12 ILE A1912 -21.339 -5.189 0.965 1.00 0.89 H new ATOM 0 HG13 ILE A1912 -21.380 -4.585 -0.680 1.00 0.89 H new ATOM 0 HG21 ILE A1912 -19.615 -3.030 -1.497 1.00 0.70 H new ATOM 0 HG22 ILE A1912 -18.348 -2.454 -0.386 1.00 0.70 H new ATOM 0 HG23 ILE A1912 -18.308 -4.127 -0.991 1.00 0.70 H new ATOM 0 HD11 ILE A1912 -20.692 -6.930 -0.624 1.00 0.83 H new ATOM 0 HD12 ILE A1912 -19.369 -5.906 -1.229 1.00 0.83 H new ATOM 0 HD13 ILE A1912 -19.327 -6.519 0.441 1.00 0.83 H new ATOM 1480 N GLY A1913 -18.451 -2.001 2.670 1.00 0.51 N ATOM 1481 CA GLY A1913 -17.623 -0.888 3.084 1.00 0.45 C ATOM 1482 C GLY A1913 -16.518 -1.323 4.026 1.00 0.41 C ATOM 1483 O GLY A1913 -15.367 -0.912 3.878 1.00 0.38 O ATOM 0 H GLY A1913 -19.436 -1.917 2.920 1.00 0.51 H new ATOM 0 HA2 GLY A1913 -17.185 -0.415 2.205 1.00 0.45 H new ATOM 0 HA3 GLY A1913 -18.243 -0.137 3.574 1.00 0.45 H new ATOM 1487 N ALA A1914 -16.873 -2.165 4.991 1.00 0.44 N ATOM 1488 CA ALA A1914 -15.897 -2.736 5.909 1.00 0.41 C ATOM 1489 C ALA A1914 -14.855 -3.530 5.137 1.00 0.35 C ATOM 1490 O ALA A1914 -13.657 -3.426 5.391 1.00 0.37 O ATOM 1491 CB ALA A1914 -16.590 -3.635 6.924 1.00 0.46 C ATOM 0 H ALA A1914 -17.833 -2.467 5.157 1.00 0.44 H new ATOM 0 HA ALA A1914 -15.401 -1.924 6.440 1.00 0.41 H new ATOM 0 HB1 ALA A1914 -15.849 -4.055 7.604 1.00 0.46 H new ATOM 0 HB2 ALA A1914 -17.314 -3.051 7.492 1.00 0.46 H new ATOM 0 HB3 ALA A1914 -17.104 -4.443 6.403 1.00 0.46 H new ATOM 1497 N HIS A1915 -15.340 -4.294 4.171 1.00 0.35 N ATOM 1498 CA HIS A1915 -14.503 -5.158 3.357 1.00 0.36 C ATOM 1499 C HIS A1915 -13.491 -4.333 2.566 1.00 0.33 C ATOM 1500 O HIS A1915 -12.332 -4.720 2.436 1.00 0.39 O ATOM 1501 CB HIS A1915 -15.392 -5.975 2.413 1.00 0.48 C ATOM 1502 CG HIS A1915 -14.782 -7.257 1.948 1.00 0.68 C ATOM 1503 ND1 HIS A1915 -14.847 -7.691 0.643 1.00 1.39 N ATOM 1504 CD2 HIS A1915 -14.129 -8.223 2.633 1.00 1.00 C ATOM 1505 CE1 HIS A1915 -14.257 -8.867 0.544 1.00 1.62 C ATOM 1506 NE2 HIS A1915 -13.812 -9.213 1.737 1.00 1.37 N ATOM 0 H HIS A1915 -16.330 -4.332 3.929 1.00 0.35 H new ATOM 0 HA HIS A1915 -13.947 -5.837 4.004 1.00 0.36 H new ATOM 0 HB2 HIS A1915 -16.332 -6.196 2.919 1.00 0.48 H new ATOM 0 HB3 HIS A1915 -15.634 -5.365 1.543 1.00 0.48 H new ATOM 0 HD2 HIS A1915 -13.900 -8.217 3.688 1.00 1.00 H new ATOM 0 HE1 HIS A1915 -14.155 -9.448 -0.361 1.00 1.62 H new ATOM 0 HE2 HIS A1915 -13.314 -10.075 1.957 1.00 1.37 H new ATOM 1515 N ILE A1916 -13.936 -3.189 2.048 1.00 0.30 N ATOM 1516 CA ILE A1916 -13.062 -2.278 1.320 1.00 0.29 C ATOM 1517 C ILE A1916 -11.945 -1.761 2.223 1.00 0.29 C ATOM 1518 O ILE A1916 -10.762 -1.928 1.923 1.00 0.32 O ATOM 1519 CB ILE A1916 -13.861 -1.076 0.762 1.00 0.31 C ATOM 1520 CG1 ILE A1916 -14.877 -1.549 -0.281 1.00 0.35 C ATOM 1521 CG2 ILE A1916 -12.928 -0.030 0.166 1.00 0.35 C ATOM 1522 CD1 ILE A1916 -15.806 -0.455 -0.762 1.00 0.40 C ATOM 0 H ILE A1916 -14.903 -2.872 2.121 1.00 0.30 H new ATOM 0 HA ILE A1916 -12.626 -2.835 0.491 1.00 0.29 H new ATOM 0 HB ILE A1916 -14.401 -0.613 1.588 1.00 0.31 H new ATOM 0 HG12 ILE A1916 -14.342 -1.962 -1.136 1.00 0.35 H new ATOM 0 HG13 ILE A1916 -15.471 -2.358 0.144 1.00 0.35 H new ATOM 0 HG21 ILE A1916 -13.515 0.804 -0.219 1.00 0.35 H new ATOM 0 HG22 ILE A1916 -12.247 0.331 0.936 1.00 0.35 H new ATOM 0 HG23 ILE A1916 -12.354 -0.475 -0.647 1.00 0.35 H new ATOM 0 HD11 ILE A1916 -16.498 -0.863 -1.499 1.00 0.40 H new ATOM 0 HD12 ILE A1916 -16.368 -0.058 0.083 1.00 0.40 H new ATOM 0 HD13 ILE A1916 -15.222 0.345 -1.217 1.00 0.40 H new ATOM 1534 N LYS A1917 -12.334 -1.174 3.350 1.00 0.28 N ATOM 1535 CA LYS A1917 -11.380 -0.565 4.272 1.00 0.32 C ATOM 1536 C LYS A1917 -10.405 -1.601 4.813 1.00 0.30 C ATOM 1537 O LYS A1917 -9.195 -1.380 4.833 1.00 0.34 O ATOM 1538 CB LYS A1917 -12.117 0.084 5.441 1.00 0.39 C ATOM 1539 CG LYS A1917 -13.159 1.103 5.023 1.00 1.04 C ATOM 1540 CD LYS A1917 -13.907 1.652 6.227 1.00 0.97 C ATOM 1541 CE LYS A1917 -14.634 0.544 6.972 1.00 0.97 C ATOM 1542 NZ LYS A1917 -15.363 1.047 8.165 1.00 1.36 N ATOM 0 H LYS A1917 -13.307 -1.107 3.648 1.00 0.28 H new ATOM 0 HA LYS A1917 -10.822 0.192 3.721 1.00 0.32 H new ATOM 0 HB2 LYS A1917 -12.601 -0.695 6.030 1.00 0.39 H new ATOM 0 HB3 LYS A1917 -11.389 0.569 6.092 1.00 0.39 H new ATOM 0 HG2 LYS A1917 -12.677 1.921 4.487 1.00 1.04 H new ATOM 0 HG3 LYS A1917 -13.865 0.642 4.332 1.00 1.04 H new ATOM 0 HD2 LYS A1917 -13.206 2.147 6.899 1.00 0.97 H new ATOM 0 HD3 LYS A1917 -14.623 2.406 5.901 1.00 0.97 H new ATOM 0 HE2 LYS A1917 -15.339 0.058 6.297 1.00 0.97 H new ATOM 0 HE3 LYS A1917 -13.915 -0.214 7.282 1.00 0.97 H new ATOM 0 HZ1 LYS A1917 -15.842 0.255 8.639 1.00 1.36 H new ATOM 0 HZ2 LYS A1917 -14.689 1.488 8.823 1.00 1.36 H new ATOM 0 HZ3 LYS A1917 -16.069 1.751 7.869 1.00 1.36 H new ATOM 1556 N HIS A1918 -10.944 -2.738 5.227 1.00 0.28 N ATOM 1557 CA HIS A1918 -10.156 -3.783 5.871 1.00 0.29 C ATOM 1558 C HIS A1918 -9.132 -4.395 4.921 1.00 0.27 C ATOM 1559 O HIS A1918 -8.076 -4.851 5.357 1.00 0.30 O ATOM 1560 CB HIS A1918 -11.077 -4.865 6.432 1.00 0.34 C ATOM 1561 CG HIS A1918 -11.624 -4.544 7.792 1.00 0.79 C ATOM 1562 ND1 HIS A1918 -11.518 -5.400 8.866 1.00 1.50 N ATOM 1563 CD2 HIS A1918 -12.291 -3.458 8.247 1.00 1.25 C ATOM 1564 CE1 HIS A1918 -12.094 -4.855 9.920 1.00 1.91 C ATOM 1565 NE2 HIS A1918 -12.569 -3.677 9.571 1.00 1.73 N ATOM 0 H HIS A1918 -11.934 -2.963 5.128 1.00 0.28 H new ATOM 0 HA HIS A1918 -9.603 -3.322 6.689 1.00 0.29 H new ATOM 0 HB2 HIS A1918 -11.907 -5.017 5.742 1.00 0.34 H new ATOM 0 HB3 HIS A1918 -10.529 -5.806 6.483 1.00 0.34 H new ATOM 0 HD2 HIS A1918 -12.555 -2.582 7.673 1.00 1.25 H new ATOM 0 HE1 HIS A1918 -12.164 -5.299 10.902 1.00 1.91 H new ATOM 0 HE2 HIS A1918 -13.064 -3.032 10.187 1.00 1.73 H new ATOM 1574 N ARG A1919 -9.430 -4.405 3.628 1.00 0.26 N ATOM 1575 CA ARG A1919 -8.480 -4.921 2.649 1.00 0.29 C ATOM 1576 C ARG A1919 -7.394 -3.896 2.354 1.00 0.27 C ATOM 1577 O ARG A1919 -6.275 -4.253 1.988 1.00 0.31 O ATOM 1578 CB ARG A1919 -9.186 -5.359 1.366 1.00 0.35 C ATOM 1579 CG ARG A1919 -10.054 -6.591 1.556 1.00 0.44 C ATOM 1580 CD ARG A1919 -9.268 -7.733 2.186 1.00 0.49 C ATOM 1581 NE ARG A1919 -10.100 -8.906 2.427 1.00 1.24 N ATOM 1582 CZ ARG A1919 -10.201 -9.511 3.611 1.00 1.57 C ATOM 1583 NH1 ARG A1919 -9.535 -9.041 4.661 1.00 1.50 N ATOM 1584 NH2 ARG A1919 -10.970 -10.581 3.745 1.00 2.55 N ATOM 0 H ARG A1919 -10.309 -4.067 3.236 1.00 0.26 H new ATOM 0 HA ARG A1919 -8.004 -5.802 3.080 1.00 0.29 H new ATOM 0 HB2 ARG A1919 -9.804 -4.539 1.000 1.00 0.35 H new ATOM 0 HB3 ARG A1919 -8.439 -5.562 0.598 1.00 0.35 H new ATOM 0 HG2 ARG A1919 -10.907 -6.343 2.187 1.00 0.44 H new ATOM 0 HG3 ARG A1919 -10.452 -6.909 0.593 1.00 0.44 H new ATOM 0 HD2 ARG A1919 -8.439 -8.005 1.533 1.00 0.49 H new ATOM 0 HD3 ARG A1919 -8.834 -7.397 3.128 1.00 0.49 H new ATOM 0 HE ARG A1919 -10.635 -9.285 1.646 1.00 1.24 H new ATOM 0 HH11 ARG A1919 -8.945 -8.215 4.562 1.00 1.50 H new ATOM 0 HH12 ARG A1919 -9.614 -9.506 5.565 1.00 1.50 H new ATOM 0 HH21 ARG A1919 -11.485 -10.943 2.942 1.00 2.55 H new ATOM 0 HH22 ARG A1919 -11.047 -11.044 4.651 1.00 2.55 H new ATOM 1598 N VAL A1920 -7.714 -2.626 2.531 1.00 0.25 N ATOM 1599 CA VAL A1920 -6.711 -1.580 2.423 1.00 0.27 C ATOM 1600 C VAL A1920 -5.791 -1.635 3.645 1.00 0.29 C ATOM 1601 O VAL A1920 -4.601 -1.323 3.566 1.00 0.35 O ATOM 1602 CB VAL A1920 -7.360 -0.184 2.298 1.00 0.27 C ATOM 1603 CG1 VAL A1920 -6.306 0.898 2.144 1.00 0.31 C ATOM 1604 CG2 VAL A1920 -8.326 -0.146 1.123 1.00 0.28 C ATOM 0 H VAL A1920 -8.654 -2.295 2.749 1.00 0.25 H new ATOM 0 HA VAL A1920 -6.128 -1.749 1.517 1.00 0.27 H new ATOM 0 HB VAL A1920 -7.915 0.008 3.216 1.00 0.27 H new ATOM 0 HG11 VAL A1920 -6.792 1.870 2.058 1.00 0.31 H new ATOM 0 HG12 VAL A1920 -5.652 0.895 3.016 1.00 0.31 H new ATOM 0 HG13 VAL A1920 -5.717 0.707 1.247 1.00 0.31 H new ATOM 0 HG21 VAL A1920 -8.773 0.846 1.051 1.00 0.28 H new ATOM 0 HG22 VAL A1920 -7.787 -0.369 0.202 1.00 0.28 H new ATOM 0 HG23 VAL A1920 -9.111 -0.888 1.273 1.00 0.28 H new ATOM 1614 N GLN A1921 -6.352 -2.072 4.770 1.00 0.26 N ATOM 1615 CA GLN A1921 -5.578 -2.286 5.993 1.00 0.27 C ATOM 1616 C GLN A1921 -4.520 -3.367 5.762 1.00 0.25 C ATOM 1617 O GLN A1921 -3.445 -3.337 6.364 1.00 0.25 O ATOM 1618 CB GLN A1921 -6.494 -2.714 7.140 1.00 0.32 C ATOM 1619 CG GLN A1921 -7.643 -1.758 7.412 1.00 0.39 C ATOM 1620 CD GLN A1921 -7.228 -0.526 8.179 1.00 0.62 C ATOM 1621 OE1 GLN A1921 -6.896 0.534 7.462 1.00 1.22 O flip ATOM 1622 NE2 GLN A1921 -7.226 -0.522 9.408 1.00 0.65 N flip ATOM 0 H GLN A1921 -7.345 -2.286 4.861 1.00 0.26 H new ATOM 0 HA GLN A1921 -5.090 -1.348 6.257 1.00 0.27 H new ATOM 0 HB2 GLN A1921 -6.902 -3.699 6.915 1.00 0.32 H new ATOM 0 HB3 GLN A1921 -5.898 -2.815 8.047 1.00 0.32 H new ATOM 0 HG2 GLN A1921 -8.086 -1.455 6.463 1.00 0.39 H new ATOM 0 HG3 GLN A1921 -8.417 -2.282 7.972 1.00 0.39 H new ATOM 0 HE21 GLN A1921 -7.490 -1.363 9.921 1.00 0.65 H new ATOM 0 HE22 GLN A1921 -6.961 0.323 9.915 1.00 0.65 H new ATOM 1631 N GLU A1922 -4.842 -4.319 4.886 1.00 0.29 N ATOM 1632 CA GLU A1922 -3.912 -5.380 4.514 1.00 0.31 C ATOM 1633 C GLU A1922 -2.618 -4.784 3.971 1.00 0.32 C ATOM 1634 O GLU A1922 -1.522 -5.123 4.429 1.00 0.35 O ATOM 1635 CB GLU A1922 -4.537 -6.296 3.459 1.00 0.36 C ATOM 1636 CG GLU A1922 -5.821 -6.976 3.905 1.00 0.43 C ATOM 1637 CD GLU A1922 -5.608 -7.939 5.051 1.00 0.81 C ATOM 1638 OE1 GLU A1922 -5.252 -9.108 4.793 1.00 1.04 O ATOM 1639 OE2 GLU A1922 -5.799 -7.538 6.212 1.00 1.49 O ATOM 0 H GLU A1922 -5.747 -4.375 4.419 1.00 0.29 H new ATOM 0 HA GLU A1922 -3.690 -5.966 5.406 1.00 0.31 H new ATOM 0 HB2 GLU A1922 -4.741 -5.711 2.562 1.00 0.36 H new ATOM 0 HB3 GLU A1922 -3.811 -7.061 3.182 1.00 0.36 H new ATOM 0 HG2 GLU A1922 -6.544 -6.217 4.204 1.00 0.43 H new ATOM 0 HG3 GLU A1922 -6.254 -7.513 3.061 1.00 0.43 H new ATOM 1646 N LEU A1923 -2.748 -3.880 3.004 1.00 0.34 N ATOM 1647 CA LEU A1923 -1.587 -3.205 2.439 1.00 0.41 C ATOM 1648 C LEU A1923 -1.006 -2.253 3.470 1.00 0.36 C ATOM 1649 O LEU A1923 0.177 -1.950 3.449 1.00 0.47 O ATOM 1650 CB LEU A1923 -1.949 -2.424 1.176 1.00 0.49 C ATOM 1651 CG LEU A1923 -2.874 -3.146 0.193 1.00 0.37 C ATOM 1652 CD1 LEU A1923 -3.344 -2.192 -0.893 1.00 0.67 C ATOM 1653 CD2 LEU A1923 -2.158 -4.338 -0.423 1.00 0.65 C ATOM 0 H LEU A1923 -3.641 -3.600 2.598 1.00 0.34 H new ATOM 0 HA LEU A1923 -0.854 -3.965 2.168 1.00 0.41 H new ATOM 0 HB2 LEU A1923 -2.423 -1.488 1.473 1.00 0.49 H new ATOM 0 HB3 LEU A1923 -1.028 -2.163 0.655 1.00 0.49 H new ATOM 0 HG LEU A1923 -3.747 -3.506 0.737 1.00 0.37 H new ATOM 0 HD11 LEU A1923 -4.001 -2.722 -1.583 1.00 0.67 H new ATOM 0 HD12 LEU A1923 -3.887 -1.363 -0.439 1.00 0.67 H new ATOM 0 HD13 LEU A1923 -2.482 -1.806 -1.437 1.00 0.67 H new ATOM 0 HD21 LEU A1923 -2.826 -4.843 -1.120 1.00 0.65 H new ATOM 0 HD22 LEU A1923 -1.271 -3.994 -0.955 1.00 0.65 H new ATOM 0 HD23 LEU A1923 -1.863 -5.032 0.364 1.00 0.65 H new ATOM 1665 N GLY A1924 -1.851 -1.797 4.382 1.00 0.28 N ATOM 1666 CA GLY A1924 -1.404 -0.906 5.432 1.00 0.33 C ATOM 1667 C GLY A1924 -0.267 -1.491 6.237 1.00 0.38 C ATOM 1668 O GLY A1924 0.590 -0.768 6.727 1.00 0.64 O ATOM 0 H GLY A1924 -2.844 -2.030 4.413 1.00 0.28 H new ATOM 0 HA2 GLY A1924 -1.086 0.039 4.992 1.00 0.33 H new ATOM 0 HA3 GLY A1924 -2.239 -0.683 6.096 1.00 0.33 H new ATOM 1672 N HIS A1925 -0.257 -2.807 6.373 1.00 0.24 N ATOM 1673 CA HIS A1925 0.815 -3.476 7.092 1.00 0.28 C ATOM 1674 C HIS A1925 1.841 -4.039 6.118 1.00 0.24 C ATOM 1675 O HIS A1925 3.044 -3.970 6.364 1.00 0.32 O ATOM 1676 CB HIS A1925 0.261 -4.589 7.980 1.00 0.34 C ATOM 1677 CG HIS A1925 -0.685 -4.102 9.032 1.00 0.44 C ATOM 1678 ND1 HIS A1925 -0.284 -3.375 10.132 1.00 0.62 N ATOM 1679 CD2 HIS A1925 -2.027 -4.235 9.140 1.00 0.53 C ATOM 1680 CE1 HIS A1925 -1.338 -3.083 10.869 1.00 0.69 C ATOM 1681 NE2 HIS A1925 -2.407 -3.593 10.290 1.00 0.62 N ATOM 0 H HIS A1925 -0.973 -3.429 5.998 1.00 0.24 H new ATOM 0 HA HIS A1925 1.306 -2.741 7.729 1.00 0.28 H new ATOM 0 HB2 HIS A1925 -0.250 -5.321 7.354 1.00 0.34 H new ATOM 0 HB3 HIS A1925 1.091 -5.106 8.461 1.00 0.34 H new ATOM 0 HD2 HIS A1925 -2.677 -4.751 8.449 1.00 0.53 H new ATOM 0 HE1 HIS A1925 -1.327 -2.521 11.791 1.00 0.69 H new ATOM 0 HE2 HIS A1925 -3.362 -3.521 10.641 1.00 0.62 H new ATOM 1690 N GLY A1926 1.359 -4.580 5.001 1.00 0.23 N ATOM 1691 CA GLY A1926 2.249 -5.159 4.009 1.00 0.25 C ATOM 1692 C GLY A1926 3.100 -4.114 3.312 1.00 0.23 C ATOM 1693 O GLY A1926 4.324 -4.230 3.267 1.00 0.25 O ATOM 0 H GLY A1926 0.368 -4.627 4.766 1.00 0.23 H new ATOM 0 HA2 GLY A1926 2.899 -5.890 4.491 1.00 0.25 H new ATOM 0 HA3 GLY A1926 1.660 -5.697 3.267 1.00 0.25 H new ATOM 1697 N CYS A1927 2.447 -3.090 2.777 1.00 0.22 N ATOM 1698 CA CYS A1927 3.133 -2.005 2.090 1.00 0.24 C ATOM 1699 C CYS A1927 4.022 -1.237 3.064 1.00 0.23 C ATOM 1700 O CYS A1927 5.103 -0.775 2.700 1.00 0.26 O ATOM 1701 CB CYS A1927 2.105 -1.071 1.437 1.00 0.31 C ATOM 1702 SG CYS A1927 1.172 -1.833 0.091 1.00 1.22 S ATOM 0 H CYS A1927 1.432 -2.989 2.807 1.00 0.22 H new ATOM 0 HA CYS A1927 3.769 -2.423 1.310 1.00 0.24 H new ATOM 0 HB2 CYS A1927 1.407 -0.726 2.200 1.00 0.31 H new ATOM 0 HB3 CYS A1927 2.621 -0.190 1.055 1.00 0.31 H new ATOM 0 HG CYS A1927 0.217 -1.033 -0.282 1.00 1.22 H new ATOM 1708 N SER A1928 3.564 -1.124 4.309 1.00 0.23 N ATOM 1709 CA SER A1928 4.351 -0.502 5.367 1.00 0.25 C ATOM 1710 C SER A1928 5.649 -1.273 5.567 1.00 0.25 C ATOM 1711 O SER A1928 6.743 -0.702 5.571 1.00 0.29 O ATOM 1712 CB SER A1928 3.555 -0.489 6.675 1.00 0.28 C ATOM 1713 OG SER A1928 4.189 0.296 7.666 1.00 1.03 O ATOM 0 H SER A1928 2.648 -1.457 4.609 1.00 0.23 H new ATOM 0 HA SER A1928 4.581 0.524 5.079 1.00 0.25 H new ATOM 0 HB2 SER A1928 2.554 -0.100 6.488 1.00 0.28 H new ATOM 0 HB3 SER A1928 3.437 -1.510 7.039 1.00 0.28 H new ATOM 0 HG SER A1928 3.653 0.283 8.486 1.00 1.03 H new ATOM 1719 N ALA A1929 5.514 -2.587 5.705 1.00 0.23 N ATOM 1720 CA ALA A1929 6.657 -3.462 5.906 1.00 0.25 C ATOM 1721 C ALA A1929 7.590 -3.419 4.703 1.00 0.25 C ATOM 1722 O ALA A1929 8.811 -3.433 4.847 1.00 0.28 O ATOM 1723 CB ALA A1929 6.191 -4.886 6.156 1.00 0.27 C ATOM 0 H ALA A1929 4.616 -3.070 5.681 1.00 0.23 H new ATOM 0 HA ALA A1929 7.207 -3.111 6.779 1.00 0.25 H new ATOM 0 HB1 ALA A1929 7.057 -5.531 6.305 1.00 0.27 H new ATOM 0 HB2 ALA A1929 5.562 -4.912 7.046 1.00 0.27 H new ATOM 0 HB3 ALA A1929 5.620 -5.238 5.297 1.00 0.27 H new ATOM 1729 N LEU A1930 7.000 -3.357 3.519 1.00 0.21 N ATOM 1730 CA LEU A1930 7.757 -3.329 2.277 1.00 0.21 C ATOM 1731 C LEU A1930 8.663 -2.102 2.216 1.00 0.21 C ATOM 1732 O LEU A1930 9.870 -2.219 1.988 1.00 0.22 O ATOM 1733 CB LEU A1930 6.797 -3.320 1.085 1.00 0.21 C ATOM 1734 CG LEU A1930 7.086 -4.355 -0.004 1.00 0.24 C ATOM 1735 CD1 LEU A1930 6.115 -4.185 -1.157 1.00 0.26 C ATOM 1736 CD2 LEU A1930 8.519 -4.246 -0.499 1.00 0.28 C ATOM 0 H LEU A1930 5.988 -3.325 3.392 1.00 0.21 H new ATOM 0 HA LEU A1930 8.382 -4.221 2.238 1.00 0.21 H new ATOM 0 HB2 LEU A1930 5.785 -3.482 1.455 1.00 0.21 H new ATOM 0 HB3 LEU A1930 6.817 -2.328 0.633 1.00 0.21 H new ATOM 0 HG LEU A1930 6.955 -5.347 0.427 1.00 0.24 H new ATOM 0 HD11 LEU A1930 6.330 -4.927 -1.926 1.00 0.26 H new ATOM 0 HD12 LEU A1930 5.095 -4.321 -0.797 1.00 0.26 H new ATOM 0 HD13 LEU A1930 6.221 -3.185 -1.578 1.00 0.26 H new ATOM 0 HD21 LEU A1930 8.695 -4.994 -1.272 1.00 0.28 H new ATOM 0 HD22 LEU A1930 8.687 -3.251 -0.912 1.00 0.28 H new ATOM 0 HD23 LEU A1930 9.205 -4.415 0.331 1.00 0.28 H new ATOM 1748 N VAL A1931 8.084 -0.929 2.437 1.00 0.21 N ATOM 1749 CA VAL A1931 8.823 0.319 2.299 1.00 0.22 C ATOM 1750 C VAL A1931 9.872 0.480 3.400 1.00 0.24 C ATOM 1751 O VAL A1931 10.943 1.044 3.166 1.00 0.26 O ATOM 1752 CB VAL A1931 7.887 1.552 2.275 1.00 0.23 C ATOM 1753 CG1 VAL A1931 6.883 1.440 1.138 1.00 0.24 C ATOM 1754 CG2 VAL A1931 7.167 1.735 3.604 1.00 0.25 C ATOM 0 H VAL A1931 7.108 -0.816 2.712 1.00 0.21 H new ATOM 0 HA VAL A1931 9.335 0.265 1.338 1.00 0.22 H new ATOM 0 HB VAL A1931 8.508 2.433 2.110 1.00 0.23 H new ATOM 0 HG11 VAL A1931 6.234 2.316 1.138 1.00 0.24 H new ATOM 0 HG12 VAL A1931 7.414 1.382 0.188 1.00 0.24 H new ATOM 0 HG13 VAL A1931 6.280 0.542 1.272 1.00 0.24 H new ATOM 0 HG21 VAL A1931 6.519 2.610 3.549 1.00 0.25 H new ATOM 0 HG22 VAL A1931 6.566 0.851 3.817 1.00 0.25 H new ATOM 0 HG23 VAL A1931 7.900 1.875 4.399 1.00 0.25 H new ATOM 1764 N THR A1932 9.584 -0.034 4.593 1.00 0.25 N ATOM 1765 CA THR A1932 10.514 0.098 5.703 1.00 0.27 C ATOM 1766 C THR A1932 11.648 -0.922 5.586 1.00 0.25 C ATOM 1767 O THR A1932 12.767 -0.674 6.044 1.00 0.28 O ATOM 1768 CB THR A1932 9.811 -0.043 7.080 1.00 0.34 C ATOM 1769 OG1 THR A1932 10.705 0.357 8.128 1.00 0.80 O ATOM 1770 CG2 THR A1932 9.349 -1.471 7.337 1.00 0.65 C ATOM 0 H THR A1932 8.725 -0.539 4.811 1.00 0.25 H new ATOM 0 HA THR A1932 10.930 1.104 5.647 1.00 0.27 H new ATOM 0 HB THR A1932 8.933 0.603 7.066 1.00 0.34 H new ATOM 0 HG1 THR A1932 10.255 0.267 8.994 1.00 0.80 H new ATOM 0 HG21 THR A1932 8.862 -1.526 8.311 1.00 0.65 H new ATOM 0 HG22 THR A1932 8.644 -1.770 6.561 1.00 0.65 H new ATOM 0 HG23 THR A1932 10.210 -2.140 7.323 1.00 0.65 H new ATOM 1778 N LYS A1933 11.369 -2.058 4.954 1.00 0.25 N ATOM 1779 CA LYS A1933 12.372 -3.100 4.797 1.00 0.26 C ATOM 1780 C LYS A1933 13.376 -2.696 3.726 1.00 0.23 C ATOM 1781 O LYS A1933 14.557 -3.039 3.803 1.00 0.25 O ATOM 1782 CB LYS A1933 11.715 -4.433 4.438 1.00 0.30 C ATOM 1783 CG LYS A1933 12.568 -5.643 4.781 1.00 0.44 C ATOM 1784 CD LYS A1933 12.891 -5.679 6.268 1.00 0.85 C ATOM 1785 CE LYS A1933 13.673 -6.925 6.649 1.00 1.24 C ATOM 1786 NZ LYS A1933 14.002 -6.950 8.098 1.00 1.27 N ATOM 0 H LYS A1933 10.461 -2.278 4.545 1.00 0.25 H new ATOM 0 HA LYS A1933 12.897 -3.225 5.744 1.00 0.26 H new ATOM 0 HB2 LYS A1933 10.762 -4.511 4.960 1.00 0.30 H new ATOM 0 HB3 LYS A1933 11.495 -4.444 3.370 1.00 0.30 H new ATOM 0 HG2 LYS A1933 12.043 -6.555 4.497 1.00 0.44 H new ATOM 0 HG3 LYS A1933 13.493 -5.615 4.205 1.00 0.44 H new ATOM 0 HD2 LYS A1933 13.467 -4.793 6.536 1.00 0.85 H new ATOM 0 HD3 LYS A1933 11.965 -5.642 6.841 1.00 0.85 H new ATOM 0 HE2 LYS A1933 13.092 -7.811 6.393 1.00 1.24 H new ATOM 0 HE3 LYS A1933 14.593 -6.968 6.067 1.00 1.24 H new ATOM 0 HZ1 LYS A1933 14.535 -7.815 8.318 1.00 1.27 H new ATOM 0 HZ2 LYS A1933 14.578 -6.118 8.338 1.00 1.27 H new ATOM 0 HZ3 LYS A1933 13.123 -6.934 8.654 1.00 1.27 H new ATOM 1800 N ALA A1934 12.897 -1.952 2.732 1.00 0.21 N ATOM 1801 CA ALA A1934 13.764 -1.395 1.702 1.00 0.22 C ATOM 1802 C ALA A1934 14.808 -0.469 2.319 1.00 0.27 C ATOM 1803 O ALA A1934 15.918 -0.338 1.801 1.00 0.30 O ATOM 1804 CB ALA A1934 12.940 -0.650 0.659 1.00 0.24 C ATOM 0 H ALA A1934 11.910 -1.722 2.620 1.00 0.21 H new ATOM 0 HA ALA A1934 14.284 -2.217 1.210 1.00 0.22 H new ATOM 0 HB1 ALA A1934 13.603 -0.240 -0.103 1.00 0.24 H new ATOM 0 HB2 ALA A1934 12.234 -1.338 0.194 1.00 0.24 H new ATOM 0 HB3 ALA A1934 12.393 0.162 1.139 1.00 0.24 H new ATOM 1810 N GLY A1935 14.445 0.163 3.433 1.00 0.31 N ATOM 1811 CA GLY A1935 15.379 0.998 4.163 1.00 0.38 C ATOM 1812 C GLY A1935 16.622 0.241 4.579 1.00 0.38 C ATOM 1813 O GLY A1935 17.736 0.762 4.495 1.00 0.40 O ATOM 0 H GLY A1935 13.513 0.109 3.844 1.00 0.31 H new ATOM 0 HA2 GLY A1935 15.664 1.848 3.543 1.00 0.38 H new ATOM 0 HA3 GLY A1935 14.888 1.400 5.049 1.00 0.38 H new ATOM 1817 N ALA A1936 16.432 -0.992 5.019 1.00 0.39 N ATOM 1818 CA ALA A1936 17.544 -1.833 5.429 1.00 0.44 C ATOM 1819 C ALA A1936 18.225 -2.457 4.219 1.00 0.41 C ATOM 1820 O ALA A1936 19.430 -2.699 4.232 1.00 0.46 O ATOM 1821 CB ALA A1936 17.064 -2.911 6.385 1.00 0.50 C ATOM 0 H ALA A1936 15.516 -1.433 5.101 1.00 0.39 H new ATOM 0 HA ALA A1936 18.274 -1.210 5.945 1.00 0.44 H new ATOM 0 HB1 ALA A1936 17.907 -3.534 6.684 1.00 0.50 H new ATOM 0 HB2 ALA A1936 16.626 -2.446 7.268 1.00 0.50 H new ATOM 0 HB3 ALA A1936 16.314 -3.529 5.890 1.00 0.50 H new ATOM 1827 N LEU A1937 17.454 -2.685 3.161 1.00 0.35 N ATOM 1828 CA LEU A1937 17.980 -3.324 1.961 1.00 0.34 C ATOM 1829 C LEU A1937 18.933 -2.375 1.249 1.00 0.35 C ATOM 1830 O LEU A1937 19.899 -2.798 0.640 1.00 0.41 O ATOM 1831 CB LEU A1937 16.833 -3.756 1.031 1.00 0.31 C ATOM 1832 CG LEU A1937 17.187 -4.808 -0.038 1.00 0.32 C ATOM 1833 CD1 LEU A1937 17.902 -4.187 -1.229 1.00 0.33 C ATOM 1834 CD2 LEU A1937 18.040 -5.913 0.567 1.00 0.37 C ATOM 0 H LEU A1937 16.466 -2.438 3.110 1.00 0.35 H new ATOM 0 HA LEU A1937 18.531 -4.220 2.247 1.00 0.34 H new ATOM 0 HB2 LEU A1937 16.023 -4.150 1.645 1.00 0.31 H new ATOM 0 HB3 LEU A1937 16.448 -2.870 0.526 1.00 0.31 H new ATOM 0 HG LEU A1937 16.251 -5.234 -0.399 1.00 0.32 H new ATOM 0 HD11 LEU A1937 18.134 -4.962 -1.959 1.00 0.33 H new ATOM 0 HD12 LEU A1937 17.259 -3.436 -1.689 1.00 0.33 H new ATOM 0 HD13 LEU A1937 18.826 -3.717 -0.894 1.00 0.33 H new ATOM 0 HD21 LEU A1937 18.281 -6.648 -0.201 1.00 0.37 H new ATOM 0 HD22 LEU A1937 18.961 -5.486 0.963 1.00 0.37 H new ATOM 0 HD23 LEU A1937 17.489 -6.398 1.373 1.00 0.37 H new ATOM 1846 N GLN A1938 18.661 -1.088 1.333 1.00 0.33 N ATOM 1847 CA GLN A1938 19.560 -0.098 0.766 1.00 0.36 C ATOM 1848 C GLN A1938 20.771 0.122 1.662 1.00 0.43 C ATOM 1849 O GLN A1938 21.832 0.540 1.201 1.00 0.47 O ATOM 1850 CB GLN A1938 18.831 1.209 0.511 1.00 0.36 C ATOM 1851 CG GLN A1938 17.853 1.112 -0.641 1.00 0.35 C ATOM 1852 CD GLN A1938 17.335 2.468 -1.076 1.00 0.50 C ATOM 1853 OE1 GLN A1938 18.020 3.479 -0.948 1.00 1.06 O ATOM 1854 NE2 GLN A1938 16.123 2.499 -1.603 1.00 0.95 N ATOM 0 H GLN A1938 17.831 -0.703 1.785 1.00 0.33 H new ATOM 0 HA GLN A1938 19.918 -0.480 -0.190 1.00 0.36 H new ATOM 0 HB2 GLN A1938 18.296 1.505 1.413 1.00 0.36 H new ATOM 0 HB3 GLN A1938 19.559 1.992 0.300 1.00 0.36 H new ATOM 0 HG2 GLN A1938 18.339 0.624 -1.486 1.00 0.35 H new ATOM 0 HG3 GLN A1938 17.013 0.482 -0.349 1.00 0.35 H new ATOM 0 HE21 GLN A1938 15.584 1.638 -1.693 1.00 0.95 H new ATOM 0 HE22 GLN A1938 15.727 3.384 -1.920 1.00 0.95 H new ATOM 1863 N CYS A1939 20.601 -0.152 2.946 1.00 0.46 N ATOM 1864 CA CYS A1939 21.692 -0.040 3.899 1.00 0.54 C ATOM 1865 C CYS A1939 22.628 -1.237 3.750 1.00 0.56 C ATOM 1866 O CYS A1939 23.826 -1.150 4.026 1.00 0.66 O ATOM 1867 CB CYS A1939 21.146 0.034 5.326 1.00 0.56 C ATOM 1868 SG CYS A1939 22.377 0.497 6.565 1.00 1.43 S ATOM 0 H CYS A1939 19.715 -0.454 3.352 1.00 0.46 H new ATOM 0 HA CYS A1939 22.249 0.875 3.697 1.00 0.54 H new ATOM 0 HB2 CYS A1939 20.329 0.755 5.354 1.00 0.56 H new ATOM 0 HB3 CYS A1939 20.725 -0.935 5.593 1.00 0.56 H new ATOM 0 HG CYS A1939 21.819 0.534 7.738 1.00 1.43 H new ATOM 1874 N SER A1940 22.068 -2.358 3.319 1.00 0.53 N ATOM 1875 CA SER A1940 22.843 -3.558 3.061 1.00 0.58 C ATOM 1876 C SER A1940 22.241 -4.322 1.883 1.00 0.53 C ATOM 1877 O SER A1940 21.535 -5.313 2.066 1.00 0.56 O ATOM 1878 CB SER A1940 22.883 -4.441 4.314 1.00 0.69 C ATOM 1879 OG SER A1940 23.381 -3.714 5.429 1.00 0.80 O ATOM 0 H SER A1940 21.069 -2.459 3.140 1.00 0.53 H new ATOM 0 HA SER A1940 23.865 -3.276 2.807 1.00 0.58 H new ATOM 0 HB2 SER A1940 21.882 -4.813 4.534 1.00 0.69 H new ATOM 0 HB3 SER A1940 23.513 -5.311 4.131 1.00 0.69 H new ATOM 0 HG SER A1940 23.397 -4.295 6.218 1.00 0.80 H new ATOM 1885 N PRO A1941 22.494 -3.844 0.651 1.00 0.49 N ATOM 1886 CA PRO A1941 21.907 -4.423 -0.569 1.00 0.47 C ATOM 1887 C PRO A1941 22.381 -5.850 -0.830 1.00 0.57 C ATOM 1888 O PRO A1941 21.760 -6.600 -1.586 1.00 0.69 O ATOM 1889 CB PRO A1941 22.391 -3.492 -1.681 1.00 0.47 C ATOM 1890 CG PRO A1941 23.591 -2.808 -1.123 1.00 0.58 C ATOM 1891 CD PRO A1941 23.349 -2.685 0.352 1.00 0.52 C ATOM 0 HA PRO A1941 20.822 -4.494 -0.495 1.00 0.47 H new ATOM 0 HB2 PRO A1941 22.640 -4.052 -2.582 1.00 0.47 H new ATOM 0 HB3 PRO A1941 21.620 -2.772 -1.956 1.00 0.47 H new ATOM 0 HG2 PRO A1941 24.496 -3.382 -1.323 1.00 0.58 H new ATOM 0 HG3 PRO A1941 23.728 -1.827 -1.579 1.00 0.58 H new ATOM 0 HD2 PRO A1941 24.281 -2.716 0.917 1.00 0.52 H new ATOM 0 HD3 PRO A1941 22.856 -1.746 0.602 1.00 0.52 H new ATOM 1899 N SER A1942 23.480 -6.217 -0.189 1.00 0.61 N ATOM 1900 CA SER A1942 24.084 -7.522 -0.380 1.00 0.70 C ATOM 1901 C SER A1942 23.563 -8.512 0.660 1.00 0.67 C ATOM 1902 O SER A1942 23.884 -9.699 0.610 1.00 0.75 O ATOM 1903 CB SER A1942 25.608 -7.399 -0.292 1.00 0.85 C ATOM 1904 OG SER A1942 26.251 -8.656 -0.440 1.00 1.54 O ATOM 0 H SER A1942 23.974 -5.621 0.474 1.00 0.61 H new ATOM 0 HA SER A1942 23.814 -7.898 -1.367 1.00 0.70 H new ATOM 0 HB2 SER A1942 25.962 -6.717 -1.065 1.00 0.85 H new ATOM 0 HB3 SER A1942 25.882 -6.962 0.668 1.00 0.85 H new ATOM 0 HG SER A1942 25.658 -9.367 -0.118 1.00 1.54 H new ATOM 1910 N ASP A1943 22.756 -8.020 1.593 1.00 0.61 N ATOM 1911 CA ASP A1943 22.210 -8.863 2.649 1.00 0.59 C ATOM 1912 C ASP A1943 21.001 -9.636 2.136 1.00 0.54 C ATOM 1913 O ASP A1943 19.938 -9.065 1.882 1.00 0.65 O ATOM 1914 CB ASP A1943 21.828 -8.024 3.871 1.00 0.59 C ATOM 1915 CG ASP A1943 21.362 -8.871 5.039 1.00 0.80 C ATOM 1916 OD1 ASP A1943 22.219 -9.376 5.796 1.00 1.16 O ATOM 1917 OD2 ASP A1943 20.141 -9.038 5.213 1.00 0.93 O ATOM 0 H ASP A1943 22.466 -7.043 1.639 1.00 0.61 H new ATOM 0 HA ASP A1943 22.978 -9.575 2.951 1.00 0.59 H new ATOM 0 HB2 ASP A1943 22.686 -7.427 4.180 1.00 0.59 H new ATOM 0 HB3 ASP A1943 21.037 -7.326 3.595 1.00 0.59 H new ATOM 1922 N VAL A1944 21.180 -10.939 1.968 1.00 0.55 N ATOM 1923 CA VAL A1944 20.141 -11.804 1.423 1.00 0.54 C ATOM 1924 C VAL A1944 18.947 -11.906 2.370 1.00 0.47 C ATOM 1925 O VAL A1944 17.801 -12.008 1.925 1.00 0.44 O ATOM 1926 CB VAL A1944 20.691 -13.219 1.131 1.00 0.64 C ATOM 1927 CG1 VAL A1944 19.616 -14.116 0.534 1.00 1.30 C ATOM 1928 CG2 VAL A1944 21.894 -13.140 0.203 1.00 1.33 C ATOM 0 H VAL A1944 22.045 -11.425 2.204 1.00 0.55 H new ATOM 0 HA VAL A1944 19.808 -11.353 0.488 1.00 0.54 H new ATOM 0 HB VAL A1944 21.007 -13.659 2.077 1.00 0.64 H new ATOM 0 HG11 VAL A1944 20.033 -15.104 0.340 1.00 1.30 H new ATOM 0 HG12 VAL A1944 18.785 -14.204 1.234 1.00 1.30 H new ATOM 0 HG13 VAL A1944 19.258 -13.683 -0.400 1.00 1.30 H new ATOM 0 HG21 VAL A1944 22.269 -14.145 0.007 1.00 1.33 H new ATOM 0 HG22 VAL A1944 21.599 -12.674 -0.737 1.00 1.33 H new ATOM 0 HG23 VAL A1944 22.677 -12.545 0.673 1.00 1.33 H new ATOM 1938 N TYR A1945 19.216 -11.864 3.671 1.00 0.48 N ATOM 1939 CA TYR A1945 18.163 -11.984 4.674 1.00 0.48 C ATOM 1940 C TYR A1945 17.153 -10.846 4.536 1.00 0.42 C ATOM 1941 O TYR A1945 15.952 -11.089 4.416 1.00 0.41 O ATOM 1942 CB TYR A1945 18.760 -11.997 6.086 1.00 0.57 C ATOM 1943 CG TYR A1945 17.740 -12.249 7.178 1.00 0.80 C ATOM 1944 CD1 TYR A1945 17.230 -13.521 7.402 1.00 0.92 C ATOM 1945 CD2 TYR A1945 17.293 -11.212 7.989 1.00 1.17 C ATOM 1946 CE1 TYR A1945 16.303 -13.754 8.400 1.00 1.22 C ATOM 1947 CE2 TYR A1945 16.366 -11.437 8.989 1.00 1.54 C ATOM 1948 CZ TYR A1945 15.862 -12.712 9.179 1.00 1.52 C ATOM 1949 OH TYR A1945 14.950 -12.939 10.189 1.00 1.91 O ATOM 0 H TYR A1945 20.154 -11.748 4.056 1.00 0.48 H new ATOM 0 HA TYR A1945 17.644 -12.928 4.509 1.00 0.48 H new ATOM 0 HB2 TYR A1945 19.531 -12.766 6.137 1.00 0.57 H new ATOM 0 HB3 TYR A1945 19.250 -11.041 6.272 1.00 0.57 H new ATOM 0 HD1 TYR A1945 17.564 -14.343 6.785 1.00 0.92 H new ATOM 0 HD2 TYR A1945 17.676 -10.214 7.835 1.00 1.17 H new ATOM 0 HE1 TYR A1945 15.926 -14.752 8.567 1.00 1.22 H new ATOM 0 HE2 TYR A1945 16.037 -10.623 9.618 1.00 1.54 H new ATOM 0 HH TYR A1945 14.747 -12.094 10.642 1.00 1.91 H new ATOM 1959 N THR A1946 17.648 -9.612 4.534 1.00 0.42 N ATOM 1960 CA THR A1946 16.793 -8.440 4.398 1.00 0.40 C ATOM 1961 C THR A1946 15.993 -8.499 3.102 1.00 0.33 C ATOM 1962 O THR A1946 14.787 -8.235 3.093 1.00 0.33 O ATOM 1963 CB THR A1946 17.616 -7.137 4.421 1.00 0.47 C ATOM 1964 OG1 THR A1946 18.428 -7.094 5.598 1.00 0.60 O ATOM 1965 CG2 THR A1946 16.707 -5.918 4.391 1.00 0.48 C ATOM 0 H THR A1946 18.641 -9.399 4.625 1.00 0.42 H new ATOM 0 HA THR A1946 16.111 -8.443 5.248 1.00 0.40 H new ATOM 0 HB THR A1946 18.250 -7.121 3.535 1.00 0.47 H new ATOM 0 HG1 THR A1946 19.140 -7.764 5.529 1.00 0.60 H new ATOM 0 HG21 THR A1946 17.313 -5.012 4.408 1.00 0.48 H new ATOM 0 HG22 THR A1946 16.105 -5.935 3.482 1.00 0.48 H new ATOM 0 HG23 THR A1946 16.051 -5.932 5.261 1.00 0.48 H new ATOM 1973 N LYS A1947 16.664 -8.864 2.015 1.00 0.32 N ATOM 1974 CA LYS A1947 16.009 -8.959 0.721 1.00 0.31 C ATOM 1975 C LYS A1947 14.910 -10.009 0.766 1.00 0.30 C ATOM 1976 O LYS A1947 13.802 -9.764 0.305 1.00 0.31 O ATOM 1977 CB LYS A1947 17.020 -9.290 -0.381 1.00 0.37 C ATOM 1978 CG LYS A1947 16.424 -9.254 -1.784 1.00 0.42 C ATOM 1979 CD LYS A1947 17.495 -9.402 -2.854 1.00 0.52 C ATOM 1980 CE LYS A1947 18.146 -10.777 -2.822 1.00 0.55 C ATOM 1981 NZ LYS A1947 17.265 -11.837 -3.380 1.00 1.20 N ATOM 0 H LYS A1947 17.657 -9.098 2.006 1.00 0.32 H new ATOM 0 HA LYS A1947 15.563 -7.992 0.491 1.00 0.31 H new ATOM 0 HB2 LYS A1947 17.848 -8.583 -0.328 1.00 0.37 H new ATOM 0 HB3 LYS A1947 17.435 -10.281 -0.197 1.00 0.37 H new ATOM 0 HG2 LYS A1947 15.692 -10.054 -1.889 1.00 0.42 H new ATOM 0 HG3 LYS A1947 15.892 -8.314 -1.929 1.00 0.42 H new ATOM 0 HD2 LYS A1947 17.053 -9.233 -3.836 1.00 0.52 H new ATOM 0 HD3 LYS A1947 18.258 -8.636 -2.712 1.00 0.52 H new ATOM 0 HE2 LYS A1947 19.077 -10.748 -3.388 1.00 0.55 H new ATOM 0 HE3 LYS A1947 18.406 -11.029 -1.794 1.00 0.55 H new ATOM 0 HZ1 LYS A1947 17.789 -12.734 -3.430 1.00 1.20 H new ATOM 0 HZ2 LYS A1947 16.433 -11.956 -2.767 1.00 1.20 H new ATOM 0 HZ3 LYS A1947 16.955 -11.564 -4.334 1.00 1.20 H new ATOM 1995 N LYS A1948 15.215 -11.162 1.353 1.00 0.33 N ATOM 1996 CA LYS A1948 14.253 -12.253 1.444 1.00 0.38 C ATOM 1997 C LYS A1948 13.019 -11.816 2.223 1.00 0.35 C ATOM 1998 O LYS A1948 11.891 -12.038 1.785 1.00 0.37 O ATOM 1999 CB LYS A1948 14.874 -13.474 2.118 1.00 0.47 C ATOM 2000 CG LYS A1948 13.996 -14.711 2.042 1.00 0.57 C ATOM 2001 CD LYS A1948 14.465 -15.790 3.000 1.00 0.80 C ATOM 2002 CE LYS A1948 14.243 -15.377 4.446 1.00 1.84 C ATOM 2003 NZ LYS A1948 14.695 -16.421 5.400 1.00 2.67 N ATOM 0 H LYS A1948 16.122 -11.364 1.773 1.00 0.33 H new ATOM 0 HA LYS A1948 13.960 -12.522 0.429 1.00 0.38 H new ATOM 0 HB2 LYS A1948 15.835 -13.689 1.651 1.00 0.47 H new ATOM 0 HB3 LYS A1948 15.073 -13.241 3.164 1.00 0.47 H new ATOM 0 HG2 LYS A1948 12.966 -14.441 2.274 1.00 0.57 H new ATOM 0 HG3 LYS A1948 14.002 -15.100 1.024 1.00 0.57 H new ATOM 0 HD2 LYS A1948 13.929 -16.717 2.798 1.00 0.80 H new ATOM 0 HD3 LYS A1948 15.524 -15.991 2.835 1.00 0.80 H new ATOM 0 HE2 LYS A1948 14.779 -14.449 4.644 1.00 1.84 H new ATOM 0 HE3 LYS A1948 13.184 -15.174 4.606 1.00 1.84 H new ATOM 0 HZ1 LYS A1948 14.525 -16.098 6.374 1.00 2.67 H new ATOM 0 HZ2 LYS A1948 14.166 -17.300 5.229 1.00 2.67 H new ATOM 0 HZ3 LYS A1948 15.711 -16.597 5.266 1.00 2.67 H new ATOM 2017 N GLU A1949 13.245 -11.187 3.373 1.00 0.34 N ATOM 2018 CA GLU A1949 12.155 -10.688 4.204 1.00 0.36 C ATOM 2019 C GLU A1949 11.285 -9.714 3.414 1.00 0.32 C ATOM 2020 O GLU A1949 10.056 -9.754 3.497 1.00 0.34 O ATOM 2021 CB GLU A1949 12.706 -9.991 5.450 1.00 0.42 C ATOM 2022 CG GLU A1949 13.533 -10.890 6.357 1.00 0.49 C ATOM 2023 CD GLU A1949 12.741 -12.054 6.913 1.00 0.86 C ATOM 2024 OE1 GLU A1949 11.808 -11.820 7.707 1.00 0.99 O ATOM 2025 OE2 GLU A1949 13.040 -13.211 6.547 1.00 1.53 O ATOM 0 H GLU A1949 14.176 -11.011 3.751 1.00 0.34 H new ATOM 0 HA GLU A1949 11.547 -11.538 4.513 1.00 0.36 H new ATOM 0 HB2 GLU A1949 13.320 -9.146 5.138 1.00 0.42 H new ATOM 0 HB3 GLU A1949 11.873 -9.585 6.023 1.00 0.42 H new ATOM 0 HG2 GLU A1949 14.388 -11.272 5.800 1.00 0.49 H new ATOM 0 HG3 GLU A1949 13.929 -10.299 7.183 1.00 0.49 H new ATOM 2032 N LEU A1950 11.930 -8.845 2.642 1.00 0.29 N ATOM 2033 CA LEU A1950 11.214 -7.893 1.804 1.00 0.27 C ATOM 2034 C LEU A1950 10.447 -8.622 0.706 1.00 0.25 C ATOM 2035 O LEU A1950 9.305 -8.278 0.410 1.00 0.27 O ATOM 2036 CB LEU A1950 12.184 -6.863 1.207 1.00 0.27 C ATOM 2037 CG LEU A1950 11.564 -5.866 0.221 1.00 0.27 C ATOM 2038 CD1 LEU A1950 12.275 -4.529 0.310 1.00 0.31 C ATOM 2039 CD2 LEU A1950 11.638 -6.399 -1.204 1.00 0.29 C ATOM 0 H LEU A1950 12.946 -8.781 2.580 1.00 0.29 H new ATOM 0 HA LEU A1950 10.494 -7.358 2.423 1.00 0.27 H new ATOM 0 HB2 LEU A1950 12.640 -6.304 2.024 1.00 0.27 H new ATOM 0 HB3 LEU A1950 12.987 -7.398 0.699 1.00 0.27 H new ATOM 0 HG LEU A1950 10.516 -5.731 0.487 1.00 0.27 H new ATOM 0 HD11 LEU A1950 11.825 -3.830 -0.395 1.00 0.31 H new ATOM 0 HD12 LEU A1950 12.182 -4.134 1.322 1.00 0.31 H new ATOM 0 HD13 LEU A1950 13.329 -4.661 0.067 1.00 0.31 H new ATOM 0 HD21 LEU A1950 11.192 -5.675 -1.887 1.00 0.29 H new ATOM 0 HD22 LEU A1950 12.680 -6.562 -1.478 1.00 0.29 H new ATOM 0 HD23 LEU A1950 11.094 -7.341 -1.269 1.00 0.29 H new ATOM 2051 N ILE A1951 11.079 -9.630 0.113 1.00 0.25 N ATOM 2052 CA ILE A1951 10.434 -10.453 -0.903 1.00 0.26 C ATOM 2053 C ILE A1951 9.156 -11.074 -0.342 1.00 0.28 C ATOM 2054 O ILE A1951 8.110 -11.055 -0.991 1.00 0.31 O ATOM 2055 CB ILE A1951 11.381 -11.567 -1.414 1.00 0.28 C ATOM 2056 CG1 ILE A1951 12.593 -10.952 -2.126 1.00 0.30 C ATOM 2057 CG2 ILE A1951 10.642 -12.521 -2.347 1.00 0.32 C ATOM 2058 CD1 ILE A1951 13.690 -11.948 -2.445 1.00 0.35 C ATOM 0 H ILE A1951 12.041 -9.897 0.320 1.00 0.25 H new ATOM 0 HA ILE A1951 10.185 -9.809 -1.746 1.00 0.26 H new ATOM 0 HB ILE A1951 11.734 -12.137 -0.554 1.00 0.28 H new ATOM 0 HG12 ILE A1951 12.259 -10.485 -3.053 1.00 0.30 H new ATOM 0 HG13 ILE A1951 13.006 -10.160 -1.501 1.00 0.30 H new ATOM 0 HG21 ILE A1951 11.327 -13.295 -2.693 1.00 0.32 H new ATOM 0 HG22 ILE A1951 9.813 -12.984 -1.812 1.00 0.32 H new ATOM 0 HG23 ILE A1951 10.257 -11.967 -3.203 1.00 0.32 H new ATOM 0 HD11 ILE A1951 14.511 -11.436 -2.947 1.00 0.35 H new ATOM 0 HD12 ILE A1951 14.054 -12.397 -1.521 1.00 0.35 H new ATOM 0 HD13 ILE A1951 13.295 -12.728 -3.097 1.00 0.35 H new ATOM 2070 N GLU A1952 9.242 -11.593 0.878 1.00 0.30 N ATOM 2071 CA GLU A1952 8.085 -12.169 1.555 1.00 0.35 C ATOM 2072 C GLU A1952 7.011 -11.108 1.778 1.00 0.33 C ATOM 2073 O GLU A1952 5.820 -11.366 1.608 1.00 0.37 O ATOM 2074 CB GLU A1952 8.503 -12.779 2.893 1.00 0.43 C ATOM 2075 CG GLU A1952 9.557 -13.865 2.762 1.00 0.54 C ATOM 2076 CD GLU A1952 9.070 -15.063 1.977 1.00 1.17 C ATOM 2077 OE1 GLU A1952 9.043 -14.989 0.731 1.00 2.11 O ATOM 2078 OE2 GLU A1952 8.706 -16.085 2.595 1.00 1.48 O ATOM 0 H GLU A1952 10.105 -11.627 1.421 1.00 0.30 H new ATOM 0 HA GLU A1952 7.673 -12.954 0.922 1.00 0.35 H new ATOM 0 HB2 GLU A1952 8.885 -11.989 3.540 1.00 0.43 H new ATOM 0 HB3 GLU A1952 7.623 -13.195 3.384 1.00 0.43 H new ATOM 0 HG2 GLU A1952 10.440 -13.451 2.274 1.00 0.54 H new ATOM 0 HG3 GLU A1952 9.864 -14.189 3.756 1.00 0.54 H new ATOM 2085 N CYS A1953 7.444 -9.912 2.160 1.00 0.31 N ATOM 2086 CA CYS A1953 6.534 -8.790 2.337 1.00 0.31 C ATOM 2087 C CYS A1953 5.854 -8.441 1.018 1.00 0.27 C ATOM 2088 O CYS A1953 4.640 -8.264 0.966 1.00 0.30 O ATOM 2089 CB CYS A1953 7.286 -7.575 2.888 1.00 0.33 C ATOM 2090 SG CYS A1953 8.024 -7.855 4.514 1.00 0.88 S ATOM 0 H CYS A1953 8.422 -9.696 2.353 1.00 0.31 H new ATOM 0 HA CYS A1953 5.766 -9.078 3.055 1.00 0.31 H new ATOM 0 HB2 CYS A1953 8.071 -7.295 2.186 1.00 0.33 H new ATOM 0 HB3 CYS A1953 6.599 -6.731 2.951 1.00 0.33 H new ATOM 0 HG CYS A1953 9.047 -8.649 4.395 1.00 0.88 H new ATOM 2096 N ALA A1954 6.647 -8.372 -0.045 1.00 0.23 N ATOM 2097 CA ALA A1954 6.138 -8.071 -1.375 1.00 0.22 C ATOM 2098 C ALA A1954 5.113 -9.108 -1.825 1.00 0.23 C ATOM 2099 O ALA A1954 4.079 -8.761 -2.396 1.00 0.25 O ATOM 2100 CB ALA A1954 7.285 -7.991 -2.370 1.00 0.25 C ATOM 0 H ALA A1954 7.655 -8.522 -0.009 1.00 0.23 H new ATOM 0 HA ALA A1954 5.637 -7.104 -1.334 1.00 0.22 H new ATOM 0 HB1 ALA A1954 6.892 -7.765 -3.361 1.00 0.25 H new ATOM 0 HB2 ALA A1954 7.976 -7.205 -2.066 1.00 0.25 H new ATOM 0 HB3 ALA A1954 7.811 -8.946 -2.397 1.00 0.25 H new ATOM 2106 N ARG A1955 5.406 -10.377 -1.562 1.00 0.28 N ATOM 2107 CA ARG A1955 4.486 -11.463 -1.894 1.00 0.34 C ATOM 2108 C ARG A1955 3.133 -11.237 -1.231 1.00 0.34 C ATOM 2109 O ARG A1955 2.090 -11.336 -1.879 1.00 0.40 O ATOM 2110 CB ARG A1955 5.061 -12.811 -1.451 1.00 0.48 C ATOM 2111 CG ARG A1955 6.318 -13.215 -2.199 1.00 0.92 C ATOM 2112 CD ARG A1955 6.951 -14.460 -1.598 1.00 1.00 C ATOM 2113 NE ARG A1955 6.081 -15.632 -1.697 1.00 1.71 N ATOM 2114 CZ ARG A1955 6.244 -16.740 -0.973 1.00 2.30 C ATOM 2115 NH1 ARG A1955 7.220 -16.817 -0.078 1.00 2.42 N ATOM 2116 NH2 ARG A1955 5.424 -17.769 -1.140 1.00 3.21 N ATOM 0 H ARG A1955 6.273 -10.681 -1.120 1.00 0.28 H new ATOM 0 HA ARG A1955 4.353 -11.475 -2.976 1.00 0.34 H new ATOM 0 HB2 ARG A1955 5.282 -12.769 -0.384 1.00 0.48 H new ATOM 0 HB3 ARG A1955 4.303 -13.582 -1.589 1.00 0.48 H new ATOM 0 HG2 ARG A1955 6.076 -13.398 -3.246 1.00 0.92 H new ATOM 0 HG3 ARG A1955 7.035 -12.394 -2.176 1.00 0.92 H new ATOM 0 HD2 ARG A1955 7.893 -14.666 -2.106 1.00 1.00 H new ATOM 0 HD3 ARG A1955 7.188 -14.274 -0.550 1.00 1.00 H new ATOM 0 HE ARG A1955 5.305 -15.600 -2.358 1.00 1.71 H new ATOM 0 HH11 ARG A1955 7.850 -16.027 0.059 1.00 2.42 H new ATOM 0 HH12 ARG A1955 7.341 -17.667 0.473 1.00 2.42 H new ATOM 0 HH21 ARG A1955 4.668 -17.713 -1.823 1.00 3.21 H new ATOM 0 HH22 ARG A1955 5.549 -18.616 -0.586 1.00 3.21 H new ATOM 2130 N ARG A1956 3.169 -10.908 0.056 1.00 0.35 N ATOM 2131 CA ARG A1956 1.955 -10.647 0.819 1.00 0.40 C ATOM 2132 C ARG A1956 1.183 -9.475 0.221 1.00 0.35 C ATOM 2133 O ARG A1956 -0.030 -9.554 0.038 1.00 0.42 O ATOM 2134 CB ARG A1956 2.290 -10.358 2.284 1.00 0.50 C ATOM 2135 CG ARG A1956 2.986 -11.510 2.989 1.00 0.89 C ATOM 2136 CD ARG A1956 3.209 -11.219 4.465 1.00 1.05 C ATOM 2137 NE ARG A1956 4.168 -10.135 4.684 1.00 1.60 N ATOM 2138 CZ ARG A1956 4.087 -9.261 5.691 1.00 2.17 C ATOM 2139 NH1 ARG A1956 3.066 -9.309 6.541 1.00 2.22 N ATOM 2140 NH2 ARG A1956 5.025 -8.335 5.851 1.00 3.16 N ATOM 0 H ARG A1956 4.031 -10.816 0.594 1.00 0.35 H new ATOM 0 HA ARG A1956 1.330 -11.538 0.771 1.00 0.40 H new ATOM 0 HB2 ARG A1956 2.926 -9.475 2.335 1.00 0.50 H new ATOM 0 HB3 ARG A1956 1.370 -10.119 2.818 1.00 0.50 H new ATOM 0 HG2 ARG A1956 2.388 -12.415 2.884 1.00 0.89 H new ATOM 0 HG3 ARG A1956 3.945 -11.704 2.508 1.00 0.89 H new ATOM 0 HD2 ARG A1956 2.258 -10.957 4.928 1.00 1.05 H new ATOM 0 HD3 ARG A1956 3.567 -12.122 4.960 1.00 1.05 H new ATOM 0 HE ARG A1956 4.944 -10.041 4.029 1.00 1.60 H new ATOM 0 HH11 ARG A1956 2.339 -10.016 6.426 1.00 2.22 H new ATOM 0 HH12 ARG A1956 3.009 -8.639 7.308 1.00 2.22 H new ATOM 0 HH21 ARG A1956 5.812 -8.289 5.203 1.00 3.16 H new ATOM 0 HH22 ARG A1956 4.959 -7.670 6.621 1.00 3.16 H new ATOM 2154 N VAL A1957 1.897 -8.398 -0.094 1.00 0.26 N ATOM 2155 CA VAL A1957 1.280 -7.213 -0.679 1.00 0.24 C ATOM 2156 C VAL A1957 0.587 -7.554 -1.992 1.00 0.22 C ATOM 2157 O VAL A1957 -0.586 -7.232 -2.184 1.00 0.24 O ATOM 2158 CB VAL A1957 2.316 -6.096 -0.929 1.00 0.25 C ATOM 2159 CG1 VAL A1957 1.653 -4.870 -1.541 1.00 0.28 C ATOM 2160 CG2 VAL A1957 3.027 -5.728 0.361 1.00 0.30 C ATOM 0 H VAL A1957 2.904 -8.322 0.046 1.00 0.26 H new ATOM 0 HA VAL A1957 0.543 -6.852 0.039 1.00 0.24 H new ATOM 0 HB VAL A1957 3.056 -6.472 -1.636 1.00 0.25 H new ATOM 0 HG11 VAL A1957 2.402 -4.096 -1.708 1.00 0.28 H new ATOM 0 HG12 VAL A1957 1.193 -5.141 -2.491 1.00 0.28 H new ATOM 0 HG13 VAL A1957 0.888 -4.493 -0.862 1.00 0.28 H new ATOM 0 HG21 VAL A1957 3.753 -4.939 0.164 1.00 0.30 H new ATOM 0 HG22 VAL A1957 2.298 -5.376 1.091 1.00 0.30 H new ATOM 0 HG23 VAL A1957 3.541 -6.604 0.756 1.00 0.30 H new ATOM 2170 N SER A1958 1.311 -8.229 -2.879 1.00 0.21 N ATOM 2171 CA SER A1958 0.785 -8.606 -4.185 1.00 0.25 C ATOM 2172 C SER A1958 -0.479 -9.455 -4.038 1.00 0.27 C ATOM 2173 O SER A1958 -1.413 -9.342 -4.833 1.00 0.30 O ATOM 2174 CB SER A1958 1.853 -9.367 -4.980 1.00 0.29 C ATOM 2175 OG SER A1958 1.410 -9.669 -6.293 1.00 1.13 O ATOM 0 H SER A1958 2.272 -8.528 -2.714 1.00 0.21 H new ATOM 0 HA SER A1958 0.520 -7.698 -4.727 1.00 0.25 H new ATOM 0 HB2 SER A1958 2.764 -8.770 -5.031 1.00 0.29 H new ATOM 0 HB3 SER A1958 2.106 -10.291 -4.459 1.00 0.29 H new ATOM 0 HG SER A1958 2.115 -10.152 -6.773 1.00 1.13 H new ATOM 2181 N GLU A1959 -0.510 -10.295 -3.010 1.00 0.28 N ATOM 2182 CA GLU A1959 -1.675 -11.130 -2.744 1.00 0.35 C ATOM 2183 C GLU A1959 -2.833 -10.300 -2.205 1.00 0.33 C ATOM 2184 O GLU A1959 -3.990 -10.517 -2.564 1.00 0.42 O ATOM 2185 CB GLU A1959 -1.332 -12.232 -1.746 1.00 0.43 C ATOM 2186 CG GLU A1959 -0.415 -13.303 -2.303 1.00 0.51 C ATOM 2187 CD GLU A1959 -0.049 -14.338 -1.264 1.00 1.18 C ATOM 2188 OE1 GLU A1959 -0.897 -15.195 -0.953 1.00 1.59 O ATOM 2189 OE2 GLU A1959 1.099 -14.309 -0.769 1.00 1.86 O ATOM 0 H GLU A1959 0.257 -10.416 -2.348 1.00 0.28 H new ATOM 0 HA GLU A1959 -1.977 -11.582 -3.689 1.00 0.35 H new ATOM 0 HB2 GLU A1959 -0.861 -11.783 -0.872 1.00 0.43 H new ATOM 0 HB3 GLU A1959 -2.256 -12.700 -1.405 1.00 0.43 H new ATOM 0 HG2 GLU A1959 -0.902 -13.793 -3.146 1.00 0.51 H new ATOM 0 HG3 GLU A1959 0.493 -12.838 -2.686 1.00 0.51 H new ATOM 2196 N LYS A1960 -2.522 -9.345 -1.341 1.00 0.25 N ATOM 2197 CA LYS A1960 -3.551 -8.523 -0.721 1.00 0.27 C ATOM 2198 C LYS A1960 -4.215 -7.607 -1.744 1.00 0.24 C ATOM 2199 O LYS A1960 -5.383 -7.262 -1.594 1.00 0.28 O ATOM 2200 CB LYS A1960 -2.984 -7.714 0.450 1.00 0.32 C ATOM 2201 CG LYS A1960 -2.448 -8.582 1.582 1.00 0.41 C ATOM 2202 CD LYS A1960 -3.456 -9.644 1.991 1.00 0.49 C ATOM 2203 CE LYS A1960 -2.884 -10.613 3.018 1.00 0.64 C ATOM 2204 NZ LYS A1960 -2.759 -9.999 4.367 1.00 0.65 N ATOM 0 H LYS A1960 -1.569 -9.121 -1.054 1.00 0.25 H new ATOM 0 HA LYS A1960 -4.314 -9.194 -0.326 1.00 0.27 H new ATOM 0 HB2 LYS A1960 -2.183 -7.072 0.084 1.00 0.32 H new ATOM 0 HB3 LYS A1960 -3.763 -7.060 0.841 1.00 0.32 H new ATOM 0 HG2 LYS A1960 -1.520 -9.060 1.268 1.00 0.41 H new ATOM 0 HG3 LYS A1960 -2.208 -7.955 2.441 1.00 0.41 H new ATOM 0 HD2 LYS A1960 -4.343 -9.162 2.403 1.00 0.49 H new ATOM 0 HD3 LYS A1960 -3.775 -10.199 1.109 1.00 0.49 H new ATOM 0 HE2 LYS A1960 -3.525 -11.493 3.080 1.00 0.64 H new ATOM 0 HE3 LYS A1960 -1.904 -10.955 2.685 1.00 0.64 H new ATOM 0 HZ1 LYS A1960 -2.630 -10.747 5.078 1.00 0.65 H new ATOM 0 HZ2 LYS A1960 -1.938 -9.360 4.383 1.00 0.65 H new ATOM 0 HZ3 LYS A1960 -3.621 -9.460 4.584 1.00 0.65 H new ATOM 2218 N VAL A1961 -3.478 -7.240 -2.791 1.00 0.21 N ATOM 2219 CA VAL A1961 -4.038 -6.445 -3.887 1.00 0.20 C ATOM 2220 C VAL A1961 -5.276 -7.122 -4.464 1.00 0.19 C ATOM 2221 O VAL A1961 -6.328 -6.500 -4.609 1.00 0.19 O ATOM 2222 CB VAL A1961 -3.022 -6.235 -5.028 1.00 0.23 C ATOM 2223 CG1 VAL A1961 -3.633 -5.393 -6.138 1.00 0.27 C ATOM 2224 CG2 VAL A1961 -1.750 -5.589 -4.509 1.00 0.27 C ATOM 0 H VAL A1961 -2.493 -7.479 -2.905 1.00 0.21 H new ATOM 0 HA VAL A1961 -4.299 -5.475 -3.464 1.00 0.20 H new ATOM 0 HB VAL A1961 -2.764 -7.212 -5.436 1.00 0.23 H new ATOM 0 HG11 VAL A1961 -2.902 -5.255 -6.935 1.00 0.27 H new ATOM 0 HG12 VAL A1961 -4.512 -5.899 -6.536 1.00 0.27 H new ATOM 0 HG13 VAL A1961 -3.923 -4.421 -5.740 1.00 0.27 H new ATOM 0 HG21 VAL A1961 -1.049 -5.452 -5.333 1.00 0.27 H new ATOM 0 HG22 VAL A1961 -1.987 -4.620 -4.069 1.00 0.27 H new ATOM 0 HG23 VAL A1961 -1.299 -6.231 -3.752 1.00 0.27 H new ATOM 2234 N SER A1962 -5.141 -8.405 -4.776 1.00 0.22 N ATOM 2235 CA SER A1962 -6.240 -9.185 -5.324 1.00 0.27 C ATOM 2236 C SER A1962 -7.422 -9.218 -4.355 1.00 0.25 C ATOM 2237 O SER A1962 -8.579 -9.232 -4.770 1.00 0.28 O ATOM 2238 CB SER A1962 -5.755 -10.600 -5.634 1.00 0.35 C ATOM 2239 OG SER A1962 -4.663 -10.564 -6.541 1.00 1.30 O ATOM 0 H SER A1962 -4.274 -8.929 -4.657 1.00 0.22 H new ATOM 0 HA SER A1962 -6.582 -8.715 -6.246 1.00 0.27 H new ATOM 0 HB2 SER A1962 -5.453 -11.098 -4.712 1.00 0.35 H new ATOM 0 HB3 SER A1962 -6.570 -11.185 -6.060 1.00 0.35 H new ATOM 0 HG SER A1962 -4.363 -11.478 -6.728 1.00 1.30 H new ATOM 2245 N HIS A1963 -7.116 -9.201 -3.063 1.00 0.26 N ATOM 2246 CA HIS A1963 -8.144 -9.197 -2.031 1.00 0.30 C ATOM 2247 C HIS A1963 -8.859 -7.849 -1.987 1.00 0.24 C ATOM 2248 O HIS A1963 -10.063 -7.788 -1.738 1.00 0.27 O ATOM 2249 CB HIS A1963 -7.538 -9.526 -0.663 1.00 0.41 C ATOM 2250 CG HIS A1963 -7.139 -10.963 -0.510 1.00 0.53 C ATOM 2251 ND1 HIS A1963 -5.856 -11.423 -0.726 1.00 1.08 N ATOM 2252 CD2 HIS A1963 -7.864 -12.044 -0.144 1.00 1.11 C ATOM 2253 CE1 HIS A1963 -5.814 -12.723 -0.499 1.00 0.95 C ATOM 2254 NE2 HIS A1963 -7.017 -13.123 -0.145 1.00 0.93 N ATOM 0 H HIS A1963 -6.161 -9.190 -2.705 1.00 0.26 H new ATOM 0 HA HIS A1963 -8.876 -9.966 -2.278 1.00 0.30 H new ATOM 0 HB2 HIS A1963 -6.663 -8.896 -0.502 1.00 0.41 H new ATOM 0 HB3 HIS A1963 -8.259 -9.274 0.114 1.00 0.41 H new ATOM 0 HD1 HIS A1963 -5.064 -10.849 -1.016 1.00 1.08 H new ATOM 0 HD2 HIS A1963 -8.915 -12.056 0.103 1.00 1.11 H new ATOM 0 HE1 HIS A1963 -4.940 -13.352 -0.589 1.00 0.95 H new ATOM 2263 N VAL A1964 -8.114 -6.774 -2.230 1.00 0.24 N ATOM 2264 CA VAL A1964 -8.693 -5.435 -2.297 1.00 0.25 C ATOM 2265 C VAL A1964 -9.612 -5.322 -3.507 1.00 0.24 C ATOM 2266 O VAL A1964 -10.737 -4.835 -3.407 1.00 0.29 O ATOM 2267 CB VAL A1964 -7.604 -4.340 -2.386 1.00 0.28 C ATOM 2268 CG1 VAL A1964 -8.229 -2.954 -2.430 1.00 0.35 C ATOM 2269 CG2 VAL A1964 -6.632 -4.447 -1.224 1.00 0.33 C ATOM 0 H VAL A1964 -7.106 -6.804 -2.384 1.00 0.24 H new ATOM 0 HA VAL A1964 -9.260 -5.281 -1.379 1.00 0.25 H new ATOM 0 HB VAL A1964 -7.050 -4.495 -3.312 1.00 0.28 H new ATOM 0 HG11 VAL A1964 -7.442 -2.202 -2.492 1.00 0.35 H new ATOM 0 HG12 VAL A1964 -8.877 -2.875 -3.303 1.00 0.35 H new ATOM 0 HG13 VAL A1964 -8.816 -2.791 -1.526 1.00 0.35 H new ATOM 0 HG21 VAL A1964 -5.876 -3.666 -1.309 1.00 0.33 H new ATOM 0 HG22 VAL A1964 -7.173 -4.328 -0.285 1.00 0.33 H new ATOM 0 HG23 VAL A1964 -6.149 -5.424 -1.243 1.00 0.33 H new ATOM 2279 N LEU A1965 -9.121 -5.786 -4.647 1.00 0.23 N ATOM 2280 CA LEU A1965 -9.905 -5.799 -5.875 1.00 0.26 C ATOM 2281 C LEU A1965 -11.187 -6.604 -5.676 1.00 0.29 C ATOM 2282 O LEU A1965 -12.283 -6.138 -5.995 1.00 0.35 O ATOM 2283 CB LEU A1965 -9.068 -6.380 -7.018 1.00 0.26 C ATOM 2284 CG LEU A1965 -7.828 -5.557 -7.380 1.00 0.26 C ATOM 2285 CD1 LEU A1965 -6.886 -6.347 -8.275 1.00 0.28 C ATOM 2286 CD2 LEU A1965 -8.238 -4.263 -8.061 1.00 0.28 C ATOM 0 H LEU A1965 -8.178 -6.161 -4.748 1.00 0.23 H new ATOM 0 HA LEU A1965 -10.184 -4.777 -6.133 1.00 0.26 H new ATOM 0 HB2 LEU A1965 -8.753 -7.387 -6.745 1.00 0.26 H new ATOM 0 HB3 LEU A1965 -9.698 -6.472 -7.903 1.00 0.26 H new ATOM 0 HG LEU A1965 -7.298 -5.321 -6.457 1.00 0.26 H new ATOM 0 HD11 LEU A1965 -6.015 -5.737 -8.515 1.00 0.28 H new ATOM 0 HD12 LEU A1965 -6.564 -7.251 -7.757 1.00 0.28 H new ATOM 0 HD13 LEU A1965 -7.402 -6.621 -9.195 1.00 0.28 H new ATOM 0 HD21 LEU A1965 -7.348 -3.687 -8.313 1.00 0.28 H new ATOM 0 HD22 LEU A1965 -8.793 -4.491 -8.971 1.00 0.28 H new ATOM 0 HD23 LEU A1965 -8.868 -3.681 -7.388 1.00 0.28 H new ATOM 2298 N ALA A1966 -11.045 -7.798 -5.108 1.00 0.28 N ATOM 2299 CA ALA A1966 -12.189 -8.657 -4.822 1.00 0.33 C ATOM 2300 C ALA A1966 -13.166 -7.974 -3.869 1.00 0.34 C ATOM 2301 O ALA A1966 -14.373 -8.199 -3.941 1.00 0.40 O ATOM 2302 CB ALA A1966 -11.725 -9.984 -4.242 1.00 0.37 C ATOM 0 H ALA A1966 -10.145 -8.194 -4.836 1.00 0.28 H new ATOM 0 HA ALA A1966 -12.710 -8.847 -5.761 1.00 0.33 H new ATOM 0 HB1 ALA A1966 -12.591 -10.613 -4.034 1.00 0.37 H new ATOM 0 HB2 ALA A1966 -11.075 -10.487 -4.958 1.00 0.37 H new ATOM 0 HB3 ALA A1966 -11.176 -9.805 -3.317 1.00 0.37 H new ATOM 2308 N ALA A1967 -12.638 -7.130 -2.986 1.00 0.32 N ATOM 2309 CA ALA A1967 -13.461 -6.397 -2.033 1.00 0.36 C ATOM 2310 C ALA A1967 -14.391 -5.428 -2.751 1.00 0.36 C ATOM 2311 O ALA A1967 -15.570 -5.331 -2.416 1.00 0.46 O ATOM 2312 CB ALA A1967 -12.590 -5.653 -1.032 1.00 0.40 C ATOM 0 H ALA A1967 -11.639 -6.938 -2.912 1.00 0.32 H new ATOM 0 HA ALA A1967 -14.072 -7.119 -1.491 1.00 0.36 H new ATOM 0 HB1 ALA A1967 -13.224 -5.112 -0.329 1.00 0.40 H new ATOM 0 HB2 ALA A1967 -11.971 -6.366 -0.488 1.00 0.40 H new ATOM 0 HB3 ALA A1967 -11.950 -4.947 -1.561 1.00 0.40 H new ATOM 2318 N LEU A1968 -13.855 -4.723 -3.741 1.00 0.35 N ATOM 2319 CA LEU A1968 -14.652 -3.801 -4.541 1.00 0.36 C ATOM 2320 C LEU A1968 -15.636 -4.563 -5.417 1.00 0.43 C ATOM 2321 O LEU A1968 -16.827 -4.260 -5.436 1.00 0.50 O ATOM 2322 CB LEU A1968 -13.761 -2.919 -5.425 1.00 0.39 C ATOM 2323 CG LEU A1968 -13.194 -1.659 -4.763 1.00 0.38 C ATOM 2324 CD1 LEU A1968 -14.314 -0.811 -4.180 1.00 0.32 C ATOM 2325 CD2 LEU A1968 -12.174 -2.012 -3.691 1.00 0.45 C ATOM 0 H LEU A1968 -12.872 -4.772 -4.009 1.00 0.35 H new ATOM 0 HA LEU A1968 -15.203 -3.162 -3.851 1.00 0.36 H new ATOM 0 HB2 LEU A1968 -12.928 -3.523 -5.784 1.00 0.39 H new ATOM 0 HB3 LEU A1968 -14.336 -2.618 -6.300 1.00 0.39 H new ATOM 0 HG LEU A1968 -12.684 -1.077 -5.531 1.00 0.38 H new ATOM 0 HD11 LEU A1968 -13.892 0.079 -3.714 1.00 0.32 H new ATOM 0 HD12 LEU A1968 -14.998 -0.515 -4.975 1.00 0.32 H new ATOM 0 HD13 LEU A1968 -14.856 -1.389 -3.432 1.00 0.32 H new ATOM 0 HD21 LEU A1968 -11.789 -1.098 -3.239 1.00 0.45 H new ATOM 0 HD22 LEU A1968 -12.649 -2.624 -2.924 1.00 0.45 H new ATOM 0 HD23 LEU A1968 -11.351 -2.568 -4.141 1.00 0.45 H new ATOM 2337 N GLN A1969 -15.128 -5.563 -6.131 1.00 0.50 N ATOM 2338 CA GLN A1969 -15.949 -6.370 -7.032 1.00 0.63 C ATOM 2339 C GLN A1969 -17.093 -7.057 -6.285 1.00 0.69 C ATOM 2340 O GLN A1969 -18.141 -7.342 -6.865 1.00 0.81 O ATOM 2341 CB GLN A1969 -15.088 -7.415 -7.749 1.00 0.75 C ATOM 2342 CG GLN A1969 -14.505 -6.944 -9.079 1.00 0.79 C ATOM 2343 CD GLN A1969 -13.652 -5.695 -8.968 1.00 0.70 C ATOM 2344 OE1 GLN A1969 -12.447 -5.768 -8.731 1.00 1.70 O ATOM 2345 NE2 GLN A1969 -14.266 -4.543 -9.181 1.00 0.81 N ATOM 0 H GLN A1969 -14.146 -5.836 -6.103 1.00 0.50 H new ATOM 0 HA GLN A1969 -16.385 -5.698 -7.771 1.00 0.63 H new ATOM 0 HB2 GLN A1969 -14.270 -7.708 -7.091 1.00 0.75 H new ATOM 0 HB3 GLN A1969 -15.691 -8.306 -7.925 1.00 0.75 H new ATOM 0 HG2 GLN A1969 -13.903 -7.747 -9.505 1.00 0.79 H new ATOM 0 HG3 GLN A1969 -15.322 -6.754 -9.775 1.00 0.79 H new ATOM 0 HE21 GLN A1969 -15.267 -4.527 -9.374 1.00 0.81 H new ATOM 0 HE22 GLN A1969 -13.738 -3.671 -9.152 1.00 0.81 H new ATOM 2354 N ALA A1970 -16.893 -7.295 -4.992 1.00 0.66 N ATOM 2355 CA ALA A1970 -17.898 -7.957 -4.163 1.00 0.79 C ATOM 2356 C ALA A1970 -19.135 -7.081 -3.975 1.00 0.78 C ATOM 2357 O ALA A1970 -20.220 -7.581 -3.675 1.00 0.93 O ATOM 2358 CB ALA A1970 -17.310 -8.334 -2.810 1.00 0.84 C ATOM 0 H ALA A1970 -16.041 -7.039 -4.493 1.00 0.66 H new ATOM 0 HA ALA A1970 -18.206 -8.865 -4.681 1.00 0.79 H new ATOM 0 HB1 ALA A1970 -18.073 -8.826 -2.206 1.00 0.84 H new ATOM 0 HB2 ALA A1970 -16.469 -9.012 -2.955 1.00 0.84 H new ATOM 0 HB3 ALA A1970 -16.967 -7.434 -2.299 1.00 0.84 H new