USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=38 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: A1837 GLN : amide:sc= 0.712 K(o=1.9,f=-4.8) USER MOD Set 1.2: A1901 LYS NZ :NH3+ -165:sc= 1.22 (180deg=0) USER MOD Set 2.1: A1867 THR OG1 : rot 74:sc= 0.775 USER MOD Set 2.2: A1888 GLN : amide:sc= 0.781 K(o=1.6,f=0.86) USER MOD Set 3.1: A1860 THR OG1 : rot 77:sc= 0.405 USER MOD Set 3.2: A1899 GLN :FLIP amide:sc= -0.804 F(o=-1.5,f=-0.4) USER MOD Set 4.1: A1832 THR OG1 : rot 73:sc= 1.22 USER MOD Set 4.2: A1928 SER OG : rot 109:sc= 1.12 USER MOD Single : A1830 SER OG : rot 180:sc= 0 USER MOD Single : A1833 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1836 ASN :FLIP amide:sc= -0.0397 F(o=-1.9!,f=-0.04) USER MOD Single : A1853 TYR OH : rot 180:sc= 0 USER MOD Single : A1854 GLN : amide:sc= 0.343 X(o=0.34,f=0) USER MOD Single : A1855 THR OG1 : rot 93:sc= 1.2 USER MOD Single : A1856 THR OG1 : rot 70:sc= 0.735 USER MOD Single : A1857 MET CE :methyl -111:sc= -1.23 (180deg=-2.03) USER MOD Single : A1862 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1869 GLN : amide:sc= -0.13 X(o=-0.13,f=0) USER MOD Single : A1871 MET CE :methyl -174:sc= -1.23 (180deg=-1.23) USER MOD Single : A1873 THR OG1 : rot 180:sc= 0 USER MOD Single : A1874 LYS NZ :NH3+ 169:sc= 1.24 (180deg=1.14) USER MOD Single : A1875 SER OG : rot -85:sc= 0.514 USER MOD Single : A1876 ASN :FLIP amide:sc= 0 F(o=-0.89!,f=0) USER MOD Single : A1877 THR OG1 : rot -75:sc= -0.317 USER MOD Single : A1878 SER OG : rot -16:sc= 0.656 USER MOD Single : A1887 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1890 THR OG1 : rot 74:sc= 1.06 USER MOD Single : A1891 SER OG : rot 180:sc= -0.912 USER MOD Single : A1893 TYR OH : rot 1:sc= 0.00785 USER MOD Single : A1898 SER OG : rot 72:sc= 1.21 USER MOD Single : A1909 ASN : amide:sc= 0.206 X(o=0.21,f=-0.058) USER MOD Single : A1915 HIS : no HD1:sc= -0.115 X(o=-0.12,f=-0.0016) USER MOD Single : A1917 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1918 HIS :FLIP no HD1:sc= -0.142 F(o=-2.6!,f=-0.14) USER MOD Single : A1921 GLN :FLIP amide:sc= -1.52 F(o=-4.1!,f=-1.5) USER MOD Single : A1925 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1927 CYS SG : rot 82:sc=-0.00918 USER MOD Single : A1932 THR OG1 : rot 82:sc= 1.23 USER MOD Single : A1933 LYS NZ :NH3+ 151:sc= 0.195 (180deg=0.0157) USER MOD Single : A1938 GLN : amide:sc= -0.734 X(o=-0.73,f=-0.9) USER MOD Single : A1939 CYS SG : rot 79:sc= 1.25 USER MOD Single : A1940 SER OG : rot 180:sc= -0.0289 USER MOD Single : A1942 SER OG : rot 180:sc= 0 USER MOD Single : A1945 TYR OH : rot 180:sc= 0 USER MOD Single : A1946 THR OG1 : rot 86:sc= 1.17 USER MOD Single : A1947 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1948 LYS NZ :NH3+ 151:sc= -1.65! (180deg=-3.06!) USER MOD Single : A1953 CYS SG : rot 66:sc= 0.852 USER MOD Single : A1958 SER OG : rot 180:sc= 0 USER MOD Single : A1960 LYS NZ :NH3+ -163:sc= 1.08 (180deg=0.56) USER MOD Single : A1962 SER OG : rot 180:sc= 0 USER MOD Single : A1963 HIS : no HD1:sc= -0.0412 X(o=-0.041,f=0) USER MOD Single : A1969 GLN : amide:sc= -0.935 K(o=-0.94,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 239 N VAL A1828 6.168 5.831 5.914 1.00 0.67 N ATOM 240 CA VAL A1828 5.523 4.699 6.572 1.00 0.65 C ATOM 241 C VAL A1828 4.525 5.198 7.618 1.00 0.57 C ATOM 242 O VAL A1828 3.523 4.542 7.911 1.00 0.57 O ATOM 243 CB VAL A1828 6.559 3.749 7.223 1.00 0.71 C ATOM 244 CG1 VAL A1828 7.329 4.445 8.337 1.00 0.71 C ATOM 245 CG2 VAL A1828 5.883 2.489 7.741 1.00 0.74 C ATOM 0 HA VAL A1828 4.989 4.130 5.811 1.00 0.65 H new ATOM 0 HB VAL A1828 7.276 3.463 6.453 1.00 0.71 H new ATOM 0 HG11 VAL A1828 8.047 3.750 8.772 1.00 0.71 H new ATOM 0 HG12 VAL A1828 7.858 5.307 7.930 1.00 0.71 H new ATOM 0 HG13 VAL A1828 6.633 4.777 9.108 1.00 0.71 H new ATOM 0 HG21 VAL A1828 6.629 1.836 8.194 1.00 0.74 H new ATOM 0 HG22 VAL A1828 5.135 2.758 8.487 1.00 0.74 H new ATOM 0 HG23 VAL A1828 5.400 1.969 6.914 1.00 0.74 H new ATOM 255 N ASP A1829 4.798 6.383 8.151 1.00 0.56 N ATOM 256 CA ASP A1829 3.896 7.039 9.089 1.00 0.57 C ATOM 257 C ASP A1829 2.560 7.335 8.421 1.00 0.51 C ATOM 258 O ASP A1829 1.502 7.079 8.990 1.00 0.52 O ATOM 259 CB ASP A1829 4.526 8.333 9.602 1.00 0.69 C ATOM 260 CG ASP A1829 3.600 9.115 10.511 1.00 0.78 C ATOM 261 OD1 ASP A1829 3.319 8.638 11.631 1.00 0.85 O ATOM 262 OD2 ASP A1829 3.181 10.226 10.125 1.00 0.87 O ATOM 0 H ASP A1829 5.645 6.913 7.947 1.00 0.56 H new ATOM 0 HA ASP A1829 3.722 6.371 9.933 1.00 0.57 H new ATOM 0 HB2 ASP A1829 5.443 8.097 10.141 1.00 0.69 H new ATOM 0 HB3 ASP A1829 4.807 8.957 8.753 1.00 0.69 H new ATOM 267 N SER A1830 2.623 7.849 7.196 1.00 0.48 N ATOM 268 CA SER A1830 1.425 8.153 6.425 1.00 0.45 C ATOM 269 C SER A1830 0.620 6.882 6.173 1.00 0.38 C ATOM 270 O SER A1830 -0.598 6.856 6.351 1.00 0.40 O ATOM 271 CB SER A1830 1.804 8.803 5.088 1.00 0.46 C ATOM 272 OG SER A1830 0.660 9.308 4.421 1.00 0.97 O ATOM 0 H SER A1830 3.497 8.064 6.715 1.00 0.48 H new ATOM 0 HA SER A1830 0.814 8.851 6.998 1.00 0.45 H new ATOM 0 HB2 SER A1830 2.513 9.612 5.262 1.00 0.46 H new ATOM 0 HB3 SER A1830 2.304 8.071 4.454 1.00 0.46 H new ATOM 0 HG SER A1830 0.930 9.718 3.573 1.00 0.97 H new ATOM 278 N ILE A1831 1.318 5.823 5.773 1.00 0.32 N ATOM 279 CA ILE A1831 0.685 4.538 5.506 1.00 0.28 C ATOM 280 C ILE A1831 -0.015 4.015 6.761 1.00 0.31 C ATOM 281 O ILE A1831 -1.155 3.551 6.705 1.00 0.30 O ATOM 282 CB ILE A1831 1.725 3.501 5.017 1.00 0.27 C ATOM 283 CG1 ILE A1831 2.476 4.041 3.796 1.00 0.27 C ATOM 284 CG2 ILE A1831 1.053 2.175 4.681 1.00 0.28 C ATOM 285 CD1 ILE A1831 3.561 3.115 3.288 1.00 0.30 C ATOM 0 H ILE A1831 2.327 5.831 5.626 1.00 0.32 H new ATOM 0 HA ILE A1831 -0.056 4.687 4.720 1.00 0.28 H new ATOM 0 HB ILE A1831 2.439 3.326 5.822 1.00 0.27 H new ATOM 0 HG12 ILE A1831 1.762 4.224 2.993 1.00 0.27 H new ATOM 0 HG13 ILE A1831 2.922 5.002 4.051 1.00 0.27 H new ATOM 0 HG21 ILE A1831 1.804 1.463 4.340 1.00 0.28 H new ATOM 0 HG22 ILE A1831 0.558 1.783 5.569 1.00 0.28 H new ATOM 0 HG23 ILE A1831 0.316 2.330 3.893 1.00 0.28 H new ATOM 0 HD11 ILE A1831 4.048 3.565 2.423 1.00 0.30 H new ATOM 0 HD12 ILE A1831 4.298 2.952 4.075 1.00 0.30 H new ATOM 0 HD13 ILE A1831 3.120 2.161 3.000 1.00 0.30 H new ATOM 297 N THR A1832 0.666 4.125 7.893 1.00 0.36 N ATOM 298 CA THR A1832 0.127 3.673 9.168 1.00 0.41 C ATOM 299 C THR A1832 -1.065 4.533 9.599 1.00 0.39 C ATOM 300 O THR A1832 -2.079 4.017 10.072 1.00 0.39 O ATOM 301 CB THR A1832 1.214 3.705 10.260 1.00 0.52 C ATOM 302 OG1 THR A1832 2.372 2.984 9.810 1.00 0.57 O ATOM 303 CG2 THR A1832 0.709 3.087 11.554 1.00 0.61 C ATOM 0 H THR A1832 1.601 4.527 7.954 1.00 0.36 H new ATOM 0 HA THR A1832 -0.215 2.646 9.036 1.00 0.41 H new ATOM 0 HB THR A1832 1.473 4.746 10.451 1.00 0.52 H new ATOM 0 HG1 THR A1832 2.840 3.509 9.128 1.00 0.57 H new ATOM 0 HG21 THR A1832 1.497 3.123 12.306 1.00 0.61 H new ATOM 0 HG22 THR A1832 -0.158 3.644 11.909 1.00 0.61 H new ATOM 0 HG23 THR A1832 0.425 2.050 11.375 1.00 0.61 H new ATOM 311 N GLN A1833 -0.942 5.844 9.413 1.00 0.40 N ATOM 312 CA GLN A1833 -2.008 6.777 9.761 1.00 0.43 C ATOM 313 C GLN A1833 -3.254 6.498 8.928 1.00 0.35 C ATOM 314 O GLN A1833 -4.381 6.565 9.422 1.00 0.36 O ATOM 315 CB GLN A1833 -1.533 8.215 9.541 1.00 0.53 C ATOM 316 CG GLN A1833 -2.552 9.271 9.937 1.00 0.98 C ATOM 317 CD GLN A1833 -2.027 10.676 9.732 1.00 1.72 C ATOM 318 OE1 GLN A1833 -2.199 11.271 8.667 1.00 2.49 O ATOM 319 NE2 GLN A1833 -1.367 11.212 10.746 1.00 2.33 N ATOM 0 H GLN A1833 -0.110 6.286 9.021 1.00 0.40 H new ATOM 0 HA GLN A1833 -2.262 6.644 10.813 1.00 0.43 H new ATOM 0 HB2 GLN A1833 -0.618 8.376 10.112 1.00 0.53 H new ATOM 0 HB3 GLN A1833 -1.280 8.346 8.489 1.00 0.53 H new ATOM 0 HG2 GLN A1833 -3.461 9.135 9.350 1.00 0.98 H new ATOM 0 HG3 GLN A1833 -2.825 9.136 10.984 1.00 0.98 H new ATOM 0 HE21 GLN A1833 -1.247 10.686 11.611 1.00 2.33 H new ATOM 0 HE22 GLN A1833 -0.979 12.151 10.662 1.00 2.33 H new ATOM 328 N ALA A1834 -3.034 6.161 7.663 1.00 0.30 N ATOM 329 CA ALA A1834 -4.120 5.837 6.750 1.00 0.29 C ATOM 330 C ALA A1834 -4.877 4.596 7.213 1.00 0.28 C ATOM 331 O ALA A1834 -6.063 4.439 6.929 1.00 0.34 O ATOM 332 CB ALA A1834 -3.578 5.637 5.347 1.00 0.31 C ATOM 0 H ALA A1834 -2.105 6.105 7.245 1.00 0.30 H new ATOM 0 HA ALA A1834 -4.821 6.671 6.743 1.00 0.29 H new ATOM 0 HB1 ALA A1834 -4.398 5.395 4.671 1.00 0.31 H new ATOM 0 HB2 ALA A1834 -3.090 6.552 5.012 1.00 0.31 H new ATOM 0 HB3 ALA A1834 -2.856 4.820 5.349 1.00 0.31 H new ATOM 338 N ILE A1835 -4.182 3.719 7.925 1.00 0.27 N ATOM 339 CA ILE A1835 -4.801 2.534 8.505 1.00 0.30 C ATOM 340 C ILE A1835 -5.839 2.934 9.550 1.00 0.33 C ATOM 341 O ILE A1835 -6.947 2.399 9.584 1.00 0.40 O ATOM 342 CB ILE A1835 -3.741 1.619 9.164 1.00 0.34 C ATOM 343 CG1 ILE A1835 -2.749 1.111 8.117 1.00 0.38 C ATOM 344 CG2 ILE A1835 -4.399 0.452 9.886 1.00 0.36 C ATOM 345 CD1 ILE A1835 -1.651 0.245 8.694 1.00 0.49 C ATOM 0 H ILE A1835 -3.184 3.807 8.116 1.00 0.27 H new ATOM 0 HA ILE A1835 -5.287 1.986 7.698 1.00 0.30 H new ATOM 0 HB ILE A1835 -3.197 2.208 9.902 1.00 0.34 H new ATOM 0 HG12 ILE A1835 -3.290 0.542 7.362 1.00 0.38 H new ATOM 0 HG13 ILE A1835 -2.299 1.965 7.611 1.00 0.38 H new ATOM 0 HG21 ILE A1835 -3.631 -0.175 10.340 1.00 0.36 H new ATOM 0 HG22 ILE A1835 -5.063 0.832 10.662 1.00 0.36 H new ATOM 0 HG23 ILE A1835 -4.975 -0.139 9.174 1.00 0.36 H new ATOM 0 HD11 ILE A1835 -0.985 -0.079 7.894 1.00 0.49 H new ATOM 0 HD12 ILE A1835 -1.084 0.817 9.429 1.00 0.49 H new ATOM 0 HD13 ILE A1835 -2.091 -0.628 9.176 1.00 0.49 H new ATOM 357 N ASN A1836 -5.478 3.908 10.373 1.00 0.36 N ATOM 358 CA ASN A1836 -6.305 4.316 11.506 1.00 0.42 C ATOM 359 C ASN A1836 -7.633 4.911 11.051 1.00 0.44 C ATOM 360 O ASN A1836 -8.682 4.610 11.620 1.00 0.53 O ATOM 361 CB ASN A1836 -5.556 5.337 12.373 1.00 0.48 C ATOM 362 CG ASN A1836 -4.439 4.723 13.202 1.00 0.52 C ATOM 363 OD1 ASN A1836 -3.878 3.614 12.742 1.00 0.72 O flip ATOM 364 ND2 ASN A1836 -4.083 5.241 14.258 1.00 0.61 N flip ATOM 0 H ASN A1836 -4.611 4.436 10.278 1.00 0.36 H new ATOM 0 HA ASN A1836 -6.516 3.422 12.092 1.00 0.42 H new ATOM 0 HB2 ASN A1836 -5.137 6.111 11.730 1.00 0.48 H new ATOM 0 HB3 ASN A1836 -6.266 5.826 13.040 1.00 0.48 H new ATOM 0 HD21 ASN A1836 -4.535 6.095 14.585 1.00 0.61 H new ATOM 0 HD22 ASN A1836 -3.336 4.817 14.807 1.00 0.61 H new ATOM 371 N GLN A1837 -7.585 5.735 10.013 1.00 0.44 N ATOM 372 CA GLN A1837 -8.760 6.479 9.564 1.00 0.50 C ATOM 373 C GLN A1837 -9.846 5.552 9.015 1.00 0.50 C ATOM 374 O GLN A1837 -11.038 5.804 9.196 1.00 0.60 O ATOM 375 CB GLN A1837 -8.361 7.498 8.495 1.00 0.54 C ATOM 376 CG GLN A1837 -7.967 6.870 7.167 1.00 0.49 C ATOM 377 CD GLN A1837 -7.557 7.887 6.124 1.00 0.58 C ATOM 378 OE1 GLN A1837 -8.010 9.030 6.140 1.00 1.00 O ATOM 379 NE2 GLN A1837 -6.718 7.464 5.195 1.00 0.67 N ATOM 0 H GLN A1837 -6.743 5.907 9.463 1.00 0.44 H new ATOM 0 HA GLN A1837 -9.170 6.998 10.431 1.00 0.50 H new ATOM 0 HB2 GLN A1837 -9.193 8.183 8.330 1.00 0.54 H new ATOM 0 HB3 GLN A1837 -7.527 8.093 8.867 1.00 0.54 H new ATOM 0 HG2 GLN A1837 -7.143 6.176 7.331 1.00 0.49 H new ATOM 0 HG3 GLN A1837 -8.805 6.286 6.786 1.00 0.49 H new ATOM 0 HE21 GLN A1837 -6.368 6.506 5.222 1.00 0.67 H new ATOM 0 HE22 GLN A1837 -6.421 8.095 4.451 1.00 0.67 H new ATOM 388 N LEU A1838 -9.429 4.474 8.364 1.00 0.44 N ATOM 389 CA LEU A1838 -10.356 3.589 7.672 1.00 0.48 C ATOM 390 C LEU A1838 -11.222 2.810 8.651 1.00 0.64 C ATOM 391 O LEU A1838 -12.425 2.661 8.443 1.00 0.79 O ATOM 392 CB LEU A1838 -9.586 2.623 6.774 1.00 0.41 C ATOM 393 CG LEU A1838 -8.855 3.280 5.605 1.00 0.40 C ATOM 394 CD1 LEU A1838 -7.994 2.264 4.877 1.00 0.50 C ATOM 395 CD2 LEU A1838 -9.850 3.916 4.648 1.00 0.53 C ATOM 0 H LEU A1838 -8.451 4.191 8.301 1.00 0.44 H new ATOM 0 HA LEU A1838 -11.014 4.207 7.061 1.00 0.48 H new ATOM 0 HB2 LEU A1838 -8.859 2.085 7.382 1.00 0.41 H new ATOM 0 HB3 LEU A1838 -10.282 1.883 6.379 1.00 0.41 H new ATOM 0 HG LEU A1838 -8.206 4.062 6.000 1.00 0.40 H new ATOM 0 HD11 LEU A1838 -7.481 2.750 4.047 1.00 0.50 H new ATOM 0 HD12 LEU A1838 -7.258 1.850 5.566 1.00 0.50 H new ATOM 0 HD13 LEU A1838 -8.624 1.461 4.494 1.00 0.50 H new ATOM 0 HD21 LEU A1838 -9.313 4.380 3.820 1.00 0.53 H new ATOM 0 HD22 LEU A1838 -10.523 3.151 4.261 1.00 0.53 H new ATOM 0 HD23 LEU A1838 -10.429 4.674 5.176 1.00 0.53 H new ATOM 538 N PHE A1850 -21.168 3.611 -5.778 1.00 0.67 N ATOM 539 CA PHE A1850 -20.148 2.601 -5.519 1.00 0.57 C ATOM 540 C PHE A1850 -19.401 2.233 -6.800 1.00 0.52 C ATOM 541 O PHE A1850 -18.192 2.013 -6.777 1.00 0.50 O ATOM 542 CB PHE A1850 -20.795 1.356 -4.905 1.00 0.60 C ATOM 543 CG PHE A1850 -19.824 0.263 -4.573 1.00 0.57 C ATOM 544 CD1 PHE A1850 -19.056 0.330 -3.425 1.00 0.60 C ATOM 545 CD2 PHE A1850 -19.678 -0.830 -5.410 1.00 0.63 C ATOM 546 CE1 PHE A1850 -18.161 -0.673 -3.117 1.00 0.65 C ATOM 547 CE2 PHE A1850 -18.785 -1.835 -5.107 1.00 0.68 C ATOM 548 CZ PHE A1850 -18.024 -1.757 -3.958 1.00 0.68 C ATOM 0 HA PHE A1850 -19.425 3.014 -4.816 1.00 0.57 H new ATOM 0 HB2 PHE A1850 -21.325 1.645 -3.997 1.00 0.60 H new ATOM 0 HB3 PHE A1850 -21.540 0.967 -5.599 1.00 0.60 H new ATOM 0 HD1 PHE A1850 -19.158 1.177 -2.763 1.00 0.60 H new ATOM 0 HD2 PHE A1850 -20.271 -0.896 -6.311 1.00 0.63 H new ATOM 0 HE1 PHE A1850 -17.567 -0.609 -2.217 1.00 0.65 H new ATOM 0 HE2 PHE A1850 -18.681 -2.683 -5.768 1.00 0.68 H new ATOM 0 HZ PHE A1850 -17.323 -2.543 -3.718 1.00 0.68 H new ATOM 558 N VAL A1851 -20.128 2.186 -7.912 1.00 0.57 N ATOM 559 CA VAL A1851 -19.548 1.858 -9.212 1.00 0.60 C ATOM 560 C VAL A1851 -18.392 2.801 -9.571 1.00 0.56 C ATOM 561 O VAL A1851 -17.376 2.371 -10.122 1.00 0.55 O ATOM 562 CB VAL A1851 -20.623 1.889 -10.327 1.00 0.71 C ATOM 563 CG1 VAL A1851 -21.347 3.229 -10.359 1.00 0.76 C ATOM 564 CG2 VAL A1851 -20.008 1.584 -11.684 1.00 0.79 C ATOM 0 H VAL A1851 -21.130 2.373 -7.939 1.00 0.57 H new ATOM 0 HA VAL A1851 -19.150 0.846 -9.137 1.00 0.60 H new ATOM 0 HB VAL A1851 -21.355 1.114 -10.099 1.00 0.71 H new ATOM 0 HG11 VAL A1851 -22.095 3.220 -11.152 1.00 0.76 H new ATOM 0 HG12 VAL A1851 -21.836 3.401 -9.400 1.00 0.76 H new ATOM 0 HG13 VAL A1851 -20.628 4.026 -10.548 1.00 0.76 H new ATOM 0 HG21 VAL A1851 -20.783 1.612 -12.449 1.00 0.79 H new ATOM 0 HG22 VAL A1851 -19.245 2.328 -11.913 1.00 0.79 H new ATOM 0 HG23 VAL A1851 -19.554 0.593 -11.663 1.00 0.79 H new ATOM 574 N ASP A1852 -18.538 4.077 -9.235 1.00 0.57 N ATOM 575 CA ASP A1852 -17.516 5.069 -9.552 1.00 0.58 C ATOM 576 C ASP A1852 -16.287 4.862 -8.684 1.00 0.50 C ATOM 577 O ASP A1852 -15.168 4.774 -9.190 1.00 0.52 O ATOM 578 CB ASP A1852 -18.056 6.487 -9.364 1.00 0.67 C ATOM 579 CG ASP A1852 -16.995 7.548 -9.592 1.00 1.10 C ATOM 580 OD1 ASP A1852 -16.477 7.641 -10.723 1.00 1.16 O ATOM 581 OD2 ASP A1852 -16.677 8.297 -8.644 1.00 1.71 O ATOM 0 H ASP A1852 -19.351 4.449 -8.745 1.00 0.57 H new ATOM 0 HA ASP A1852 -17.236 4.941 -10.598 1.00 0.58 H new ATOM 0 HB2 ASP A1852 -18.884 6.651 -10.054 1.00 0.67 H new ATOM 0 HB3 ASP A1852 -18.456 6.589 -8.355 1.00 0.67 H new ATOM 586 N TYR A1853 -16.501 4.759 -7.380 1.00 0.43 N ATOM 587 CA TYR A1853 -15.406 4.548 -6.443 1.00 0.38 C ATOM 588 C TYR A1853 -14.717 3.219 -6.726 1.00 0.33 C ATOM 589 O TYR A1853 -13.496 3.108 -6.627 1.00 0.33 O ATOM 590 CB TYR A1853 -15.916 4.594 -5.001 1.00 0.40 C ATOM 591 CG TYR A1853 -16.565 5.912 -4.642 1.00 0.53 C ATOM 592 CD1 TYR A1853 -15.888 7.111 -4.802 1.00 0.66 C ATOM 593 CD2 TYR A1853 -17.853 5.950 -4.127 1.00 0.67 C ATOM 594 CE1 TYR A1853 -16.478 8.314 -4.460 1.00 0.83 C ATOM 595 CE2 TYR A1853 -18.449 7.146 -3.786 1.00 0.83 C ATOM 596 CZ TYR A1853 -17.757 8.340 -4.007 1.00 0.89 C ATOM 597 OH TYR A1853 -18.349 9.517 -3.602 1.00 1.07 O ATOM 0 H TYR A1853 -17.422 4.818 -6.947 1.00 0.43 H new ATOM 0 HA TYR A1853 -14.679 5.349 -6.573 1.00 0.38 H new ATOM 0 HB2 TYR A1853 -16.635 3.789 -4.851 1.00 0.40 H new ATOM 0 HB3 TYR A1853 -15.084 4.409 -4.322 1.00 0.40 H new ATOM 0 HD1 TYR A1853 -14.884 7.106 -5.200 1.00 0.66 H new ATOM 0 HD2 TYR A1853 -18.398 5.027 -3.991 1.00 0.67 H new ATOM 0 HE1 TYR A1853 -15.920 9.234 -4.554 1.00 0.83 H new ATOM 0 HE2 TYR A1853 -19.438 7.160 -3.353 1.00 0.83 H new ATOM 0 HH TYR A1853 -19.268 9.338 -3.311 1.00 1.07 H new ATOM 607 N GLN A1854 -15.510 2.224 -7.103 1.00 0.34 N ATOM 608 CA GLN A1854 -14.983 0.928 -7.506 1.00 0.33 C ATOM 609 C GLN A1854 -14.017 1.086 -8.673 1.00 0.30 C ATOM 610 O GLN A1854 -12.870 0.643 -8.610 1.00 0.30 O ATOM 611 CB GLN A1854 -16.125 -0.004 -7.911 1.00 0.39 C ATOM 612 CG GLN A1854 -15.651 -1.350 -8.428 1.00 0.43 C ATOM 613 CD GLN A1854 -16.777 -2.196 -8.979 1.00 0.54 C ATOM 614 OE1 GLN A1854 -17.091 -2.132 -10.166 1.00 0.99 O ATOM 615 NE2 GLN A1854 -17.389 -2.997 -8.127 1.00 0.81 N ATOM 0 H GLN A1854 -16.527 2.292 -7.138 1.00 0.34 H new ATOM 0 HA GLN A1854 -14.450 0.497 -6.659 1.00 0.33 H new ATOM 0 HB2 GLN A1854 -16.777 -0.162 -7.052 1.00 0.39 H new ATOM 0 HB3 GLN A1854 -16.725 0.482 -8.681 1.00 0.39 H new ATOM 0 HG2 GLN A1854 -14.906 -1.193 -9.208 1.00 0.43 H new ATOM 0 HG3 GLN A1854 -15.158 -1.891 -7.620 1.00 0.43 H new ATOM 0 HE21 GLN A1854 -17.098 -3.020 -7.150 1.00 0.81 H new ATOM 0 HE22 GLN A1854 -18.153 -3.593 -8.446 1.00 0.81 H new ATOM 624 N THR A1855 -14.488 1.743 -9.727 1.00 0.32 N ATOM 625 CA THR A1855 -13.706 1.920 -10.941 1.00 0.34 C ATOM 626 C THR A1855 -12.429 2.725 -10.670 1.00 0.31 C ATOM 627 O THR A1855 -11.402 2.514 -11.314 1.00 0.37 O ATOM 628 CB THR A1855 -14.546 2.614 -12.035 1.00 0.39 C ATOM 629 OG1 THR A1855 -15.776 1.896 -12.231 1.00 1.40 O ATOM 630 CG2 THR A1855 -13.789 2.678 -13.353 1.00 1.46 C ATOM 0 H THR A1855 -15.416 2.165 -9.763 1.00 0.32 H new ATOM 0 HA THR A1855 -13.417 0.930 -11.292 1.00 0.34 H new ATOM 0 HB THR A1855 -14.755 3.632 -11.705 1.00 0.39 H new ATOM 0 HG1 THR A1855 -16.476 2.287 -11.667 1.00 1.40 H new ATOM 0 HG21 THR A1855 -14.406 3.172 -14.103 1.00 1.46 H new ATOM 0 HG22 THR A1855 -12.866 3.240 -13.215 1.00 1.46 H new ATOM 0 HG23 THR A1855 -13.552 1.667 -13.686 1.00 1.46 H new ATOM 638 N THR A1856 -12.488 3.635 -9.709 1.00 0.29 N ATOM 639 CA THR A1856 -11.322 4.424 -9.355 1.00 0.31 C ATOM 640 C THR A1856 -10.355 3.615 -8.486 1.00 0.29 C ATOM 641 O THR A1856 -9.148 3.616 -8.725 1.00 0.38 O ATOM 642 CB THR A1856 -11.728 5.719 -8.624 1.00 0.36 C ATOM 643 OG1 THR A1856 -12.757 6.391 -9.366 1.00 0.39 O ATOM 644 CG2 THR A1856 -10.537 6.652 -8.463 1.00 0.42 C ATOM 0 H THR A1856 -13.325 3.843 -9.165 1.00 0.29 H new ATOM 0 HA THR A1856 -10.816 4.693 -10.282 1.00 0.31 H new ATOM 0 HB THR A1856 -12.096 5.449 -7.634 1.00 0.36 H new ATOM 0 HG1 THR A1856 -13.589 5.875 -9.313 1.00 0.39 H new ATOM 0 HG21 THR A1856 -10.852 7.558 -7.944 1.00 0.42 H new ATOM 0 HG22 THR A1856 -9.760 6.153 -7.884 1.00 0.42 H new ATOM 0 HG23 THR A1856 -10.145 6.914 -9.446 1.00 0.42 H new ATOM 652 N MET A1857 -10.889 2.898 -7.499 1.00 0.24 N ATOM 653 CA MET A1857 -10.056 2.127 -6.578 1.00 0.23 C ATOM 654 C MET A1857 -9.299 1.012 -7.285 1.00 0.21 C ATOM 655 O MET A1857 -8.110 0.820 -7.035 1.00 0.24 O ATOM 656 CB MET A1857 -10.881 1.536 -5.434 1.00 0.26 C ATOM 657 CG MET A1857 -11.241 2.543 -4.357 1.00 0.32 C ATOM 658 SD MET A1857 -11.998 1.773 -2.915 1.00 0.71 S ATOM 659 CE MET A1857 -10.657 0.729 -2.351 1.00 0.34 C ATOM 0 H MET A1857 -11.891 2.835 -7.317 1.00 0.24 H new ATOM 0 HA MET A1857 -9.330 2.829 -6.167 1.00 0.23 H new ATOM 0 HB2 MET A1857 -11.798 1.110 -5.842 1.00 0.26 H new ATOM 0 HB3 MET A1857 -10.323 0.717 -4.981 1.00 0.26 H new ATOM 0 HG2 MET A1857 -10.342 3.077 -4.049 1.00 0.32 H new ATOM 0 HG3 MET A1857 -11.926 3.283 -4.771 1.00 0.32 H new ATOM 0 HE1 MET A1857 -10.919 -0.317 -2.510 1.00 0.34 H new ATOM 0 HE2 MET A1857 -9.752 0.966 -2.910 1.00 0.34 H new ATOM 0 HE3 MET A1857 -10.483 0.902 -1.289 1.00 0.34 H new ATOM 669 N VAL A1858 -9.972 0.278 -8.166 1.00 0.20 N ATOM 670 CA VAL A1858 -9.330 -0.840 -8.850 1.00 0.22 C ATOM 671 C VAL A1858 -8.137 -0.363 -9.675 1.00 0.24 C ATOM 672 O VAL A1858 -7.115 -1.041 -9.744 1.00 0.29 O ATOM 673 CB VAL A1858 -10.306 -1.636 -9.749 1.00 0.25 C ATOM 674 CG1 VAL A1858 -11.425 -2.244 -8.918 1.00 0.28 C ATOM 675 CG2 VAL A1858 -10.873 -0.767 -10.861 1.00 0.25 C ATOM 0 H VAL A1858 -10.947 0.433 -8.421 1.00 0.20 H new ATOM 0 HA VAL A1858 -8.983 -1.516 -8.068 1.00 0.22 H new ATOM 0 HB VAL A1858 -9.743 -2.444 -10.216 1.00 0.25 H new ATOM 0 HG11 VAL A1858 -12.101 -2.800 -9.568 1.00 0.28 H new ATOM 0 HG12 VAL A1858 -11.001 -2.919 -8.174 1.00 0.28 H new ATOM 0 HG13 VAL A1858 -11.977 -1.450 -8.415 1.00 0.28 H new ATOM 0 HG21 VAL A1858 -11.554 -1.358 -11.473 1.00 0.25 H new ATOM 0 HG22 VAL A1858 -11.413 0.074 -10.426 1.00 0.25 H new ATOM 0 HG23 VAL A1858 -10.059 -0.394 -11.482 1.00 0.25 H new ATOM 685 N ARG A1859 -8.256 0.824 -10.265 1.00 0.24 N ATOM 686 CA ARG A1859 -7.181 1.385 -11.074 1.00 0.28 C ATOM 687 C ARG A1859 -5.972 1.722 -10.210 1.00 0.29 C ATOM 688 O ARG A1859 -4.830 1.469 -10.598 1.00 0.35 O ATOM 689 CB ARG A1859 -7.658 2.631 -11.822 1.00 0.32 C ATOM 690 CG ARG A1859 -8.614 2.327 -12.965 1.00 0.37 C ATOM 691 CD ARG A1859 -9.075 3.597 -13.664 1.00 0.47 C ATOM 692 NE ARG A1859 -9.939 4.412 -12.810 1.00 1.43 N ATOM 693 CZ ARG A1859 -9.935 5.748 -12.801 1.00 1.88 C ATOM 694 NH1 ARG A1859 -9.099 6.418 -13.582 1.00 1.64 N ATOM 695 NH2 ARG A1859 -10.773 6.414 -12.012 1.00 3.02 N ATOM 0 H ARG A1859 -9.085 1.414 -10.197 1.00 0.24 H new ATOM 0 HA ARG A1859 -6.885 0.633 -11.805 1.00 0.28 H new ATOM 0 HB2 ARG A1859 -8.149 3.302 -11.117 1.00 0.32 H new ATOM 0 HB3 ARG A1859 -6.791 3.162 -12.216 1.00 0.32 H new ATOM 0 HG2 ARG A1859 -8.124 1.672 -13.685 1.00 0.37 H new ATOM 0 HG3 ARG A1859 -9.480 1.787 -12.582 1.00 0.37 H new ATOM 0 HD2 ARG A1859 -8.205 4.182 -13.963 1.00 0.47 H new ATOM 0 HD3 ARG A1859 -9.611 3.334 -14.576 1.00 0.47 H new ATOM 0 HE ARG A1859 -10.584 3.931 -12.183 1.00 1.43 H new ATOM 0 HH11 ARG A1859 -8.456 5.913 -14.192 1.00 1.64 H new ATOM 0 HH12 ARG A1859 -9.099 7.438 -13.573 1.00 1.64 H new ATOM 0 HH21 ARG A1859 -11.421 5.905 -11.411 1.00 3.02 H new ATOM 0 HH22 ARG A1859 -10.767 7.434 -12.007 1.00 3.02 H new ATOM 709 N THR A1860 -6.227 2.277 -9.036 1.00 0.25 N ATOM 710 CA THR A1860 -5.162 2.638 -8.117 1.00 0.27 C ATOM 711 C THR A1860 -4.546 1.391 -7.474 1.00 0.26 C ATOM 712 O THR A1860 -3.338 1.328 -7.254 1.00 0.29 O ATOM 713 CB THR A1860 -5.684 3.583 -7.020 1.00 0.28 C ATOM 714 OG1 THR A1860 -6.563 4.558 -7.599 1.00 0.35 O ATOM 715 CG2 THR A1860 -4.533 4.289 -6.319 1.00 0.32 C ATOM 0 H THR A1860 -7.166 2.487 -8.697 1.00 0.25 H new ATOM 0 HA THR A1860 -4.392 3.153 -8.691 1.00 0.27 H new ATOM 0 HB THR A1860 -6.226 2.989 -6.284 1.00 0.28 H new ATOM 0 HG1 THR A1860 -7.432 4.145 -7.785 1.00 0.35 H new ATOM 0 HG21 THR A1860 -4.928 4.951 -5.548 1.00 0.32 H new ATOM 0 HG22 THR A1860 -3.877 3.549 -5.861 1.00 0.32 H new ATOM 0 HG23 THR A1860 -3.968 4.874 -7.045 1.00 0.32 H new ATOM 723 N ALA A1861 -5.379 0.394 -7.189 1.00 0.23 N ATOM 724 CA ALA A1861 -4.905 -0.858 -6.604 1.00 0.23 C ATOM 725 C ALA A1861 -3.960 -1.577 -7.558 1.00 0.24 C ATOM 726 O ALA A1861 -2.857 -1.967 -7.180 1.00 0.25 O ATOM 727 CB ALA A1861 -6.079 -1.752 -6.236 1.00 0.23 C ATOM 0 H ALA A1861 -6.385 0.428 -7.353 1.00 0.23 H new ATOM 0 HA ALA A1861 -4.353 -0.623 -5.694 1.00 0.23 H new ATOM 0 HB1 ALA A1861 -5.707 -2.680 -5.802 1.00 0.23 H new ATOM 0 HB2 ALA A1861 -6.713 -1.241 -5.512 1.00 0.23 H new ATOM 0 HB3 ALA A1861 -6.659 -1.977 -7.131 1.00 0.23 H new ATOM 733 N LYS A1862 -4.391 -1.737 -8.800 1.00 0.28 N ATOM 734 CA LYS A1862 -3.552 -2.327 -9.831 1.00 0.31 C ATOM 735 C LYS A1862 -2.301 -1.477 -10.070 1.00 0.32 C ATOM 736 O LYS A1862 -1.273 -1.975 -10.530 1.00 0.35 O ATOM 737 CB LYS A1862 -4.357 -2.496 -11.119 1.00 0.41 C ATOM 738 CG LYS A1862 -5.588 -3.368 -10.930 1.00 0.47 C ATOM 739 CD LYS A1862 -6.334 -3.607 -12.235 1.00 0.64 C ATOM 740 CE LYS A1862 -7.079 -2.362 -12.686 1.00 0.69 C ATOM 741 NZ LYS A1862 -7.833 -2.589 -13.945 1.00 1.31 N ATOM 0 H LYS A1862 -5.321 -1.465 -9.119 1.00 0.28 H new ATOM 0 HA LYS A1862 -3.221 -3.310 -9.496 1.00 0.31 H new ATOM 0 HB2 LYS A1862 -4.664 -1.515 -11.483 1.00 0.41 H new ATOM 0 HB3 LYS A1862 -3.720 -2.935 -11.886 1.00 0.41 H new ATOM 0 HG2 LYS A1862 -5.290 -4.326 -10.504 1.00 0.47 H new ATOM 0 HG3 LYS A1862 -6.258 -2.895 -10.212 1.00 0.47 H new ATOM 0 HD2 LYS A1862 -5.628 -3.910 -13.008 1.00 0.64 H new ATOM 0 HD3 LYS A1862 -7.039 -4.428 -12.107 1.00 0.64 H new ATOM 0 HE2 LYS A1862 -7.769 -2.049 -11.902 1.00 0.69 H new ATOM 0 HE3 LYS A1862 -6.369 -1.547 -12.831 1.00 0.69 H new ATOM 0 HZ1 LYS A1862 -8.326 -1.715 -14.217 1.00 1.31 H new ATOM 0 HZ2 LYS A1862 -7.173 -2.863 -14.700 1.00 1.31 H new ATOM 0 HZ3 LYS A1862 -8.529 -3.348 -13.801 1.00 1.31 H new ATOM 755 N ALA A1863 -2.394 -0.190 -9.752 1.00 0.33 N ATOM 756 CA ALA A1863 -1.261 0.717 -9.888 1.00 0.37 C ATOM 757 C ALA A1863 -0.209 0.456 -8.811 1.00 0.33 C ATOM 758 O ALA A1863 0.988 0.539 -9.074 1.00 0.40 O ATOM 759 CB ALA A1863 -1.726 2.163 -9.830 1.00 0.41 C ATOM 0 H ALA A1863 -3.244 0.249 -9.398 1.00 0.33 H new ATOM 0 HA ALA A1863 -0.802 0.533 -10.860 1.00 0.37 H new ATOM 0 HB1 ALA A1863 -0.867 2.826 -9.933 1.00 0.41 H new ATOM 0 HB2 ALA A1863 -2.429 2.352 -10.641 1.00 0.41 H new ATOM 0 HB3 ALA A1863 -2.216 2.350 -8.874 1.00 0.41 H new ATOM 765 N ILE A1864 -0.646 0.146 -7.596 1.00 0.26 N ATOM 766 CA ILE A1864 0.296 -0.152 -6.521 1.00 0.25 C ATOM 767 C ILE A1864 0.814 -1.584 -6.653 1.00 0.21 C ATOM 768 O ILE A1864 1.909 -1.907 -6.193 1.00 0.21 O ATOM 769 CB ILE A1864 -0.314 0.077 -5.108 1.00 0.25 C ATOM 770 CG1 ILE A1864 -1.308 -1.023 -4.725 1.00 0.23 C ATOM 771 CG2 ILE A1864 -0.994 1.435 -5.034 1.00 0.28 C ATOM 772 CD1 ILE A1864 -0.741 -2.034 -3.752 1.00 0.26 C ATOM 0 H ILE A1864 -1.630 0.094 -7.332 1.00 0.26 H new ATOM 0 HA ILE A1864 1.128 0.545 -6.623 1.00 0.25 H new ATOM 0 HB ILE A1864 0.510 0.045 -4.395 1.00 0.25 H new ATOM 0 HG12 ILE A1864 -2.194 -0.565 -4.286 1.00 0.23 H new ATOM 0 HG13 ILE A1864 -1.631 -1.541 -5.628 1.00 0.23 H new ATOM 0 HG21 ILE A1864 -1.415 1.577 -4.039 1.00 0.28 H new ATOM 0 HG22 ILE A1864 -0.264 2.219 -5.235 1.00 0.28 H new ATOM 0 HG23 ILE A1864 -1.792 1.483 -5.775 1.00 0.28 H new ATOM 0 HD11 ILE A1864 -1.498 -2.784 -3.524 1.00 0.26 H new ATOM 0 HD12 ILE A1864 0.128 -2.519 -4.197 1.00 0.26 H new ATOM 0 HD13 ILE A1864 -0.444 -1.528 -2.834 1.00 0.26 H new ATOM 784 N ALA A1865 0.027 -2.432 -7.314 1.00 0.18 N ATOM 785 CA ALA A1865 0.382 -3.835 -7.493 1.00 0.17 C ATOM 786 C ALA A1865 1.572 -3.999 -8.432 1.00 0.17 C ATOM 787 O ALA A1865 2.372 -4.922 -8.276 1.00 0.20 O ATOM 788 CB ALA A1865 -0.804 -4.631 -8.007 1.00 0.18 C ATOM 0 H ALA A1865 -0.864 -2.168 -7.735 1.00 0.18 H new ATOM 0 HA ALA A1865 0.669 -4.223 -6.516 1.00 0.17 H new ATOM 0 HB1 ALA A1865 -0.515 -5.674 -8.133 1.00 0.18 H new ATOM 0 HB2 ALA A1865 -1.624 -4.565 -7.292 1.00 0.18 H new ATOM 0 HB3 ALA A1865 -1.126 -4.226 -8.966 1.00 0.18 H new ATOM 794 N VAL A1866 1.694 -3.115 -9.412 1.00 0.16 N ATOM 795 CA VAL A1866 2.839 -3.160 -10.308 1.00 0.18 C ATOM 796 C VAL A1866 4.083 -2.635 -9.591 1.00 0.17 C ATOM 797 O VAL A1866 5.205 -3.033 -9.893 1.00 0.20 O ATOM 798 CB VAL A1866 2.591 -2.371 -11.617 1.00 0.24 C ATOM 799 CG1 VAL A1866 2.398 -0.895 -11.341 1.00 0.73 C ATOM 800 CG2 VAL A1866 3.730 -2.589 -12.603 1.00 0.68 C ATOM 0 H VAL A1866 1.025 -2.369 -9.605 1.00 0.16 H new ATOM 0 HA VAL A1866 2.996 -4.201 -10.590 1.00 0.18 H new ATOM 0 HB VAL A1866 1.672 -2.750 -12.064 1.00 0.24 H new ATOM 0 HG11 VAL A1866 2.226 -0.369 -12.280 1.00 0.73 H new ATOM 0 HG12 VAL A1866 1.539 -0.757 -10.685 1.00 0.73 H new ATOM 0 HG13 VAL A1866 3.290 -0.495 -10.859 1.00 0.73 H new ATOM 0 HG21 VAL A1866 3.534 -2.025 -13.515 1.00 0.68 H new ATOM 0 HG22 VAL A1866 4.666 -2.248 -12.159 1.00 0.68 H new ATOM 0 HG23 VAL A1866 3.807 -3.650 -12.841 1.00 0.68 H new ATOM 810 N THR A1867 3.865 -1.768 -8.610 1.00 0.18 N ATOM 811 CA THR A1867 4.953 -1.241 -7.804 1.00 0.20 C ATOM 812 C THR A1867 5.546 -2.336 -6.919 1.00 0.19 C ATOM 813 O THR A1867 6.749 -2.581 -6.951 1.00 0.24 O ATOM 814 CB THR A1867 4.477 -0.068 -6.928 1.00 0.20 C ATOM 815 OG1 THR A1867 3.867 0.931 -7.757 1.00 0.25 O ATOM 816 CG2 THR A1867 5.637 0.543 -6.153 1.00 0.23 C ATOM 0 H THR A1867 2.942 -1.416 -8.355 1.00 0.18 H new ATOM 0 HA THR A1867 5.722 -0.877 -8.485 1.00 0.20 H new ATOM 0 HB THR A1867 3.750 -0.446 -6.209 1.00 0.20 H new ATOM 0 HG1 THR A1867 2.983 0.621 -8.046 1.00 0.25 H new ATOM 0 HG21 THR A1867 5.272 1.369 -5.543 1.00 0.23 H new ATOM 0 HG22 THR A1867 6.083 -0.215 -5.509 1.00 0.23 H new ATOM 0 HG23 THR A1867 6.387 0.912 -6.852 1.00 0.23 H new ATOM 824 N VAL A1868 4.693 -3.007 -6.148 1.00 0.17 N ATOM 825 CA VAL A1868 5.149 -4.078 -5.266 1.00 0.18 C ATOM 826 C VAL A1868 5.794 -5.214 -6.060 1.00 0.21 C ATOM 827 O VAL A1868 6.827 -5.754 -5.659 1.00 0.28 O ATOM 828 CB VAL A1868 4.001 -4.632 -4.383 1.00 0.17 C ATOM 829 CG1 VAL A1868 2.753 -4.916 -5.201 1.00 0.18 C ATOM 830 CG2 VAL A1868 4.446 -5.889 -3.656 1.00 0.23 C ATOM 0 H VAL A1868 3.689 -2.830 -6.116 1.00 0.17 H new ATOM 0 HA VAL A1868 5.899 -3.641 -4.607 1.00 0.18 H new ATOM 0 HB VAL A1868 3.754 -3.865 -3.649 1.00 0.17 H new ATOM 0 HG11 VAL A1868 1.970 -5.303 -4.548 1.00 0.18 H new ATOM 0 HG12 VAL A1868 2.410 -3.995 -5.673 1.00 0.18 H new ATOM 0 HG13 VAL A1868 2.982 -5.654 -5.970 1.00 0.18 H new ATOM 0 HG21 VAL A1868 3.627 -6.263 -3.041 1.00 0.23 H new ATOM 0 HG22 VAL A1868 4.730 -6.649 -4.384 1.00 0.23 H new ATOM 0 HG23 VAL A1868 5.301 -5.658 -3.020 1.00 0.23 H new ATOM 840 N GLN A1869 5.201 -5.551 -7.203 1.00 0.19 N ATOM 841 CA GLN A1869 5.725 -6.618 -8.045 1.00 0.23 C ATOM 842 C GLN A1869 7.089 -6.220 -8.610 1.00 0.24 C ATOM 843 O GLN A1869 7.907 -7.068 -8.954 1.00 0.27 O ATOM 844 CB GLN A1869 4.741 -6.948 -9.178 1.00 0.24 C ATOM 845 CG GLN A1869 5.008 -6.197 -10.472 1.00 0.24 C ATOM 846 CD GLN A1869 5.538 -7.102 -11.566 1.00 0.43 C ATOM 847 OE1 GLN A1869 4.770 -7.632 -12.367 1.00 0.91 O ATOM 848 NE2 GLN A1869 6.841 -7.328 -11.578 1.00 0.29 N ATOM 0 H GLN A1869 4.360 -5.101 -7.565 1.00 0.19 H new ATOM 0 HA GLN A1869 5.849 -7.514 -7.436 1.00 0.23 H new ATOM 0 HB2 GLN A1869 4.780 -8.019 -9.378 1.00 0.24 H new ATOM 0 HB3 GLN A1869 3.729 -6.723 -8.842 1.00 0.24 H new ATOM 0 HG2 GLN A1869 4.087 -5.723 -10.811 1.00 0.24 H new ATOM 0 HG3 GLN A1869 5.726 -5.399 -10.284 1.00 0.24 H new ATOM 0 HE21 GLN A1869 7.445 -6.868 -10.896 1.00 0.29 H new ATOM 0 HE22 GLN A1869 7.242 -7.962 -12.269 1.00 0.29 H new ATOM 857 N GLU A1870 7.315 -4.920 -8.726 1.00 0.23 N ATOM 858 CA GLU A1870 8.581 -4.408 -9.199 1.00 0.25 C ATOM 859 C GLU A1870 9.622 -4.478 -8.083 1.00 0.26 C ATOM 860 O GLU A1870 10.763 -4.864 -8.312 1.00 0.27 O ATOM 861 CB GLU A1870 8.405 -2.965 -9.681 1.00 0.26 C ATOM 862 CG GLU A1870 9.645 -2.379 -10.323 1.00 0.31 C ATOM 863 CD GLU A1870 10.003 -3.049 -11.632 1.00 0.39 C ATOM 864 OE1 GLU A1870 9.506 -2.609 -12.686 1.00 0.57 O ATOM 865 OE2 GLU A1870 10.784 -4.025 -11.610 1.00 0.45 O ATOM 0 H GLU A1870 6.630 -4.201 -8.496 1.00 0.23 H new ATOM 0 HA GLU A1870 8.929 -5.017 -10.034 1.00 0.25 H new ATOM 0 HB2 GLU A1870 7.585 -2.929 -10.398 1.00 0.26 H new ATOM 0 HB3 GLU A1870 8.116 -2.342 -8.835 1.00 0.26 H new ATOM 0 HG2 GLU A1870 9.490 -1.314 -10.496 1.00 0.31 H new ATOM 0 HG3 GLU A1870 10.483 -2.471 -9.633 1.00 0.31 H new ATOM 872 N MET A1871 9.202 -4.150 -6.860 1.00 0.29 N ATOM 873 CA MET A1871 10.121 -4.053 -5.724 1.00 0.35 C ATOM 874 C MET A1871 10.814 -5.384 -5.442 1.00 0.34 C ATOM 875 O MET A1871 12.001 -5.416 -5.111 1.00 0.35 O ATOM 876 CB MET A1871 9.381 -3.570 -4.472 1.00 0.51 C ATOM 877 CG MET A1871 8.710 -2.215 -4.649 1.00 0.63 C ATOM 878 SD MET A1871 7.951 -1.595 -3.137 1.00 1.25 S ATOM 879 CE MET A1871 9.410 -1.207 -2.178 1.00 0.34 C ATOM 0 H MET A1871 8.229 -3.947 -6.630 1.00 0.29 H new ATOM 0 HA MET A1871 10.888 -3.325 -5.988 1.00 0.35 H new ATOM 0 HB2 MET A1871 8.626 -4.307 -4.198 1.00 0.51 H new ATOM 0 HB3 MET A1871 10.086 -3.512 -3.643 1.00 0.51 H new ATOM 0 HG2 MET A1871 9.449 -1.494 -4.999 1.00 0.63 H new ATOM 0 HG3 MET A1871 7.948 -2.293 -5.425 1.00 0.63 H new ATOM 0 HE1 MET A1871 9.115 -0.911 -1.171 1.00 0.34 H new ATOM 0 HE2 MET A1871 10.054 -2.085 -2.124 1.00 0.34 H new ATOM 0 HE3 MET A1871 9.951 -0.389 -2.653 1.00 0.34 H new ATOM 889 N VAL A1872 10.077 -6.479 -5.584 1.00 0.38 N ATOM 890 CA VAL A1872 10.638 -7.811 -5.370 1.00 0.43 C ATOM 891 C VAL A1872 11.743 -8.105 -6.384 1.00 0.41 C ATOM 892 O VAL A1872 12.771 -8.697 -6.058 1.00 0.50 O ATOM 893 CB VAL A1872 9.545 -8.903 -5.451 1.00 0.50 C ATOM 894 CG1 VAL A1872 8.804 -8.860 -6.774 1.00 0.51 C ATOM 895 CG2 VAL A1872 10.134 -10.281 -5.229 1.00 0.59 C ATOM 0 H VAL A1872 9.091 -6.473 -5.846 1.00 0.38 H new ATOM 0 HA VAL A1872 11.065 -7.827 -4.367 1.00 0.43 H new ATOM 0 HB VAL A1872 8.829 -8.696 -4.656 1.00 0.50 H new ATOM 0 HG11 VAL A1872 8.045 -9.642 -6.792 1.00 0.51 H new ATOM 0 HG12 VAL A1872 8.326 -7.888 -6.892 1.00 0.51 H new ATOM 0 HG13 VAL A1872 9.508 -9.019 -7.591 1.00 0.51 H new ATOM 0 HG21 VAL A1872 9.344 -11.029 -5.291 1.00 0.59 H new ATOM 0 HG22 VAL A1872 10.885 -10.483 -5.992 1.00 0.59 H new ATOM 0 HG23 VAL A1872 10.597 -10.324 -4.243 1.00 0.59 H new ATOM 905 N THR A1873 11.527 -7.657 -7.603 1.00 0.34 N ATOM 906 CA THR A1873 12.465 -7.870 -8.680 1.00 0.37 C ATOM 907 C THR A1873 13.632 -6.886 -8.590 1.00 0.34 C ATOM 908 O THR A1873 14.785 -7.241 -8.848 1.00 0.43 O ATOM 909 CB THR A1873 11.734 -7.717 -10.025 1.00 0.38 C ATOM 910 OG1 THR A1873 10.765 -8.764 -10.166 1.00 0.44 O ATOM 911 CG2 THR A1873 12.699 -7.742 -11.204 1.00 0.44 C ATOM 0 H THR A1873 10.694 -7.134 -7.873 1.00 0.34 H new ATOM 0 HA THR A1873 12.874 -8.877 -8.601 1.00 0.37 H new ATOM 0 HB THR A1873 11.238 -6.746 -10.027 1.00 0.38 H new ATOM 0 HG1 THR A1873 10.299 -8.665 -11.022 1.00 0.44 H new ATOM 0 HG21 THR A1873 12.141 -7.631 -12.134 1.00 0.44 H new ATOM 0 HG22 THR A1873 13.411 -6.923 -11.109 1.00 0.44 H new ATOM 0 HG23 THR A1873 13.236 -8.690 -11.214 1.00 0.44 H new ATOM 919 N LYS A1874 13.330 -5.660 -8.192 1.00 0.28 N ATOM 920 CA LYS A1874 14.330 -4.604 -8.141 1.00 0.29 C ATOM 921 C LYS A1874 15.333 -4.818 -7.024 1.00 0.30 C ATOM 922 O LYS A1874 16.504 -4.554 -7.205 1.00 0.33 O ATOM 923 CB LYS A1874 13.674 -3.232 -7.985 1.00 0.29 C ATOM 924 CG LYS A1874 12.865 -2.781 -9.192 1.00 0.33 C ATOM 925 CD LYS A1874 13.746 -2.281 -10.329 1.00 0.41 C ATOM 926 CE LYS A1874 14.462 -3.409 -11.051 1.00 0.57 C ATOM 927 NZ LYS A1874 15.285 -2.898 -12.174 1.00 1.40 N ATOM 0 H LYS A1874 12.397 -5.371 -7.899 1.00 0.28 H new ATOM 0 HA LYS A1874 14.867 -4.640 -9.089 1.00 0.29 H new ATOM 0 HB2 LYS A1874 13.021 -3.252 -7.112 1.00 0.29 H new ATOM 0 HB3 LYS A1874 14.450 -2.492 -7.786 1.00 0.29 H new ATOM 0 HG2 LYS A1874 12.255 -3.611 -9.547 1.00 0.33 H new ATOM 0 HG3 LYS A1874 12.180 -1.988 -8.891 1.00 0.33 H new ATOM 0 HD2 LYS A1874 13.134 -1.729 -11.042 1.00 0.41 H new ATOM 0 HD3 LYS A1874 14.483 -1.582 -9.933 1.00 0.41 H new ATOM 0 HE2 LYS A1874 15.098 -3.947 -10.348 1.00 0.57 H new ATOM 0 HE3 LYS A1874 13.730 -4.123 -11.430 1.00 0.57 H new ATOM 0 HZ1 LYS A1874 15.901 -3.658 -12.527 1.00 1.40 H new ATOM 0 HZ2 LYS A1874 14.662 -2.573 -12.941 1.00 1.40 H new ATOM 0 HZ3 LYS A1874 15.869 -2.104 -11.843 1.00 1.40 H new ATOM 941 N SER A1875 14.889 -5.304 -5.878 1.00 0.32 N ATOM 942 CA SER A1875 15.803 -5.517 -4.763 1.00 0.37 C ATOM 943 C SER A1875 16.885 -6.528 -5.137 1.00 0.40 C ATOM 944 O SER A1875 17.998 -6.491 -4.616 1.00 0.44 O ATOM 945 CB SER A1875 15.031 -5.986 -3.531 1.00 0.41 C ATOM 946 OG SER A1875 14.113 -7.009 -3.870 1.00 1.11 O ATOM 0 H SER A1875 13.918 -5.556 -5.693 1.00 0.32 H new ATOM 0 HA SER A1875 16.291 -4.571 -4.529 1.00 0.37 H new ATOM 0 HB2 SER A1875 15.728 -6.352 -2.778 1.00 0.41 H new ATOM 0 HB3 SER A1875 14.497 -5.145 -3.089 1.00 0.41 H new ATOM 0 HG SER A1875 13.278 -6.607 -4.188 1.00 1.11 H new ATOM 952 N ASN A1876 16.548 -7.409 -6.066 1.00 0.42 N ATOM 953 CA ASN A1876 17.468 -8.432 -6.535 1.00 0.48 C ATOM 954 C ASN A1876 18.435 -7.887 -7.580 1.00 0.51 C ATOM 955 O ASN A1876 19.541 -8.401 -7.745 1.00 0.65 O ATOM 956 CB ASN A1876 16.682 -9.605 -7.120 1.00 0.52 C ATOM 957 CG ASN A1876 16.213 -10.582 -6.058 1.00 0.56 C ATOM 958 OD1 ASN A1876 14.993 -10.401 -5.572 1.00 0.76 O flip ATOM 959 ND2 ASN A1876 16.940 -11.500 -5.681 1.00 0.62 N flip ATOM 0 H ASN A1876 15.632 -7.435 -6.514 1.00 0.42 H new ATOM 0 HA ASN A1876 18.056 -8.769 -5.681 1.00 0.48 H new ATOM 0 HB2 ASN A1876 15.818 -9.223 -7.664 1.00 0.52 H new ATOM 0 HB3 ASN A1876 17.306 -10.131 -7.842 1.00 0.52 H new ATOM 0 HD21 ASN A1876 17.873 -11.607 -6.078 1.00 0.62 H new ATOM 0 HD22 ASN A1876 16.609 -12.154 -4.971 1.00 0.62 H new ATOM 966 N THR A1877 18.018 -6.843 -8.277 1.00 0.48 N ATOM 967 CA THR A1877 18.789 -6.307 -9.388 1.00 0.55 C ATOM 968 C THR A1877 19.424 -4.958 -9.053 1.00 0.48 C ATOM 969 O THR A1877 20.629 -4.763 -9.224 1.00 0.57 O ATOM 970 CB THR A1877 17.891 -6.160 -10.628 1.00 0.69 C ATOM 971 OG1 THR A1877 16.606 -5.647 -10.239 1.00 1.32 O ATOM 972 CG2 THR A1877 17.714 -7.497 -11.329 1.00 0.94 C ATOM 0 H THR A1877 17.146 -6.347 -8.092 1.00 0.48 H new ATOM 0 HA THR A1877 19.595 -7.011 -9.592 1.00 0.55 H new ATOM 0 HB THR A1877 18.370 -5.466 -11.319 1.00 0.69 H new ATOM 0 HG1 THR A1877 16.087 -6.358 -9.807 1.00 1.32 H new ATOM 0 HG21 THR A1877 17.075 -7.368 -12.203 1.00 0.94 H new ATOM 0 HG22 THR A1877 18.687 -7.875 -11.643 1.00 0.94 H new ATOM 0 HG23 THR A1877 17.253 -8.209 -10.644 1.00 0.94 H new ATOM 980 N SER A1878 18.614 -4.046 -8.545 1.00 0.40 N ATOM 981 CA SER A1878 19.030 -2.680 -8.306 1.00 0.40 C ATOM 982 C SER A1878 18.404 -2.184 -7.004 1.00 0.37 C ATOM 983 O SER A1878 17.280 -1.681 -6.997 1.00 0.38 O ATOM 984 CB SER A1878 18.596 -1.796 -9.478 1.00 0.47 C ATOM 985 OG SER A1878 19.348 -0.595 -9.536 1.00 1.17 O ATOM 0 H SER A1878 17.646 -4.235 -8.286 1.00 0.40 H new ATOM 0 HA SER A1878 20.116 -2.634 -8.219 1.00 0.40 H new ATOM 0 HB2 SER A1878 18.715 -2.345 -10.412 1.00 0.47 H new ATOM 0 HB3 SER A1878 17.537 -1.558 -9.381 1.00 0.47 H new ATOM 0 HG SER A1878 19.802 -0.452 -8.679 1.00 1.17 H new ATOM 991 N PRO A1879 19.116 -2.344 -5.879 1.00 0.38 N ATOM 992 CA PRO A1879 18.593 -2.005 -4.553 1.00 0.39 C ATOM 993 C PRO A1879 18.232 -0.529 -4.409 1.00 0.38 C ATOM 994 O PRO A1879 17.366 -0.174 -3.614 1.00 0.39 O ATOM 995 CB PRO A1879 19.737 -2.370 -3.603 1.00 0.46 C ATOM 996 CG PRO A1879 20.955 -2.411 -4.460 1.00 0.67 C ATOM 997 CD PRO A1879 20.490 -2.872 -5.809 1.00 0.44 C ATOM 0 HA PRO A1879 17.664 -2.537 -4.349 1.00 0.39 H new ATOM 0 HB2 PRO A1879 19.839 -1.632 -2.807 1.00 0.46 H new ATOM 0 HB3 PRO A1879 19.560 -3.333 -3.124 1.00 0.46 H new ATOM 0 HG2 PRO A1879 21.423 -1.428 -4.522 1.00 0.67 H new ATOM 0 HG3 PRO A1879 21.700 -3.093 -4.049 1.00 0.67 H new ATOM 0 HD2 PRO A1879 21.116 -2.477 -6.609 1.00 0.44 H new ATOM 0 HD3 PRO A1879 20.511 -3.958 -5.894 1.00 0.44 H new ATOM 1005 N GLU A1880 18.875 0.332 -5.190 1.00 0.42 N ATOM 1006 CA GLU A1880 18.613 1.763 -5.097 1.00 0.46 C ATOM 1007 C GLU A1880 17.347 2.143 -5.860 1.00 0.38 C ATOM 1008 O GLU A1880 16.877 3.277 -5.767 1.00 0.41 O ATOM 1009 CB GLU A1880 19.807 2.599 -5.585 1.00 0.62 C ATOM 1010 CG GLU A1880 20.283 2.280 -6.995 1.00 1.05 C ATOM 1011 CD GLU A1880 21.152 1.044 -7.047 1.00 1.39 C ATOM 1012 OE1 GLU A1880 22.364 1.154 -6.780 1.00 2.24 O ATOM 1013 OE2 GLU A1880 20.630 -0.041 -7.355 1.00 1.44 O ATOM 0 H GLU A1880 19.573 0.069 -5.886 1.00 0.42 H new ATOM 0 HA GLU A1880 18.461 1.989 -4.042 1.00 0.46 H new ATOM 0 HB2 GLU A1880 19.535 3.654 -5.539 1.00 0.62 H new ATOM 0 HB3 GLU A1880 20.639 2.454 -4.896 1.00 0.62 H new ATOM 0 HG2 GLU A1880 19.418 2.140 -7.644 1.00 1.05 H new ATOM 0 HG3 GLU A1880 20.842 3.130 -7.387 1.00 1.05 H new ATOM 1020 N GLU A1881 16.793 1.198 -6.613 1.00 0.36 N ATOM 1021 CA GLU A1881 15.524 1.426 -7.294 1.00 0.35 C ATOM 1022 C GLU A1881 14.357 1.229 -6.332 1.00 0.30 C ATOM 1023 O GLU A1881 13.214 1.543 -6.653 1.00 0.32 O ATOM 1024 CB GLU A1881 15.362 0.513 -8.514 1.00 0.45 C ATOM 1025 CG GLU A1881 16.318 0.837 -9.653 1.00 0.57 C ATOM 1026 CD GLU A1881 15.864 0.260 -10.983 1.00 1.06 C ATOM 1027 OE1 GLU A1881 14.835 0.727 -11.519 1.00 1.39 O ATOM 1028 OE2 GLU A1881 16.524 -0.667 -11.499 1.00 1.89 O ATOM 0 H GLU A1881 17.199 0.275 -6.766 1.00 0.36 H new ATOM 0 HA GLU A1881 15.525 2.457 -7.647 1.00 0.35 H new ATOM 0 HB2 GLU A1881 15.516 -0.521 -8.206 1.00 0.45 H new ATOM 0 HB3 GLU A1881 14.338 0.588 -8.879 1.00 0.45 H new ATOM 0 HG2 GLU A1881 16.413 1.919 -9.745 1.00 0.57 H new ATOM 0 HG3 GLU A1881 17.308 0.449 -9.412 1.00 0.57 H new ATOM 1035 N LEU A1882 14.655 0.706 -5.148 1.00 0.28 N ATOM 1036 CA LEU A1882 13.632 0.454 -4.141 1.00 0.29 C ATOM 1037 C LEU A1882 13.077 1.756 -3.573 1.00 0.31 C ATOM 1038 O LEU A1882 11.894 1.839 -3.253 1.00 0.32 O ATOM 1039 CB LEU A1882 14.200 -0.402 -3.011 1.00 0.30 C ATOM 1040 CG LEU A1882 14.601 -1.822 -3.411 1.00 0.31 C ATOM 1041 CD1 LEU A1882 15.290 -2.525 -2.251 1.00 0.34 C ATOM 1042 CD2 LEU A1882 13.383 -2.609 -3.868 1.00 0.34 C ATOM 0 H LEU A1882 15.599 0.448 -4.862 1.00 0.28 H new ATOM 0 HA LEU A1882 12.816 -0.082 -4.626 1.00 0.29 H new ATOM 0 HB2 LEU A1882 15.073 0.103 -2.598 1.00 0.30 H new ATOM 0 HB3 LEU A1882 13.459 -0.461 -2.214 1.00 0.30 H new ATOM 0 HG LEU A1882 15.303 -1.764 -4.243 1.00 0.31 H new ATOM 0 HD11 LEU A1882 15.569 -3.535 -2.552 1.00 0.34 H new ATOM 0 HD12 LEU A1882 16.185 -1.970 -1.969 1.00 0.34 H new ATOM 0 HD13 LEU A1882 14.610 -2.575 -1.400 1.00 0.34 H new ATOM 0 HD21 LEU A1882 13.686 -3.618 -4.149 1.00 0.34 H new ATOM 0 HD22 LEU A1882 12.658 -2.661 -3.056 1.00 0.34 H new ATOM 0 HD23 LEU A1882 12.931 -2.113 -4.727 1.00 0.34 H new ATOM 1054 N GLY A1883 13.933 2.766 -3.456 1.00 0.35 N ATOM 1055 CA GLY A1883 13.517 4.040 -2.887 1.00 0.38 C ATOM 1056 C GLY A1883 12.371 4.699 -3.646 1.00 0.34 C ATOM 1057 O GLY A1883 11.334 4.995 -3.050 1.00 0.35 O ATOM 0 H GLY A1883 14.910 2.727 -3.745 1.00 0.35 H new ATOM 0 HA2 GLY A1883 13.215 3.885 -1.851 1.00 0.38 H new ATOM 0 HA3 GLY A1883 14.370 4.718 -2.872 1.00 0.38 H new ATOM 1061 N PRO A1884 12.512 4.934 -4.968 1.00 0.33 N ATOM 1062 CA PRO A1884 11.436 5.509 -5.785 1.00 0.32 C ATOM 1063 C PRO A1884 10.158 4.676 -5.741 1.00 0.29 C ATOM 1064 O PRO A1884 9.050 5.213 -5.819 1.00 0.31 O ATOM 1065 CB PRO A1884 12.011 5.527 -7.209 1.00 0.37 C ATOM 1066 CG PRO A1884 13.215 4.650 -7.167 1.00 0.58 C ATOM 1067 CD PRO A1884 13.732 4.712 -5.759 1.00 0.36 C ATOM 0 HA PRO A1884 11.149 6.495 -5.421 1.00 0.32 H new ATOM 0 HB2 PRO A1884 11.282 5.158 -7.931 1.00 0.37 H new ATOM 0 HB3 PRO A1884 12.275 6.540 -7.512 1.00 0.37 H new ATOM 0 HG2 PRO A1884 12.961 3.627 -7.443 1.00 0.58 H new ATOM 0 HG3 PRO A1884 13.970 4.993 -7.874 1.00 0.58 H new ATOM 0 HD2 PRO A1884 14.236 3.789 -5.473 1.00 0.36 H new ATOM 0 HD3 PRO A1884 14.451 5.521 -5.628 1.00 0.36 H new ATOM 1075 N LEU A1885 10.312 3.367 -5.606 1.00 0.26 N ATOM 1076 CA LEU A1885 9.167 2.470 -5.563 1.00 0.26 C ATOM 1077 C LEU A1885 8.480 2.540 -4.216 1.00 0.27 C ATOM 1078 O LEU A1885 7.256 2.606 -4.142 1.00 0.27 O ATOM 1079 CB LEU A1885 9.593 1.034 -5.856 1.00 0.28 C ATOM 1080 CG LEU A1885 10.281 0.815 -7.200 1.00 0.35 C ATOM 1081 CD1 LEU A1885 10.763 -0.619 -7.313 1.00 0.36 C ATOM 1082 CD2 LEU A1885 9.343 1.154 -8.347 1.00 0.37 C ATOM 0 H LEU A1885 11.217 2.903 -5.525 1.00 0.26 H new ATOM 0 HA LEU A1885 8.463 2.790 -6.331 1.00 0.26 H new ATOM 0 HB2 LEU A1885 10.266 0.704 -5.065 1.00 0.28 H new ATOM 0 HB3 LEU A1885 8.711 0.395 -5.811 1.00 0.28 H new ATOM 0 HG LEU A1885 11.143 1.480 -7.260 1.00 0.35 H new ATOM 0 HD11 LEU A1885 11.252 -0.764 -8.276 1.00 0.36 H new ATOM 0 HD12 LEU A1885 11.471 -0.829 -6.511 1.00 0.36 H new ATOM 0 HD13 LEU A1885 9.913 -1.296 -7.233 1.00 0.36 H new ATOM 0 HD21 LEU A1885 9.854 0.991 -9.296 1.00 0.37 H new ATOM 0 HD22 LEU A1885 8.460 0.516 -8.296 1.00 0.37 H new ATOM 0 HD23 LEU A1885 9.041 2.199 -8.273 1.00 0.37 H new ATOM 1094 N ALA A1886 9.272 2.528 -3.151 1.00 0.29 N ATOM 1095 CA ALA A1886 8.741 2.699 -1.809 1.00 0.32 C ATOM 1096 C ALA A1886 7.968 4.004 -1.724 1.00 0.30 C ATOM 1097 O ALA A1886 6.957 4.104 -1.028 1.00 0.33 O ATOM 1098 CB ALA A1886 9.865 2.679 -0.783 1.00 0.36 C ATOM 0 H ALA A1886 10.283 2.402 -3.193 1.00 0.29 H new ATOM 0 HA ALA A1886 8.065 1.872 -1.590 1.00 0.32 H new ATOM 0 HB1 ALA A1886 9.448 2.808 0.216 1.00 0.36 H new ATOM 0 HB2 ALA A1886 10.390 1.725 -0.837 1.00 0.36 H new ATOM 0 HB3 ALA A1886 10.563 3.489 -0.993 1.00 0.36 H new ATOM 1104 N ASN A1887 8.443 4.997 -2.462 1.00 0.28 N ATOM 1105 CA ASN A1887 7.803 6.299 -2.492 1.00 0.28 C ATOM 1106 C ASN A1887 6.469 6.231 -3.224 1.00 0.25 C ATOM 1107 O ASN A1887 5.465 6.764 -2.753 1.00 0.25 O ATOM 1108 CB ASN A1887 8.703 7.328 -3.169 1.00 0.32 C ATOM 1109 CG ASN A1887 8.370 8.746 -2.753 1.00 0.77 C ATOM 1110 OD1 ASN A1887 7.494 9.393 -3.332 1.00 1.43 O ATOM 1111 ND2 ASN A1887 9.086 9.241 -1.758 1.00 1.04 N ATOM 0 H ASN A1887 9.273 4.922 -3.050 1.00 0.28 H new ATOM 0 HA ASN A1887 7.626 6.604 -1.461 1.00 0.28 H new ATOM 0 HB2 ASN A1887 9.743 7.115 -2.924 1.00 0.32 H new ATOM 0 HB3 ASN A1887 8.605 7.237 -4.251 1.00 0.32 H new ATOM 0 HD21 ASN A1887 8.924 10.196 -1.439 1.00 1.04 H new ATOM 0 HD22 ASN A1887 9.800 8.668 -1.309 1.00 1.04 H new ATOM 1118 N GLN A1888 6.460 5.561 -4.371 1.00 0.27 N ATOM 1119 CA GLN A1888 5.262 5.477 -5.196 1.00 0.28 C ATOM 1120 C GLN A1888 4.221 4.570 -4.547 1.00 0.25 C ATOM 1121 O GLN A1888 3.021 4.834 -4.624 1.00 0.26 O ATOM 1122 CB GLN A1888 5.611 4.969 -6.595 1.00 0.34 C ATOM 1123 CG GLN A1888 4.460 5.069 -7.581 1.00 0.44 C ATOM 1124 CD GLN A1888 4.822 4.546 -8.954 1.00 0.59 C ATOM 1125 OE1 GLN A1888 5.316 5.283 -9.806 1.00 1.07 O ATOM 1126 NE2 GLN A1888 4.576 3.268 -9.174 1.00 0.78 N ATOM 0 H GLN A1888 7.269 5.069 -4.750 1.00 0.27 H new ATOM 0 HA GLN A1888 4.838 6.477 -5.284 1.00 0.28 H new ATOM 0 HB2 GLN A1888 6.458 5.538 -6.979 1.00 0.34 H new ATOM 0 HB3 GLN A1888 5.931 3.929 -6.526 1.00 0.34 H new ATOM 0 HG2 GLN A1888 3.607 4.509 -7.196 1.00 0.44 H new ATOM 0 HG3 GLN A1888 4.147 6.110 -7.664 1.00 0.44 H new ATOM 0 HE21 GLN A1888 4.165 2.694 -8.438 1.00 0.78 H new ATOM 0 HE22 GLN A1888 4.797 2.855 -10.080 1.00 0.78 H new ATOM 1135 N LEU A1889 4.688 3.509 -3.900 1.00 0.22 N ATOM 1136 CA LEU A1889 3.804 2.607 -3.174 1.00 0.19 C ATOM 1137 C LEU A1889 3.136 3.359 -2.028 1.00 0.20 C ATOM 1138 O LEU A1889 1.989 3.094 -1.677 1.00 0.25 O ATOM 1139 CB LEU A1889 4.592 1.408 -2.636 1.00 0.18 C ATOM 1140 CG LEU A1889 3.746 0.294 -2.015 1.00 0.18 C ATOM 1141 CD1 LEU A1889 2.812 -0.310 -3.053 1.00 0.21 C ATOM 1142 CD2 LEU A1889 4.640 -0.781 -1.416 1.00 0.18 C ATOM 0 H LEU A1889 5.675 3.253 -3.864 1.00 0.22 H new ATOM 0 HA LEU A1889 3.036 2.236 -3.853 1.00 0.19 H new ATOM 0 HB2 LEU A1889 5.179 0.984 -3.451 1.00 0.18 H new ATOM 0 HB3 LEU A1889 5.299 1.765 -1.887 1.00 0.18 H new ATOM 0 HG LEU A1889 3.141 0.726 -1.218 1.00 0.18 H new ATOM 0 HD11 LEU A1889 2.219 -1.100 -2.593 1.00 0.21 H new ATOM 0 HD12 LEU A1889 2.148 0.464 -3.439 1.00 0.21 H new ATOM 0 HD13 LEU A1889 3.399 -0.727 -3.872 1.00 0.21 H new ATOM 0 HD21 LEU A1889 4.023 -1.566 -0.979 1.00 0.18 H new ATOM 0 HD22 LEU A1889 5.269 -1.208 -2.197 1.00 0.18 H new ATOM 0 HD23 LEU A1889 5.270 -0.341 -0.642 1.00 0.18 H new ATOM 1154 N THR A1890 3.867 4.312 -1.467 1.00 0.20 N ATOM 1155 CA THR A1890 3.357 5.160 -0.401 1.00 0.22 C ATOM 1156 C THR A1890 2.323 6.158 -0.929 1.00 0.23 C ATOM 1157 O THR A1890 1.213 6.257 -0.399 1.00 0.24 O ATOM 1158 CB THR A1890 4.513 5.927 0.273 1.00 0.23 C ATOM 1159 OG1 THR A1890 5.367 5.007 0.968 1.00 0.25 O ATOM 1160 CG2 THR A1890 3.997 6.988 1.236 1.00 0.28 C ATOM 0 H THR A1890 4.828 4.518 -1.738 1.00 0.20 H new ATOM 0 HA THR A1890 2.872 4.514 0.331 1.00 0.22 H new ATOM 0 HB THR A1890 5.079 6.435 -0.508 1.00 0.23 H new ATOM 0 HG1 THR A1890 5.900 4.502 0.319 1.00 0.25 H new ATOM 0 HG21 THR A1890 4.840 7.507 1.691 1.00 0.28 H new ATOM 0 HG22 THR A1890 3.381 7.704 0.692 1.00 0.28 H new ATOM 0 HG23 THR A1890 3.400 6.513 2.015 1.00 0.28 H new ATOM 1168 N SER A1891 2.687 6.878 -1.982 1.00 0.23 N ATOM 1169 CA SER A1891 1.850 7.940 -2.513 1.00 0.26 C ATOM 1170 C SER A1891 0.530 7.401 -3.048 1.00 0.26 C ATOM 1171 O SER A1891 -0.547 7.892 -2.695 1.00 0.28 O ATOM 1172 CB SER A1891 2.611 8.680 -3.606 1.00 0.30 C ATOM 1173 OG SER A1891 3.158 7.777 -4.552 1.00 1.17 O ATOM 0 H SER A1891 3.563 6.743 -2.487 1.00 0.23 H new ATOM 0 HA SER A1891 1.610 8.630 -1.704 1.00 0.26 H new ATOM 0 HB2 SER A1891 1.942 9.377 -4.110 1.00 0.30 H new ATOM 0 HB3 SER A1891 3.410 9.271 -3.159 1.00 0.30 H new ATOM 0 HG SER A1891 3.640 8.279 -5.243 1.00 1.17 H new ATOM 1179 N ASP A1892 0.622 6.392 -3.899 1.00 0.26 N ATOM 1180 CA ASP A1892 -0.569 5.772 -4.481 1.00 0.28 C ATOM 1181 C ASP A1892 -1.430 5.095 -3.419 1.00 0.24 C ATOM 1182 O ASP A1892 -2.654 5.043 -3.549 1.00 0.25 O ATOM 1183 CB ASP A1892 -0.197 4.771 -5.575 1.00 0.33 C ATOM 1184 CG ASP A1892 -0.254 5.389 -6.958 1.00 0.50 C ATOM 1185 OD1 ASP A1892 -1.371 5.683 -7.435 1.00 0.73 O ATOM 1186 OD2 ASP A1892 0.814 5.589 -7.576 1.00 0.80 O ATOM 0 H ASP A1892 1.504 5.982 -4.205 1.00 0.26 H new ATOM 0 HA ASP A1892 -1.155 6.574 -4.930 1.00 0.28 H new ATOM 0 HB2 ASP A1892 0.807 4.390 -5.390 1.00 0.33 H new ATOM 0 HB3 ASP A1892 -0.875 3.919 -5.531 1.00 0.33 H new ATOM 1191 N TYR A1893 -0.803 4.586 -2.363 1.00 0.24 N ATOM 1192 CA TYR A1893 -1.555 4.000 -1.257 1.00 0.23 C ATOM 1193 C TYR A1893 -2.427 5.058 -0.591 1.00 0.22 C ATOM 1194 O TYR A1893 -3.582 4.796 -0.251 1.00 0.23 O ATOM 1195 CB TYR A1893 -0.621 3.365 -0.221 1.00 0.24 C ATOM 1196 CG TYR A1893 -1.332 2.946 1.047 1.00 0.22 C ATOM 1197 CD1 TYR A1893 -2.071 1.772 1.101 1.00 0.26 C ATOM 1198 CD2 TYR A1893 -1.273 3.736 2.188 1.00 0.26 C ATOM 1199 CE1 TYR A1893 -2.732 1.400 2.256 1.00 0.28 C ATOM 1200 CE2 TYR A1893 -1.929 3.369 3.345 1.00 0.27 C ATOM 1201 CZ TYR A1893 -2.659 2.202 3.375 1.00 0.25 C ATOM 1202 OH TYR A1893 -3.317 1.841 4.528 1.00 0.31 O ATOM 0 H TYR A1893 0.210 4.567 -2.249 1.00 0.24 H new ATOM 0 HA TYR A1893 -2.191 3.215 -1.666 1.00 0.23 H new ATOM 0 HB2 TYR A1893 -0.138 2.494 -0.663 1.00 0.24 H new ATOM 0 HB3 TYR A1893 0.168 4.074 0.030 1.00 0.24 H new ATOM 0 HD1 TYR A1893 -2.130 1.140 0.227 1.00 0.26 H new ATOM 0 HD2 TYR A1893 -0.704 4.654 2.169 1.00 0.26 H new ATOM 0 HE1 TYR A1893 -3.304 0.484 2.282 1.00 0.28 H new ATOM 0 HE2 TYR A1893 -1.870 3.995 4.223 1.00 0.27 H new ATOM 0 HH TYR A1893 -3.773 0.985 4.390 1.00 0.31 H new ATOM 1212 N GLY A1894 -1.869 6.253 -0.419 1.00 0.25 N ATOM 1213 CA GLY A1894 -2.617 7.351 0.171 1.00 0.29 C ATOM 1214 C GLY A1894 -3.874 7.672 -0.615 1.00 0.29 C ATOM 1215 O GLY A1894 -4.879 8.108 -0.047 1.00 0.31 O ATOM 0 H GLY A1894 -0.909 6.482 -0.678 1.00 0.25 H new ATOM 0 HA2 GLY A1894 -2.886 7.096 1.196 1.00 0.29 H new ATOM 0 HA3 GLY A1894 -1.983 8.237 0.218 1.00 0.29 H new ATOM 1219 N ARG A1895 -3.824 7.431 -1.920 1.00 0.33 N ATOM 1220 CA ARG A1895 -4.974 7.644 -2.784 1.00 0.37 C ATOM 1221 C ARG A1895 -6.071 6.650 -2.431 1.00 0.36 C ATOM 1222 O ARG A1895 -7.201 7.035 -2.142 1.00 0.40 O ATOM 1223 CB ARG A1895 -4.575 7.497 -4.257 1.00 0.47 C ATOM 1224 CG ARG A1895 -3.640 8.591 -4.750 1.00 0.87 C ATOM 1225 CD ARG A1895 -3.178 8.335 -6.177 1.00 0.91 C ATOM 1226 NE ARG A1895 -2.468 9.487 -6.736 1.00 1.56 N ATOM 1227 CZ ARG A1895 -1.563 9.413 -7.715 1.00 2.06 C ATOM 1228 NH1 ARG A1895 -1.182 8.238 -8.198 1.00 1.98 N ATOM 1229 NH2 ARG A1895 -1.026 10.527 -8.197 1.00 3.04 N ATOM 0 H ARG A1895 -2.994 7.086 -2.403 1.00 0.33 H new ATOM 0 HA ARG A1895 -5.347 8.657 -2.632 1.00 0.37 H new ATOM 0 HB2 ARG A1895 -4.094 6.529 -4.399 1.00 0.47 H new ATOM 0 HB3 ARG A1895 -5.476 7.498 -4.870 1.00 0.47 H new ATOM 0 HG2 ARG A1895 -4.148 9.554 -4.699 1.00 0.87 H new ATOM 0 HG3 ARG A1895 -2.773 8.653 -4.092 1.00 0.87 H new ATOM 0 HD2 ARG A1895 -2.525 7.462 -6.196 1.00 0.91 H new ATOM 0 HD3 ARG A1895 -4.040 8.102 -6.802 1.00 0.91 H new ATOM 0 HE ARG A1895 -2.679 10.408 -6.352 1.00 1.56 H new ATOM 0 HH11 ARG A1895 -1.581 7.378 -7.822 1.00 1.98 H new ATOM 0 HH12 ARG A1895 -0.490 8.194 -8.946 1.00 1.98 H new ATOM 0 HH21 ARG A1895 -1.305 11.433 -7.820 1.00 3.04 H new ATOM 0 HH22 ARG A1895 -0.334 10.478 -8.945 1.00 3.04 H new ATOM 1243 N LEU A1896 -5.715 5.370 -2.413 1.00 0.35 N ATOM 1244 CA LEU A1896 -6.658 4.314 -2.060 1.00 0.39 C ATOM 1245 C LEU A1896 -7.195 4.497 -0.649 1.00 0.36 C ATOM 1246 O LEU A1896 -8.383 4.308 -0.401 1.00 0.43 O ATOM 1247 CB LEU A1896 -6.002 2.941 -2.180 1.00 0.43 C ATOM 1248 CG LEU A1896 -5.928 2.381 -3.596 1.00 0.41 C ATOM 1249 CD1 LEU A1896 -5.305 0.996 -3.584 1.00 0.86 C ATOM 1250 CD2 LEU A1896 -7.314 2.334 -4.217 1.00 0.72 C ATOM 0 H LEU A1896 -4.778 5.038 -2.639 1.00 0.35 H new ATOM 0 HA LEU A1896 -7.491 4.378 -2.760 1.00 0.39 H new ATOM 0 HB2 LEU A1896 -4.991 3.002 -1.777 1.00 0.43 H new ATOM 0 HB3 LEU A1896 -6.552 2.237 -1.556 1.00 0.43 H new ATOM 0 HG LEU A1896 -5.300 3.038 -4.198 1.00 0.41 H new ATOM 0 HD11 LEU A1896 -5.259 0.609 -4.602 1.00 0.86 H new ATOM 0 HD12 LEU A1896 -4.298 1.054 -3.172 1.00 0.86 H new ATOM 0 HD13 LEU A1896 -5.911 0.330 -2.970 1.00 0.86 H new ATOM 0 HD21 LEU A1896 -7.246 1.932 -5.228 1.00 0.72 H new ATOM 0 HD22 LEU A1896 -7.961 1.696 -3.615 1.00 0.72 H new ATOM 0 HD23 LEU A1896 -7.731 3.341 -4.254 1.00 0.72 H new ATOM 1262 N ALA A1897 -6.315 4.873 0.268 1.00 0.32 N ATOM 1263 CA ALA A1897 -6.697 5.079 1.660 1.00 0.37 C ATOM 1264 C ALA A1897 -7.739 6.187 1.791 1.00 0.38 C ATOM 1265 O ALA A1897 -8.540 6.192 2.725 1.00 0.49 O ATOM 1266 CB ALA A1897 -5.474 5.405 2.495 1.00 0.42 C ATOM 0 H ALA A1897 -5.328 5.042 0.073 1.00 0.32 H new ATOM 0 HA ALA A1897 -7.143 4.155 2.028 1.00 0.37 H new ATOM 0 HB1 ALA A1897 -5.772 5.557 3.533 1.00 0.42 H new ATOM 0 HB2 ALA A1897 -4.764 4.580 2.438 1.00 0.42 H new ATOM 0 HB3 ALA A1897 -5.006 6.313 2.115 1.00 0.42 H new ATOM 1272 N SER A1898 -7.723 7.122 0.855 1.00 0.34 N ATOM 1273 CA SER A1898 -8.689 8.206 0.853 1.00 0.40 C ATOM 1274 C SER A1898 -9.980 7.771 0.161 1.00 0.35 C ATOM 1275 O SER A1898 -11.076 8.073 0.632 1.00 0.42 O ATOM 1276 CB SER A1898 -8.097 9.432 0.154 1.00 0.50 C ATOM 1277 OG SER A1898 -6.881 9.832 0.769 1.00 1.38 O ATOM 0 H SER A1898 -7.052 7.151 0.088 1.00 0.34 H new ATOM 0 HA SER A1898 -8.924 8.467 1.885 1.00 0.40 H new ATOM 0 HB2 SER A1898 -7.919 9.205 -0.897 1.00 0.50 H new ATOM 0 HB3 SER A1898 -8.812 10.254 0.186 1.00 0.50 H new ATOM 0 HG SER A1898 -6.178 9.184 0.555 1.00 1.38 H new ATOM 1283 N GLN A1899 -9.830 7.027 -0.933 1.00 0.32 N ATOM 1284 CA GLN A1899 -10.959 6.614 -1.767 1.00 0.33 C ATOM 1285 C GLN A1899 -11.792 5.517 -1.106 1.00 0.28 C ATOM 1286 O GLN A1899 -12.988 5.392 -1.372 1.00 0.32 O ATOM 1287 CB GLN A1899 -10.447 6.115 -3.119 1.00 0.41 C ATOM 1288 CG GLN A1899 -9.699 7.170 -3.918 1.00 0.56 C ATOM 1289 CD GLN A1899 -8.926 6.577 -5.079 1.00 0.76 C ATOM 1290 OE1 GLN A1899 -9.433 5.491 -5.640 1.00 1.56 O flip ATOM 1291 NE2 GLN A1899 -7.882 7.095 -5.474 1.00 1.15 N flip ATOM 0 H GLN A1899 -8.925 6.694 -1.266 1.00 0.32 H new ATOM 0 HA GLN A1899 -11.600 7.485 -1.903 1.00 0.33 H new ATOM 0 HB2 GLN A1899 -9.789 5.262 -2.955 1.00 0.41 H new ATOM 0 HB3 GLN A1899 -11.292 5.758 -3.708 1.00 0.41 H new ATOM 0 HG2 GLN A1899 -10.409 7.906 -4.296 1.00 0.56 H new ATOM 0 HG3 GLN A1899 -9.010 7.700 -3.260 1.00 0.56 H new ATOM 0 HE21 GLN A1899 -7.523 7.932 -5.015 1.00 1.15 H new ATOM 0 HE22 GLN A1899 -7.376 6.687 -6.260 1.00 1.15 H new ATOM 1300 N ALA A1900 -11.159 4.724 -0.251 1.00 0.26 N ATOM 1301 CA ALA A1900 -11.836 3.616 0.418 1.00 0.28 C ATOM 1302 C ALA A1900 -12.940 4.111 1.350 1.00 0.30 C ATOM 1303 O ALA A1900 -13.900 3.392 1.630 1.00 0.34 O ATOM 1304 CB ALA A1900 -10.832 2.775 1.192 1.00 0.33 C ATOM 0 H ALA A1900 -10.175 4.826 -0.003 1.00 0.26 H new ATOM 0 HA ALA A1900 -12.302 3.000 -0.351 1.00 0.28 H new ATOM 0 HB1 ALA A1900 -11.350 1.953 1.686 1.00 0.33 H new ATOM 0 HB2 ALA A1900 -10.087 2.374 0.505 1.00 0.33 H new ATOM 0 HB3 ALA A1900 -10.339 3.395 1.941 1.00 0.33 H new ATOM 1310 N LYS A1901 -12.800 5.341 1.827 1.00 0.34 N ATOM 1311 CA LYS A1901 -13.767 5.908 2.757 1.00 0.42 C ATOM 1312 C LYS A1901 -15.115 6.198 2.075 1.00 0.41 C ATOM 1313 O LYS A1901 -16.147 5.712 2.541 1.00 0.46 O ATOM 1314 CB LYS A1901 -13.195 7.156 3.441 1.00 0.52 C ATOM 1315 CG LYS A1901 -12.029 6.838 4.366 1.00 0.79 C ATOM 1316 CD LYS A1901 -11.532 8.061 5.122 1.00 1.18 C ATOM 1317 CE LYS A1901 -10.805 9.041 4.214 1.00 1.69 C ATOM 1318 NZ LYS A1901 -10.236 10.184 4.978 1.00 2.27 N ATOM 0 H LYS A1901 -12.029 5.963 1.586 1.00 0.34 H new ATOM 0 HA LYS A1901 -13.962 5.164 3.529 1.00 0.42 H new ATOM 0 HB2 LYS A1901 -12.867 7.864 2.680 1.00 0.52 H new ATOM 0 HB3 LYS A1901 -13.984 7.645 4.013 1.00 0.52 H new ATOM 0 HG2 LYS A1901 -12.335 6.073 5.080 1.00 0.79 H new ATOM 0 HG3 LYS A1901 -11.210 6.419 3.781 1.00 0.79 H new ATOM 0 HD2 LYS A1901 -12.377 8.563 5.593 1.00 1.18 H new ATOM 0 HD3 LYS A1901 -10.863 7.744 5.922 1.00 1.18 H new ATOM 0 HE2 LYS A1901 -10.005 8.522 3.686 1.00 1.69 H new ATOM 0 HE3 LYS A1901 -11.495 9.416 3.458 1.00 1.69 H new ATOM 0 HZ1 LYS A1901 -9.976 10.946 4.320 1.00 2.27 H new ATOM 0 HZ2 LYS A1901 -10.943 10.536 5.654 1.00 2.27 H new ATOM 0 HZ3 LYS A1901 -9.390 9.869 5.495 1.00 2.27 H new ATOM 1332 N PRO A1902 -15.149 6.979 0.971 1.00 0.41 N ATOM 1333 CA PRO A1902 -16.390 7.217 0.226 1.00 0.46 C ATOM 1334 C PRO A1902 -16.942 5.935 -0.392 1.00 0.42 C ATOM 1335 O PRO A1902 -18.149 5.788 -0.561 1.00 0.48 O ATOM 1336 CB PRO A1902 -15.989 8.206 -0.874 1.00 0.51 C ATOM 1337 CG PRO A1902 -14.689 8.776 -0.434 1.00 0.60 C ATOM 1338 CD PRO A1902 -14.019 7.703 0.369 1.00 0.43 C ATOM 0 HA PRO A1902 -17.179 7.594 0.876 1.00 0.46 H new ATOM 0 HB2 PRO A1902 -15.893 7.705 -1.837 1.00 0.51 H new ATOM 0 HB3 PRO A1902 -16.740 8.987 -0.994 1.00 0.51 H new ATOM 0 HG2 PRO A1902 -14.078 9.061 -1.290 1.00 0.60 H new ATOM 0 HG3 PRO A1902 -14.839 9.675 0.164 1.00 0.60 H new ATOM 0 HD2 PRO A1902 -13.411 7.051 -0.258 1.00 0.43 H new ATOM 0 HD3 PRO A1902 -13.358 8.121 1.128 1.00 0.43 H new ATOM 1346 N ALA A1903 -16.049 5.010 -0.727 1.00 0.35 N ATOM 1347 CA ALA A1903 -16.458 3.726 -1.285 1.00 0.35 C ATOM 1348 C ALA A1903 -17.271 2.933 -0.269 1.00 0.35 C ATOM 1349 O ALA A1903 -18.278 2.312 -0.612 1.00 0.39 O ATOM 1350 CB ALA A1903 -15.242 2.927 -1.729 1.00 0.32 C ATOM 0 H ALA A1903 -15.041 5.124 -0.622 1.00 0.35 H new ATOM 0 HA ALA A1903 -17.086 3.916 -2.156 1.00 0.35 H new ATOM 0 HB1 ALA A1903 -15.565 1.972 -2.143 1.00 0.32 H new ATOM 0 HB2 ALA A1903 -14.697 3.486 -2.490 1.00 0.32 H new ATOM 0 HB3 ALA A1903 -14.591 2.750 -0.873 1.00 0.32 H new ATOM 1356 N ALA A1904 -16.835 2.978 0.984 1.00 0.35 N ATOM 1357 CA ALA A1904 -17.500 2.252 2.060 1.00 0.38 C ATOM 1358 C ALA A1904 -18.928 2.751 2.272 1.00 0.43 C ATOM 1359 O ALA A1904 -19.852 1.955 2.435 1.00 0.46 O ATOM 1360 CB ALA A1904 -16.698 2.370 3.350 1.00 0.41 C ATOM 0 H ALA A1904 -16.019 3.513 1.281 1.00 0.35 H new ATOM 0 HA ALA A1904 -17.555 1.202 1.772 1.00 0.38 H new ATOM 0 HB1 ALA A1904 -17.205 1.824 4.145 1.00 0.41 H new ATOM 0 HB2 ALA A1904 -15.703 1.951 3.199 1.00 0.41 H new ATOM 0 HB3 ALA A1904 -16.611 3.420 3.630 1.00 0.41 H new ATOM 1366 N VAL A1905 -19.104 4.066 2.261 1.00 0.47 N ATOM 1367 CA VAL A1905 -20.417 4.662 2.493 1.00 0.54 C ATOM 1368 C VAL A1905 -21.315 4.519 1.259 1.00 0.54 C ATOM 1369 O VAL A1905 -22.542 4.478 1.371 1.00 0.61 O ATOM 1370 CB VAL A1905 -20.302 6.153 2.903 1.00 0.63 C ATOM 1371 CG1 VAL A1905 -19.798 7.010 1.754 1.00 1.25 C ATOM 1372 CG2 VAL A1905 -21.632 6.677 3.425 1.00 1.26 C ATOM 0 H VAL A1905 -18.357 4.740 2.094 1.00 0.47 H new ATOM 0 HA VAL A1905 -20.875 4.118 3.319 1.00 0.54 H new ATOM 0 HB VAL A1905 -19.570 6.216 3.708 1.00 0.63 H new ATOM 0 HG11 VAL A1905 -19.730 8.049 2.077 1.00 1.25 H new ATOM 0 HG12 VAL A1905 -18.813 6.661 1.445 1.00 1.25 H new ATOM 0 HG13 VAL A1905 -20.489 6.936 0.914 1.00 1.25 H new ATOM 0 HG21 VAL A1905 -21.525 7.725 3.706 1.00 1.26 H new ATOM 0 HG22 VAL A1905 -22.390 6.585 2.647 1.00 1.26 H new ATOM 0 HG23 VAL A1905 -21.935 6.097 4.297 1.00 1.26 H new ATOM 1382 N ALA A1906 -20.701 4.422 0.084 1.00 0.50 N ATOM 1383 CA ALA A1906 -21.450 4.278 -1.158 1.00 0.52 C ATOM 1384 C ALA A1906 -21.953 2.851 -1.329 1.00 0.54 C ATOM 1385 O ALA A1906 -22.861 2.592 -2.122 1.00 0.64 O ATOM 1386 CB ALA A1906 -20.594 4.682 -2.346 1.00 0.52 C ATOM 0 H ALA A1906 -19.688 4.441 -0.033 1.00 0.50 H new ATOM 0 HA ALA A1906 -22.314 4.940 -1.109 1.00 0.52 H new ATOM 0 HB1 ALA A1906 -21.170 4.568 -3.265 1.00 0.52 H new ATOM 0 HB2 ALA A1906 -20.287 5.722 -2.237 1.00 0.52 H new ATOM 0 HB3 ALA A1906 -19.710 4.046 -2.390 1.00 0.52 H new ATOM 1392 N ALA A1907 -21.351 1.929 -0.589 1.00 0.51 N ATOM 1393 CA ALA A1907 -21.769 0.538 -0.618 1.00 0.61 C ATOM 1394 C ALA A1907 -23.124 0.383 0.056 1.00 0.79 C ATOM 1395 O ALA A1907 -23.421 1.067 1.038 1.00 0.85 O ATOM 1396 CB ALA A1907 -20.730 -0.344 0.057 1.00 0.54 C ATOM 0 H ALA A1907 -20.571 2.122 0.039 1.00 0.51 H new ATOM 0 HA ALA A1907 -21.861 0.222 -1.657 1.00 0.61 H new ATOM 0 HB1 ALA A1907 -21.059 -1.383 0.026 1.00 0.54 H new ATOM 0 HB2 ALA A1907 -19.778 -0.249 -0.465 1.00 0.54 H new ATOM 0 HB3 ALA A1907 -20.607 -0.033 1.094 1.00 0.54 H new ATOM 1402 N GLU A1908 -23.946 -0.509 -0.471 1.00 0.97 N ATOM 1403 CA GLU A1908 -25.295 -0.701 0.043 1.00 1.19 C ATOM 1404 C GLU A1908 -25.302 -1.656 1.234 1.00 1.13 C ATOM 1405 O GLU A1908 -26.340 -1.885 1.853 1.00 1.25 O ATOM 1406 CB GLU A1908 -26.220 -1.216 -1.060 1.00 1.45 C ATOM 1407 CG GLU A1908 -25.803 -2.560 -1.627 1.00 1.66 C ATOM 1408 CD GLU A1908 -26.602 -2.951 -2.850 1.00 2.12 C ATOM 1409 OE1 GLU A1908 -27.701 -3.519 -2.691 1.00 2.67 O ATOM 1410 OE2 GLU A1908 -26.134 -2.692 -3.979 1.00 2.66 O ATOM 0 H GLU A1908 -23.704 -1.113 -1.256 1.00 0.97 H new ATOM 0 HA GLU A1908 -25.664 0.266 0.386 1.00 1.19 H new ATOM 0 HB2 GLU A1908 -27.233 -1.297 -0.665 1.00 1.45 H new ATOM 0 HB3 GLU A1908 -26.250 -0.484 -1.868 1.00 1.45 H new ATOM 0 HG2 GLU A1908 -24.744 -2.528 -1.885 1.00 1.66 H new ATOM 0 HG3 GLU A1908 -25.922 -3.326 -0.860 1.00 1.66 H new ATOM 1417 N ASN A1909 -24.140 -2.205 1.556 1.00 1.07 N ATOM 1418 CA ASN A1909 -24.024 -3.134 2.670 1.00 1.04 C ATOM 1419 C ASN A1909 -22.784 -2.800 3.500 1.00 0.92 C ATOM 1420 O ASN A1909 -21.696 -2.620 2.952 1.00 0.83 O ATOM 1421 CB ASN A1909 -23.960 -4.571 2.143 1.00 1.07 C ATOM 1422 CG ASN A1909 -24.218 -5.603 3.222 1.00 1.51 C ATOM 1423 OD1 ASN A1909 -25.367 -5.940 3.508 1.00 2.18 O ATOM 1424 ND2 ASN A1909 -23.158 -6.141 3.802 1.00 1.92 N ATOM 0 H ASN A1909 -23.266 -2.024 1.063 1.00 1.07 H new ATOM 0 HA ASN A1909 -24.900 -3.042 3.312 1.00 1.04 H new ATOM 0 HB2 ASN A1909 -24.693 -4.694 1.346 1.00 1.07 H new ATOM 0 HB3 ASN A1909 -22.979 -4.749 1.703 1.00 1.07 H new ATOM 0 HD21 ASN A1909 -23.277 -6.862 4.514 1.00 1.92 H new ATOM 0 HD22 ASN A1909 -22.222 -5.835 3.538 1.00 1.92 H new ATOM 1431 N GLU A1910 -22.958 -2.724 4.817 1.00 0.98 N ATOM 1432 CA GLU A1910 -21.890 -2.304 5.729 1.00 0.93 C ATOM 1433 C GLU A1910 -20.695 -3.246 5.656 1.00 0.79 C ATOM 1434 O GLU A1910 -19.551 -2.800 5.578 1.00 0.69 O ATOM 1435 CB GLU A1910 -22.412 -2.245 7.169 1.00 1.11 C ATOM 1436 CG GLU A1910 -21.343 -1.922 8.206 1.00 1.19 C ATOM 1437 CD GLU A1910 -20.815 -0.504 8.097 1.00 1.53 C ATOM 1438 OE1 GLU A1910 -21.439 0.415 8.664 1.00 1.92 O ATOM 1439 OE2 GLU A1910 -19.780 -0.307 7.427 1.00 2.24 O ATOM 0 H GLU A1910 -23.837 -2.950 5.283 1.00 0.98 H new ATOM 0 HA GLU A1910 -21.564 -1.311 5.420 1.00 0.93 H new ATOM 0 HB2 GLU A1910 -23.199 -1.493 7.228 1.00 1.11 H new ATOM 0 HB3 GLU A1910 -22.867 -3.203 7.419 1.00 1.11 H new ATOM 0 HG2 GLU A1910 -21.756 -2.074 9.203 1.00 1.19 H new ATOM 0 HG3 GLU A1910 -20.514 -2.621 8.094 1.00 1.19 H new ATOM 1446 N GLU A1911 -20.963 -4.547 5.671 1.00 0.82 N ATOM 1447 CA GLU A1911 -19.901 -5.552 5.628 1.00 0.74 C ATOM 1448 C GLU A1911 -19.045 -5.398 4.375 1.00 0.62 C ATOM 1449 O GLU A1911 -17.905 -5.854 4.337 1.00 0.53 O ATOM 1450 CB GLU A1911 -20.472 -6.972 5.690 1.00 0.87 C ATOM 1451 CG GLU A1911 -21.271 -7.275 6.953 1.00 1.06 C ATOM 1452 CD GLU A1911 -22.676 -6.710 6.910 1.00 1.80 C ATOM 1453 OE1 GLU A1911 -23.555 -7.358 6.309 1.00 2.49 O ATOM 1454 OE2 GLU A1911 -22.906 -5.615 7.458 1.00 2.32 O ATOM 0 H GLU A1911 -21.906 -4.933 5.713 1.00 0.82 H new ATOM 0 HA GLU A1911 -19.274 -5.390 6.505 1.00 0.74 H new ATOM 0 HB2 GLU A1911 -21.113 -7.131 4.823 1.00 0.87 H new ATOM 0 HB3 GLU A1911 -19.651 -7.684 5.615 1.00 0.87 H new ATOM 0 HG2 GLU A1911 -21.323 -8.355 7.094 1.00 1.06 H new ATOM 0 HG3 GLU A1911 -20.746 -6.866 7.816 1.00 1.06 H new ATOM 1461 N ILE A1912 -19.591 -4.746 3.356 1.00 0.68 N ATOM 1462 CA ILE A1912 -18.845 -4.481 2.138 1.00 0.63 C ATOM 1463 C ILE A1912 -17.881 -3.325 2.366 1.00 0.52 C ATOM 1464 O ILE A1912 -16.698 -3.424 2.048 1.00 0.49 O ATOM 1465 CB ILE A1912 -19.779 -4.154 0.954 1.00 0.73 C ATOM 1466 CG1 ILE A1912 -20.667 -5.361 0.633 1.00 0.89 C ATOM 1467 CG2 ILE A1912 -18.974 -3.736 -0.269 1.00 0.70 C ATOM 1468 CD1 ILE A1912 -19.893 -6.614 0.284 1.00 0.83 C ATOM 0 H ILE A1912 -20.548 -4.392 3.351 1.00 0.68 H new ATOM 0 HA ILE A1912 -18.289 -5.384 1.885 1.00 0.63 H new ATOM 0 HB ILE A1912 -20.418 -3.318 1.237 1.00 0.73 H new ATOM 0 HG12 ILE A1912 -21.307 -5.568 1.491 1.00 0.89 H new ATOM 0 HG13 ILE A1912 -21.323 -5.107 -0.200 1.00 0.89 H new ATOM 0 HG21 ILE A1912 -19.653 -3.510 -1.092 1.00 0.70 H new ATOM 0 HG22 ILE A1912 -18.385 -2.850 -0.031 1.00 0.70 H new ATOM 0 HG23 ILE A1912 -18.308 -4.548 -0.561 1.00 0.70 H new ATOM 0 HD11 ILE A1912 -20.590 -7.424 0.069 1.00 0.83 H new ATOM 0 HD12 ILE A1912 -19.273 -6.427 -0.593 1.00 0.83 H new ATOM 0 HD13 ILE A1912 -19.258 -6.895 1.124 1.00 0.83 H new ATOM 1480 N GLY A1913 -18.394 -2.242 2.938 1.00 0.51 N ATOM 1481 CA GLY A1913 -17.551 -1.112 3.277 1.00 0.45 C ATOM 1482 C GLY A1913 -16.486 -1.497 4.281 1.00 0.41 C ATOM 1483 O GLY A1913 -15.331 -1.082 4.166 1.00 0.38 O ATOM 0 H GLY A1913 -19.380 -2.127 3.173 1.00 0.51 H new ATOM 0 HA2 GLY A1913 -17.079 -0.725 2.374 1.00 0.45 H new ATOM 0 HA3 GLY A1913 -18.164 -0.309 3.685 1.00 0.45 H new ATOM 1487 N ALA A1914 -16.883 -2.305 5.261 1.00 0.44 N ATOM 1488 CA ALA A1914 -15.955 -2.867 6.232 1.00 0.41 C ATOM 1489 C ALA A1914 -14.888 -3.689 5.532 1.00 0.35 C ATOM 1490 O ALA A1914 -13.703 -3.612 5.859 1.00 0.37 O ATOM 1491 CB ALA A1914 -16.696 -3.743 7.226 1.00 0.46 C ATOM 0 H ALA A1914 -17.853 -2.586 5.402 1.00 0.44 H new ATOM 0 HA ALA A1914 -15.480 -2.043 6.764 1.00 0.41 H new ATOM 0 HB1 ALA A1914 -15.989 -4.156 7.945 1.00 0.46 H new ATOM 0 HB2 ALA A1914 -17.442 -3.146 7.752 1.00 0.46 H new ATOM 0 HB3 ALA A1914 -17.191 -4.557 6.696 1.00 0.46 H new ATOM 1497 N HIS A1915 -15.322 -4.473 4.561 1.00 0.35 N ATOM 1498 CA HIS A1915 -14.424 -5.332 3.817 1.00 0.36 C ATOM 1499 C HIS A1915 -13.415 -4.494 3.038 1.00 0.33 C ATOM 1500 O HIS A1915 -12.217 -4.763 3.078 1.00 0.39 O ATOM 1501 CB HIS A1915 -15.218 -6.235 2.871 1.00 0.48 C ATOM 1502 CG HIS A1915 -14.457 -7.443 2.438 1.00 0.68 C ATOM 1503 ND1 HIS A1915 -14.446 -7.913 1.145 1.00 1.39 N ATOM 1504 CD2 HIS A1915 -13.688 -8.284 3.152 1.00 1.00 C ATOM 1505 CE1 HIS A1915 -13.692 -8.996 1.084 1.00 1.62 C ATOM 1506 NE2 HIS A1915 -13.218 -9.244 2.291 1.00 1.37 N ATOM 0 H HIS A1915 -16.298 -4.531 4.270 1.00 0.35 H new ATOM 0 HA HIS A1915 -13.879 -5.962 4.519 1.00 0.36 H new ATOM 0 HB2 HIS A1915 -16.137 -6.550 3.365 1.00 0.48 H new ATOM 0 HB3 HIS A1915 -15.510 -5.662 1.991 1.00 0.48 H new ATOM 0 HD2 HIS A1915 -13.479 -8.216 4.209 1.00 1.00 H new ATOM 0 HE1 HIS A1915 -13.496 -9.580 0.197 1.00 1.62 H new ATOM 0 HE2 HIS A1915 -12.605 -10.020 2.542 1.00 1.37 H new ATOM 1515 N ILE A1916 -13.907 -3.464 2.357 1.00 0.30 N ATOM 1516 CA ILE A1916 -13.053 -2.575 1.574 1.00 0.29 C ATOM 1517 C ILE A1916 -11.987 -1.923 2.451 1.00 0.29 C ATOM 1518 O ILE A1916 -10.791 -2.044 2.182 1.00 0.32 O ATOM 1519 CB ILE A1916 -13.881 -1.468 0.882 1.00 0.31 C ATOM 1520 CG1 ILE A1916 -14.877 -2.082 -0.101 1.00 0.35 C ATOM 1521 CG2 ILE A1916 -12.968 -0.479 0.169 1.00 0.35 C ATOM 1522 CD1 ILE A1916 -15.810 -1.068 -0.724 1.00 0.40 C ATOM 0 H ILE A1916 -14.898 -3.223 2.331 1.00 0.30 H new ATOM 0 HA ILE A1916 -12.569 -3.188 0.814 1.00 0.29 H new ATOM 0 HB ILE A1916 -14.438 -0.928 1.647 1.00 0.31 H new ATOM 0 HG12 ILE A1916 -14.328 -2.593 -0.892 1.00 0.35 H new ATOM 0 HG13 ILE A1916 -15.468 -2.838 0.416 1.00 0.35 H new ATOM 0 HG21 ILE A1916 -13.571 0.292 -0.311 1.00 0.35 H new ATOM 0 HG22 ILE A1916 -12.297 -0.016 0.893 1.00 0.35 H new ATOM 0 HG23 ILE A1916 -12.382 -1.004 -0.585 1.00 0.35 H new ATOM 0 HD11 ILE A1916 -16.490 -1.573 -1.411 1.00 0.40 H new ATOM 0 HD12 ILE A1916 -16.386 -0.574 0.059 1.00 0.40 H new ATOM 0 HD13 ILE A1916 -15.228 -0.325 -1.270 1.00 0.40 H new ATOM 1534 N LYS A1917 -12.428 -1.268 3.522 1.00 0.28 N ATOM 1535 CA LYS A1917 -11.516 -0.551 4.406 1.00 0.32 C ATOM 1536 C LYS A1917 -10.501 -1.510 5.031 1.00 0.30 C ATOM 1537 O LYS A1917 -9.328 -1.174 5.171 1.00 0.34 O ATOM 1538 CB LYS A1917 -12.291 0.201 5.502 1.00 0.39 C ATOM 1539 CG LYS A1917 -13.087 -0.711 6.423 1.00 1.04 C ATOM 1540 CD LYS A1917 -13.876 0.056 7.474 1.00 0.97 C ATOM 1541 CE LYS A1917 -14.994 0.876 6.855 1.00 0.97 C ATOM 1542 NZ LYS A1917 -15.959 1.355 7.878 1.00 1.36 N ATOM 0 H LYS A1917 -13.409 -1.219 3.797 1.00 0.28 H new ATOM 0 HA LYS A1917 -10.975 0.181 3.807 1.00 0.32 H new ATOM 0 HB2 LYS A1917 -11.587 0.781 6.099 1.00 0.39 H new ATOM 0 HB3 LYS A1917 -12.971 0.911 5.032 1.00 0.39 H new ATOM 0 HG2 LYS A1917 -13.774 -1.312 5.827 1.00 1.04 H new ATOM 0 HG3 LYS A1917 -12.406 -1.403 6.919 1.00 1.04 H new ATOM 0 HD2 LYS A1917 -14.296 -0.645 8.196 1.00 0.97 H new ATOM 0 HD3 LYS A1917 -13.204 0.715 8.024 1.00 0.97 H new ATOM 0 HE2 LYS A1917 -14.569 1.730 6.328 1.00 0.97 H new ATOM 0 HE3 LYS A1917 -15.519 0.273 6.114 1.00 0.97 H new ATOM 0 HZ1 LYS A1917 -16.707 1.911 7.416 1.00 1.36 H new ATOM 0 HZ2 LYS A1917 -16.383 0.539 8.364 1.00 1.36 H new ATOM 0 HZ3 LYS A1917 -15.463 1.951 8.571 1.00 1.36 H new ATOM 1556 N HIS A1918 -10.952 -2.714 5.374 1.00 0.28 N ATOM 1557 CA HIS A1918 -10.092 -3.699 6.023 1.00 0.29 C ATOM 1558 C HIS A1918 -9.114 -4.346 5.046 1.00 0.27 C ATOM 1559 O HIS A1918 -8.066 -4.840 5.453 1.00 0.30 O ATOM 1560 CB HIS A1918 -10.912 -4.761 6.755 1.00 0.34 C ATOM 1561 CG HIS A1918 -11.253 -4.368 8.161 1.00 0.79 C ATOM 1562 ND1 HIS A1918 -11.896 -3.279 8.644 1.00 1.50 N flip ATOM 1563 CD2 HIS A1918 -10.900 -5.117 9.263 1.00 1.25 C flip ATOM 1564 CE1 HIS A1918 -11.914 -3.386 10.011 1.00 1.91 C flip ATOM 1565 NE2 HIS A1918 -11.309 -4.504 10.357 1.00 1.73 N flip ATOM 0 H HIS A1918 -11.908 -3.031 5.213 1.00 0.28 H new ATOM 0 HA HIS A1918 -9.501 -3.158 6.762 1.00 0.29 H new ATOM 0 HB2 HIS A1918 -11.832 -4.947 6.202 1.00 0.34 H new ATOM 0 HB3 HIS A1918 -10.354 -5.697 6.770 1.00 0.34 H new ATOM 0 HD2 HIS A1918 -10.371 -6.058 9.235 1.00 1.25 H new ATOM 0 HE1 HIS A1918 -12.352 -2.671 10.692 1.00 1.91 H new ATOM 0 HE2 HIS A1918 -11.179 -4.839 11.311 1.00 1.73 H new ATOM 1574 N ARG A1919 -9.453 -4.370 3.767 1.00 0.26 N ATOM 1575 CA ARG A1919 -8.520 -4.877 2.769 1.00 0.29 C ATOM 1576 C ARG A1919 -7.409 -3.863 2.513 1.00 0.27 C ATOM 1577 O ARG A1919 -6.274 -4.233 2.224 1.00 0.31 O ATOM 1578 CB ARG A1919 -9.234 -5.246 1.466 1.00 0.35 C ATOM 1579 CG ARG A1919 -10.222 -6.404 1.599 1.00 0.44 C ATOM 1580 CD ARG A1919 -9.569 -7.678 2.131 1.00 0.49 C ATOM 1581 NE ARG A1919 -9.205 -7.578 3.548 1.00 1.24 N ATOM 1582 CZ ARG A1919 -9.123 -8.618 4.379 1.00 1.57 C ATOM 1583 NH1 ARG A1919 -9.410 -9.841 3.954 1.00 1.50 N ATOM 1584 NH2 ARG A1919 -8.754 -8.430 5.641 1.00 2.55 N ATOM 0 H ARG A1919 -10.349 -4.051 3.398 1.00 0.26 H new ATOM 0 HA ARG A1919 -8.073 -5.789 3.164 1.00 0.29 H new ATOM 0 HB2 ARG A1919 -9.766 -4.370 1.096 1.00 0.35 H new ATOM 0 HB3 ARG A1919 -8.487 -5.505 0.716 1.00 0.35 H new ATOM 0 HG2 ARG A1919 -11.032 -6.110 2.266 1.00 0.44 H new ATOM 0 HG3 ARG A1919 -10.669 -6.609 0.626 1.00 0.44 H new ATOM 0 HD2 ARG A1919 -10.252 -8.516 1.994 1.00 0.49 H new ATOM 0 HD3 ARG A1919 -8.676 -7.896 1.545 1.00 0.49 H new ATOM 0 HE ARG A1919 -9.001 -6.652 3.923 1.00 1.24 H new ATOM 0 HH11 ARG A1919 -9.695 -9.991 2.986 1.00 1.50 H new ATOM 0 HH12 ARG A1919 -9.345 -10.632 4.595 1.00 1.50 H new ATOM 0 HH21 ARG A1919 -8.534 -7.491 5.974 1.00 2.55 H new ATOM 0 HH22 ARG A1919 -8.691 -9.224 6.278 1.00 2.55 H new ATOM 1598 N VAL A1920 -7.731 -2.583 2.648 1.00 0.25 N ATOM 1599 CA VAL A1920 -6.719 -1.535 2.560 1.00 0.27 C ATOM 1600 C VAL A1920 -5.856 -1.546 3.825 1.00 0.29 C ATOM 1601 O VAL A1920 -4.717 -1.095 3.814 1.00 0.35 O ATOM 1602 CB VAL A1920 -7.356 -0.140 2.359 1.00 0.27 C ATOM 1603 CG1 VAL A1920 -6.289 0.922 2.122 1.00 0.31 C ATOM 1604 CG2 VAL A1920 -8.343 -0.165 1.202 1.00 0.28 C ATOM 0 H VAL A1920 -8.678 -2.245 2.818 1.00 0.25 H new ATOM 0 HA VAL A1920 -6.096 -1.738 1.689 1.00 0.27 H new ATOM 0 HB VAL A1920 -7.894 0.117 3.272 1.00 0.27 H new ATOM 0 HG11 VAL A1920 -6.766 1.892 1.984 1.00 0.31 H new ATOM 0 HG12 VAL A1920 -5.621 0.965 2.982 1.00 0.31 H new ATOM 0 HG13 VAL A1920 -5.716 0.669 1.230 1.00 0.31 H new ATOM 0 HG21 VAL A1920 -8.781 0.825 1.076 1.00 0.28 H new ATOM 0 HG22 VAL A1920 -7.824 -0.451 0.287 1.00 0.28 H new ATOM 0 HG23 VAL A1920 -9.132 -0.887 1.413 1.00 0.28 H new ATOM 1614 N GLN A1921 -6.406 -2.086 4.912 1.00 0.26 N ATOM 1615 CA GLN A1921 -5.635 -2.297 6.139 1.00 0.27 C ATOM 1616 C GLN A1921 -4.523 -3.307 5.875 1.00 0.25 C ATOM 1617 O GLN A1921 -3.414 -3.193 6.403 1.00 0.25 O ATOM 1618 CB GLN A1921 -6.533 -2.813 7.265 1.00 0.32 C ATOM 1619 CG GLN A1921 -7.726 -1.925 7.564 1.00 0.39 C ATOM 1620 CD GLN A1921 -7.356 -0.656 8.293 1.00 0.62 C ATOM 1621 OE1 GLN A1921 -7.036 0.387 7.548 1.00 1.22 O flip ATOM 1622 NE2 GLN A1921 -7.355 -0.616 9.522 1.00 0.65 N flip ATOM 0 H GLN A1921 -7.380 -2.385 4.969 1.00 0.26 H new ATOM 0 HA GLN A1921 -5.206 -1.343 6.446 1.00 0.27 H new ATOM 0 HB2 GLN A1921 -6.892 -3.808 7.002 1.00 0.32 H new ATOM 0 HB3 GLN A1921 -5.936 -2.919 8.171 1.00 0.32 H new ATOM 0 HG2 GLN A1921 -8.222 -1.667 6.628 1.00 0.39 H new ATOM 0 HG3 GLN A1921 -8.445 -2.484 8.163 1.00 0.39 H new ATOM 0 HE21 GLN A1921 -7.609 -1.445 10.059 1.00 0.65 H new ATOM 0 HE22 GLN A1921 -7.100 0.246 10.004 1.00 0.65 H new ATOM 1631 N GLU A1922 -4.844 -4.300 5.048 1.00 0.29 N ATOM 1632 CA GLU A1922 -3.872 -5.288 4.604 1.00 0.31 C ATOM 1633 C GLU A1922 -2.729 -4.591 3.885 1.00 0.32 C ATOM 1634 O GLU A1922 -1.554 -4.830 4.172 1.00 0.35 O ATOM 1635 CB GLU A1922 -4.532 -6.290 3.656 1.00 0.36 C ATOM 1636 CG GLU A1922 -5.697 -7.040 4.270 1.00 0.43 C ATOM 1637 CD GLU A1922 -5.252 -8.021 5.329 1.00 0.81 C ATOM 1638 OE1 GLU A1922 -5.002 -7.597 6.473 1.00 1.49 O ATOM 1639 OE2 GLU A1922 -5.137 -9.223 5.015 1.00 1.04 O ATOM 0 H GLU A1922 -5.781 -4.439 4.670 1.00 0.29 H new ATOM 0 HA GLU A1922 -3.488 -5.821 5.474 1.00 0.31 H new ATOM 0 HB2 GLU A1922 -4.880 -5.761 2.769 1.00 0.36 H new ATOM 0 HB3 GLU A1922 -3.783 -7.010 3.325 1.00 0.36 H new ATOM 0 HG2 GLU A1922 -6.395 -6.327 4.709 1.00 0.43 H new ATOM 0 HG3 GLU A1922 -6.236 -7.573 3.487 1.00 0.43 H new ATOM 1646 N LEU A1923 -3.095 -3.720 2.953 1.00 0.34 N ATOM 1647 CA LEU A1923 -2.141 -2.908 2.236 1.00 0.41 C ATOM 1648 C LEU A1923 -1.376 -2.011 3.196 1.00 0.36 C ATOM 1649 O LEU A1923 -0.171 -1.855 3.072 1.00 0.47 O ATOM 1650 CB LEU A1923 -2.872 -2.067 1.196 1.00 0.49 C ATOM 1651 CG LEU A1923 -3.423 -2.844 0.001 1.00 0.37 C ATOM 1652 CD1 LEU A1923 -4.110 -1.902 -0.974 1.00 0.67 C ATOM 1653 CD2 LEU A1923 -2.310 -3.614 -0.690 1.00 0.65 C ATOM 0 H LEU A1923 -4.065 -3.562 2.678 1.00 0.34 H new ATOM 0 HA LEU A1923 -1.425 -3.559 1.735 1.00 0.41 H new ATOM 0 HB2 LEU A1923 -3.698 -1.550 1.685 1.00 0.49 H new ATOM 0 HB3 LEU A1923 -2.190 -1.301 0.827 1.00 0.49 H new ATOM 0 HG LEU A1923 -4.161 -3.560 0.363 1.00 0.37 H new ATOM 0 HD11 LEU A1923 -4.497 -2.472 -1.819 1.00 0.67 H new ATOM 0 HD12 LEU A1923 -4.933 -1.395 -0.471 1.00 0.67 H new ATOM 0 HD13 LEU A1923 -3.393 -1.163 -1.332 1.00 0.67 H new ATOM 0 HD21 LEU A1923 -2.719 -4.162 -1.539 1.00 0.65 H new ATOM 0 HD22 LEU A1923 -1.549 -2.917 -1.041 1.00 0.65 H new ATOM 0 HD23 LEU A1923 -1.862 -4.316 0.013 1.00 0.65 H new ATOM 1665 N GLY A1924 -2.084 -1.440 4.158 1.00 0.28 N ATOM 1666 CA GLY A1924 -1.454 -0.598 5.154 1.00 0.33 C ATOM 1667 C GLY A1924 -0.287 -1.271 5.831 1.00 0.38 C ATOM 1668 O GLY A1924 0.810 -0.731 5.848 1.00 0.64 O ATOM 0 H GLY A1924 -3.093 -1.546 4.267 1.00 0.28 H new ATOM 0 HA2 GLY A1924 -1.113 0.323 4.682 1.00 0.33 H new ATOM 0 HA3 GLY A1924 -2.192 -0.317 5.905 1.00 0.33 H new ATOM 1672 N HIS A1925 -0.504 -2.459 6.365 1.00 0.24 N ATOM 1673 CA HIS A1925 0.560 -3.168 7.061 1.00 0.28 C ATOM 1674 C HIS A1925 1.563 -3.757 6.073 1.00 0.24 C ATOM 1675 O HIS A1925 2.767 -3.752 6.327 1.00 0.32 O ATOM 1676 CB HIS A1925 -0.012 -4.266 7.962 1.00 0.34 C ATOM 1677 CG HIS A1925 -0.751 -3.740 9.156 1.00 0.44 C ATOM 1678 ND1 HIS A1925 -0.114 -3.254 10.276 1.00 0.62 N ATOM 1679 CD2 HIS A1925 -2.079 -3.628 9.404 1.00 0.53 C ATOM 1680 CE1 HIS A1925 -1.012 -2.866 11.161 1.00 0.69 C ATOM 1681 NE2 HIS A1925 -2.211 -3.081 10.658 1.00 0.62 N ATOM 0 H HIS A1925 -1.397 -2.951 6.332 1.00 0.24 H new ATOM 0 HA HIS A1925 1.083 -2.447 7.689 1.00 0.28 H new ATOM 0 HB2 HIS A1925 -0.685 -4.891 7.375 1.00 0.34 H new ATOM 0 HB3 HIS A1925 0.802 -4.906 8.302 1.00 0.34 H new ATOM 0 HD2 HIS A1925 -2.882 -3.915 8.741 1.00 0.53 H new ATOM 0 HE1 HIS A1925 -0.801 -2.444 12.132 1.00 0.69 H new ATOM 0 HE2 HIS A1925 -3.094 -2.875 11.124 1.00 0.62 H new ATOM 1690 N GLY A1926 1.065 -4.238 4.939 1.00 0.23 N ATOM 1691 CA GLY A1926 1.931 -4.835 3.937 1.00 0.25 C ATOM 1692 C GLY A1926 2.845 -3.818 3.282 1.00 0.23 C ATOM 1693 O GLY A1926 4.065 -3.989 3.268 1.00 0.25 O ATOM 0 H GLY A1926 0.075 -4.225 4.695 1.00 0.23 H new ATOM 0 HA2 GLY A1926 2.534 -5.616 4.401 1.00 0.25 H new ATOM 0 HA3 GLY A1926 1.320 -5.316 3.173 1.00 0.25 H new ATOM 1697 N CYS A1927 2.256 -2.755 2.748 1.00 0.22 N ATOM 1698 CA CYS A1927 3.017 -1.694 2.105 1.00 0.24 C ATOM 1699 C CYS A1927 3.966 -1.041 3.104 1.00 0.23 C ATOM 1700 O CYS A1927 5.112 -0.745 2.770 1.00 0.26 O ATOM 1701 CB CYS A1927 2.072 -0.652 1.496 1.00 0.31 C ATOM 1702 SG CYS A1927 0.993 -1.306 0.198 1.00 1.22 S ATOM 0 H CYS A1927 1.247 -2.606 2.749 1.00 0.22 H new ATOM 0 HA CYS A1927 3.611 -2.129 1.301 1.00 0.24 H new ATOM 0 HB2 CYS A1927 1.455 -0.229 2.289 1.00 0.31 H new ATOM 0 HB3 CYS A1927 2.665 0.165 1.084 1.00 0.31 H new ATOM 0 HG CYS A1927 -0.034 -1.890 0.741 1.00 1.22 H new ATOM 1708 N SER A1928 3.488 -0.839 4.334 1.00 0.23 N ATOM 1709 CA SER A1928 4.332 -0.332 5.413 1.00 0.25 C ATOM 1710 C SER A1928 5.578 -1.188 5.576 1.00 0.25 C ATOM 1711 O SER A1928 6.698 -0.679 5.576 1.00 0.29 O ATOM 1712 CB SER A1928 3.563 -0.312 6.734 1.00 0.28 C ATOM 1713 OG SER A1928 2.689 0.796 6.816 1.00 1.03 O ATOM 0 H SER A1928 2.521 -1.019 4.605 1.00 0.23 H new ATOM 0 HA SER A1928 4.628 0.683 5.150 1.00 0.25 H new ATOM 0 HB2 SER A1928 2.991 -1.234 6.836 1.00 0.28 H new ATOM 0 HB3 SER A1928 4.268 -0.281 7.565 1.00 0.28 H new ATOM 0 HG SER A1928 1.762 0.488 6.741 1.00 1.03 H new ATOM 1719 N ALA A1929 5.373 -2.490 5.701 1.00 0.23 N ATOM 1720 CA ALA A1929 6.475 -3.421 5.902 1.00 0.25 C ATOM 1721 C ALA A1929 7.433 -3.399 4.717 1.00 0.25 C ATOM 1722 O ALA A1929 8.649 -3.353 4.897 1.00 0.28 O ATOM 1723 CB ALA A1929 5.945 -4.829 6.127 1.00 0.27 C ATOM 0 H ALA A1929 4.452 -2.928 5.667 1.00 0.23 H new ATOM 0 HA ALA A1929 7.025 -3.107 6.789 1.00 0.25 H new ATOM 0 HB1 ALA A1929 6.781 -5.513 6.276 1.00 0.27 H new ATOM 0 HB2 ALA A1929 5.305 -4.840 7.010 1.00 0.27 H new ATOM 0 HB3 ALA A1929 5.369 -5.144 5.257 1.00 0.27 H new ATOM 1729 N LEU A1930 6.876 -3.402 3.512 1.00 0.21 N ATOM 1730 CA LEU A1930 7.675 -3.427 2.292 1.00 0.21 C ATOM 1731 C LEU A1930 8.566 -2.189 2.194 1.00 0.21 C ATOM 1732 O LEU A1930 9.783 -2.300 2.023 1.00 0.22 O ATOM 1733 CB LEU A1930 6.764 -3.501 1.064 1.00 0.21 C ATOM 1734 CG LEU A1930 7.189 -4.497 -0.019 1.00 0.24 C ATOM 1735 CD1 LEU A1930 6.314 -4.342 -1.248 1.00 0.26 C ATOM 1736 CD2 LEU A1930 8.655 -4.324 -0.388 1.00 0.28 C ATOM 0 H LEU A1930 5.869 -3.387 3.353 1.00 0.21 H new ATOM 0 HA LEU A1930 8.311 -4.312 2.326 1.00 0.21 H new ATOM 0 HB2 LEU A1930 5.758 -3.760 1.395 1.00 0.21 H new ATOM 0 HB3 LEU A1930 6.706 -2.509 0.617 1.00 0.21 H new ATOM 0 HG LEU A1930 7.062 -5.503 0.382 1.00 0.24 H new ATOM 0 HD11 LEU A1930 6.627 -5.056 -2.010 1.00 0.26 H new ATOM 0 HD12 LEU A1930 5.274 -4.530 -0.980 1.00 0.26 H new ATOM 0 HD13 LEU A1930 6.411 -3.329 -1.638 1.00 0.26 H new ATOM 0 HD21 LEU A1930 8.924 -5.046 -1.159 1.00 0.28 H new ATOM 0 HD22 LEU A1930 8.819 -3.314 -0.764 1.00 0.28 H new ATOM 0 HD23 LEU A1930 9.274 -4.488 0.494 1.00 0.28 H new ATOM 1748 N VAL A1931 7.961 -1.011 2.316 1.00 0.21 N ATOM 1749 CA VAL A1931 8.701 0.239 2.186 1.00 0.22 C ATOM 1750 C VAL A1931 9.708 0.401 3.326 1.00 0.24 C ATOM 1751 O VAL A1931 10.779 0.982 3.145 1.00 0.26 O ATOM 1752 CB VAL A1931 7.759 1.466 2.132 1.00 0.23 C ATOM 1753 CG1 VAL A1931 6.818 1.365 0.942 1.00 0.24 C ATOM 1754 CG2 VAL A1931 6.966 1.622 3.422 1.00 0.25 C ATOM 0 H VAL A1931 6.965 -0.896 2.504 1.00 0.21 H new ATOM 0 HA VAL A1931 9.242 0.190 1.241 1.00 0.22 H new ATOM 0 HB VAL A1931 8.382 2.353 2.015 1.00 0.23 H new ATOM 0 HG11 VAL A1931 6.164 2.236 0.921 1.00 0.24 H new ATOM 0 HG12 VAL A1931 7.399 1.325 0.021 1.00 0.24 H new ATOM 0 HG13 VAL A1931 6.216 0.461 1.030 1.00 0.24 H new ATOM 0 HG21 VAL A1931 6.316 2.494 3.346 1.00 0.25 H new ATOM 0 HG22 VAL A1931 6.360 0.731 3.587 1.00 0.25 H new ATOM 0 HG23 VAL A1931 7.653 1.753 4.258 1.00 0.25 H new ATOM 1764 N THR A1932 9.369 -0.141 4.489 1.00 0.25 N ATOM 1765 CA THR A1932 10.262 -0.117 5.635 1.00 0.27 C ATOM 1766 C THR A1932 11.456 -1.039 5.400 1.00 0.25 C ATOM 1767 O THR A1932 12.606 -0.676 5.667 1.00 0.28 O ATOM 1768 CB THR A1932 9.524 -0.553 6.918 1.00 0.34 C ATOM 1769 OG1 THR A1932 8.445 0.348 7.193 1.00 0.80 O ATOM 1770 CG2 THR A1932 10.462 -0.600 8.112 1.00 0.65 C ATOM 0 H THR A1932 8.477 -0.604 4.661 1.00 0.25 H new ATOM 0 HA THR A1932 10.614 0.907 5.761 1.00 0.27 H new ATOM 0 HB THR A1932 9.134 -1.557 6.751 1.00 0.34 H new ATOM 0 HG1 THR A1932 7.668 0.104 6.648 1.00 0.80 H new ATOM 0 HG21 THR A1932 9.908 -0.911 8.998 1.00 0.65 H new ATOM 0 HG22 THR A1932 11.264 -1.312 7.917 1.00 0.65 H new ATOM 0 HG23 THR A1932 10.888 0.389 8.279 1.00 0.65 H new ATOM 1778 N LYS A1933 11.174 -2.228 4.878 1.00 0.25 N ATOM 1779 CA LYS A1933 12.205 -3.220 4.627 1.00 0.26 C ATOM 1780 C LYS A1933 13.169 -2.718 3.560 1.00 0.23 C ATOM 1781 O LYS A1933 14.377 -2.902 3.669 1.00 0.25 O ATOM 1782 CB LYS A1933 11.576 -4.546 4.188 1.00 0.30 C ATOM 1783 CG LYS A1933 12.480 -5.746 4.409 1.00 0.44 C ATOM 1784 CD LYS A1933 12.763 -5.945 5.889 1.00 0.85 C ATOM 1785 CE LYS A1933 13.711 -7.106 6.129 1.00 1.24 C ATOM 1786 NZ LYS A1933 13.995 -7.292 7.575 1.00 1.27 N ATOM 0 H LYS A1933 10.233 -2.526 4.620 1.00 0.25 H new ATOM 0 HA LYS A1933 12.758 -3.387 5.551 1.00 0.26 H new ATOM 0 HB2 LYS A1933 10.645 -4.696 4.735 1.00 0.30 H new ATOM 0 HB3 LYS A1933 11.318 -4.485 3.131 1.00 0.30 H new ATOM 0 HG2 LYS A1933 12.010 -6.641 4.001 1.00 0.44 H new ATOM 0 HG3 LYS A1933 13.417 -5.605 3.871 1.00 0.44 H new ATOM 0 HD2 LYS A1933 13.193 -5.033 6.303 1.00 0.85 H new ATOM 0 HD3 LYS A1933 11.827 -6.125 6.417 1.00 0.85 H new ATOM 0 HE2 LYS A1933 13.278 -8.020 5.723 1.00 1.24 H new ATOM 0 HE3 LYS A1933 14.644 -6.930 5.594 1.00 1.24 H new ATOM 0 HZ1 LYS A1933 14.202 -8.294 7.762 1.00 1.27 H new ATOM 0 HZ2 LYS A1933 14.816 -6.713 7.845 1.00 1.27 H new ATOM 0 HZ3 LYS A1933 13.167 -7.000 8.132 1.00 1.27 H new ATOM 1800 N ALA A1934 12.620 -2.079 2.533 1.00 0.21 N ATOM 1801 CA ALA A1934 13.425 -1.478 1.472 1.00 0.22 C ATOM 1802 C ALA A1934 14.373 -0.421 2.026 1.00 0.27 C ATOM 1803 O ALA A1934 15.532 -0.343 1.615 1.00 0.30 O ATOM 1804 CB ALA A1934 12.526 -0.873 0.403 1.00 0.24 C ATOM 0 H ALA A1934 11.614 -1.963 2.411 1.00 0.21 H new ATOM 0 HA ALA A1934 14.028 -2.267 1.022 1.00 0.22 H new ATOM 0 HB1 ALA A1934 13.140 -0.429 -0.380 1.00 0.24 H new ATOM 0 HB2 ALA A1934 11.897 -1.652 -0.027 1.00 0.24 H new ATOM 0 HB3 ALA A1934 11.896 -0.104 0.850 1.00 0.24 H new ATOM 1810 N GLY A1935 13.877 0.382 2.962 1.00 0.31 N ATOM 1811 CA GLY A1935 14.706 1.395 3.590 1.00 0.38 C ATOM 1812 C GLY A1935 15.903 0.789 4.297 1.00 0.38 C ATOM 1813 O GLY A1935 17.024 1.292 4.190 1.00 0.40 O ATOM 0 H GLY A1935 12.914 0.349 3.297 1.00 0.31 H new ATOM 0 HA2 GLY A1935 15.050 2.102 2.835 1.00 0.38 H new ATOM 0 HA3 GLY A1935 14.109 1.960 4.306 1.00 0.38 H new ATOM 1817 N ALA A1936 15.663 -0.308 5.004 1.00 0.39 N ATOM 1818 CA ALA A1936 16.723 -1.011 5.712 1.00 0.44 C ATOM 1819 C ALA A1936 17.612 -1.780 4.738 1.00 0.41 C ATOM 1820 O ALA A1936 18.819 -1.891 4.945 1.00 0.46 O ATOM 1821 CB ALA A1936 16.132 -1.952 6.752 1.00 0.50 C ATOM 0 H ALA A1936 14.740 -0.731 5.102 1.00 0.39 H new ATOM 0 HA ALA A1936 17.341 -0.272 6.222 1.00 0.44 H new ATOM 0 HB1 ALA A1936 16.937 -2.470 7.273 1.00 0.50 H new ATOM 0 HB2 ALA A1936 15.545 -1.379 7.470 1.00 0.50 H new ATOM 0 HB3 ALA A1936 15.490 -2.682 6.259 1.00 0.50 H new ATOM 1827 N LEU A1937 17.011 -2.284 3.665 1.00 0.35 N ATOM 1828 CA LEU A1937 17.735 -3.070 2.678 1.00 0.34 C ATOM 1829 C LEU A1937 18.736 -2.188 1.953 1.00 0.35 C ATOM 1830 O LEU A1937 19.857 -2.595 1.701 1.00 0.41 O ATOM 1831 CB LEU A1937 16.754 -3.725 1.686 1.00 0.31 C ATOM 1832 CG LEU A1937 17.347 -4.774 0.723 1.00 0.32 C ATOM 1833 CD1 LEU A1937 18.044 -4.117 -0.461 1.00 0.33 C ATOM 1834 CD2 LEU A1937 18.312 -5.692 1.461 1.00 0.37 C ATOM 0 H LEU A1937 16.020 -2.160 3.458 1.00 0.35 H new ATOM 0 HA LEU A1937 18.279 -3.867 3.185 1.00 0.34 H new ATOM 0 HB2 LEU A1937 15.956 -4.199 2.258 1.00 0.31 H new ATOM 0 HB3 LEU A1937 16.294 -2.937 1.090 1.00 0.31 H new ATOM 0 HG LEU A1937 16.520 -5.369 0.335 1.00 0.32 H new ATOM 0 HD11 LEU A1937 18.449 -4.887 -1.118 1.00 0.33 H new ATOM 0 HD12 LEU A1937 17.327 -3.509 -1.014 1.00 0.33 H new ATOM 0 HD13 LEU A1937 18.855 -3.484 -0.100 1.00 0.33 H new ATOM 0 HD21 LEU A1937 18.720 -6.425 0.766 1.00 0.37 H new ATOM 0 HD22 LEU A1937 19.125 -5.101 1.884 1.00 0.37 H new ATOM 0 HD23 LEU A1937 17.783 -6.207 2.263 1.00 0.37 H new ATOM 1846 N GLN A1938 18.332 -0.968 1.642 1.00 0.33 N ATOM 1847 CA GLN A1938 19.219 -0.024 0.979 1.00 0.36 C ATOM 1848 C GLN A1938 20.413 0.334 1.865 1.00 0.43 C ATOM 1849 O GLN A1938 21.473 0.715 1.369 1.00 0.47 O ATOM 1850 CB GLN A1938 18.457 1.233 0.577 1.00 0.36 C ATOM 1851 CG GLN A1938 17.529 1.020 -0.607 1.00 0.35 C ATOM 1852 CD GLN A1938 16.910 2.313 -1.107 1.00 0.50 C ATOM 1853 OE1 GLN A1938 16.634 2.470 -2.297 1.00 1.06 O ATOM 1854 NE2 GLN A1938 16.681 3.250 -0.201 1.00 0.95 N ATOM 0 H GLN A1938 17.398 -0.607 1.837 1.00 0.33 H new ATOM 0 HA GLN A1938 19.603 -0.503 0.078 1.00 0.36 H new ATOM 0 HB2 GLN A1938 17.874 1.584 1.428 1.00 0.36 H new ATOM 0 HB3 GLN A1938 19.171 2.020 0.333 1.00 0.36 H new ATOM 0 HG2 GLN A1938 18.085 0.550 -1.419 1.00 0.35 H new ATOM 0 HG3 GLN A1938 16.736 0.329 -0.322 1.00 0.35 H new ATOM 0 HE21 GLN A1938 16.923 3.085 0.776 1.00 0.95 H new ATOM 0 HE22 GLN A1938 16.263 4.138 -0.480 1.00 0.95 H new ATOM 1863 N CYS A1939 20.233 0.216 3.174 1.00 0.46 N ATOM 1864 CA CYS A1939 21.301 0.500 4.126 1.00 0.54 C ATOM 1865 C CYS A1939 22.310 -0.650 4.184 1.00 0.56 C ATOM 1866 O CYS A1939 23.409 -0.495 4.719 1.00 0.66 O ATOM 1867 CB CYS A1939 20.713 0.767 5.512 1.00 0.56 C ATOM 1868 SG CYS A1939 19.586 2.183 5.565 1.00 1.43 S ATOM 0 H CYS A1939 19.355 -0.075 3.603 1.00 0.46 H new ATOM 0 HA CYS A1939 21.830 1.391 3.789 1.00 0.54 H new ATOM 0 HB2 CYS A1939 20.180 -0.123 5.848 1.00 0.56 H new ATOM 0 HB3 CYS A1939 21.528 0.936 6.216 1.00 0.56 H new ATOM 0 HG CYS A1939 18.423 1.830 5.103 1.00 1.43 H new ATOM 1874 N SER A1940 21.925 -1.801 3.646 1.00 0.53 N ATOM 1875 CA SER A1940 22.809 -2.959 3.556 1.00 0.58 C ATOM 1876 C SER A1940 22.372 -3.840 2.384 1.00 0.53 C ATOM 1877 O SER A1940 21.911 -4.965 2.573 1.00 0.56 O ATOM 1878 CB SER A1940 22.796 -3.759 4.866 1.00 0.69 C ATOM 1879 OG SER A1940 23.240 -2.965 5.956 1.00 0.80 O ATOM 0 H SER A1940 20.994 -1.959 3.260 1.00 0.53 H new ATOM 0 HA SER A1940 23.829 -2.615 3.387 1.00 0.58 H new ATOM 0 HB2 SER A1940 21.787 -4.122 5.064 1.00 0.69 H new ATOM 0 HB3 SER A1940 23.436 -4.636 4.766 1.00 0.69 H new ATOM 0 HG SER A1940 23.220 -3.498 6.778 1.00 0.80 H new ATOM 1885 N PRO A1941 22.515 -3.321 1.149 1.00 0.49 N ATOM 1886 CA PRO A1941 21.955 -3.949 -0.059 1.00 0.47 C ATOM 1887 C PRO A1941 22.578 -5.304 -0.375 1.00 0.57 C ATOM 1888 O PRO A1941 22.042 -6.079 -1.170 1.00 0.69 O ATOM 1889 CB PRO A1941 22.289 -2.948 -1.168 1.00 0.47 C ATOM 1890 CG PRO A1941 23.445 -2.168 -0.650 1.00 0.58 C ATOM 1891 CD PRO A1941 23.239 -2.077 0.834 1.00 0.52 C ATOM 0 HA PRO A1941 20.890 -4.152 0.058 1.00 0.47 H new ATOM 0 HB2 PRO A1941 22.542 -3.459 -2.097 1.00 0.47 H new ATOM 0 HB3 PRO A1941 21.440 -2.299 -1.382 1.00 0.47 H new ATOM 0 HG2 PRO A1941 24.388 -2.662 -0.885 1.00 0.58 H new ATOM 0 HG3 PRO A1941 23.483 -1.177 -1.102 1.00 0.58 H new ATOM 0 HD2 PRO A1941 24.187 -2.016 1.369 1.00 0.52 H new ATOM 0 HD3 PRO A1941 22.661 -1.194 1.107 1.00 0.52 H new ATOM 1899 N SER A1942 23.703 -5.585 0.255 1.00 0.61 N ATOM 1900 CA SER A1942 24.462 -6.785 -0.035 1.00 0.70 C ATOM 1901 C SER A1942 23.997 -7.973 0.803 1.00 0.67 C ATOM 1902 O SER A1942 24.338 -9.119 0.502 1.00 0.75 O ATOM 1903 CB SER A1942 25.942 -6.509 0.207 1.00 0.85 C ATOM 1904 OG SER A1942 26.395 -5.449 -0.618 1.00 1.54 O ATOM 0 H SER A1942 24.113 -4.992 0.977 1.00 0.61 H new ATOM 0 HA SER A1942 24.298 -7.050 -1.079 1.00 0.70 H new ATOM 0 HB2 SER A1942 26.103 -6.255 1.255 1.00 0.85 H new ATOM 0 HB3 SER A1942 26.523 -7.409 0.004 1.00 0.85 H new ATOM 0 HG SER A1942 27.346 -5.285 -0.447 1.00 1.54 H new ATOM 1910 N ASP A1943 23.207 -7.711 1.840 1.00 0.61 N ATOM 1911 CA ASP A1943 22.729 -8.784 2.704 1.00 0.59 C ATOM 1912 C ASP A1943 21.564 -9.516 2.048 1.00 0.54 C ATOM 1913 O ASP A1943 20.512 -8.930 1.781 1.00 0.65 O ATOM 1914 CB ASP A1943 22.314 -8.253 4.075 1.00 0.59 C ATOM 1915 CG ASP A1943 21.869 -9.368 5.001 1.00 0.80 C ATOM 1916 OD1 ASP A1943 22.734 -10.059 5.567 1.00 1.16 O ATOM 1917 OD2 ASP A1943 20.646 -9.556 5.177 1.00 0.93 O ATOM 0 H ASP A1943 22.888 -6.778 2.100 1.00 0.61 H new ATOM 0 HA ASP A1943 23.551 -9.484 2.850 1.00 0.59 H new ATOM 0 HB2 ASP A1943 23.150 -7.718 4.526 1.00 0.59 H new ATOM 0 HB3 ASP A1943 21.503 -7.534 3.956 1.00 0.59 H new ATOM 1922 N VAL A1944 21.765 -10.801 1.789 1.00 0.55 N ATOM 1923 CA VAL A1944 20.779 -11.607 1.084 1.00 0.54 C ATOM 1924 C VAL A1944 19.563 -11.891 1.963 1.00 0.47 C ATOM 1925 O VAL A1944 18.438 -11.950 1.472 1.00 0.44 O ATOM 1926 CB VAL A1944 21.391 -12.943 0.603 1.00 0.64 C ATOM 1927 CG1 VAL A1944 20.409 -13.710 -0.270 1.00 1.30 C ATOM 1928 CG2 VAL A1944 22.692 -12.699 -0.145 1.00 1.33 C ATOM 0 H VAL A1944 22.607 -11.309 2.059 1.00 0.55 H new ATOM 0 HA VAL A1944 20.458 -11.032 0.216 1.00 0.54 H new ATOM 0 HB VAL A1944 21.607 -13.549 1.483 1.00 0.64 H new ATOM 0 HG11 VAL A1944 20.865 -14.645 -0.595 1.00 1.30 H new ATOM 0 HG12 VAL A1944 19.506 -13.925 0.301 1.00 1.30 H new ATOM 0 HG13 VAL A1944 20.152 -13.110 -1.143 1.00 1.30 H new ATOM 0 HG21 VAL A1944 23.106 -13.652 -0.475 1.00 1.33 H new ATOM 0 HG22 VAL A1944 22.500 -12.067 -1.012 1.00 1.33 H new ATOM 0 HG23 VAL A1944 23.404 -12.203 0.515 1.00 1.33 H new ATOM 1938 N TYR A1945 19.794 -12.051 3.261 1.00 0.48 N ATOM 1939 CA TYR A1945 18.723 -12.372 4.200 1.00 0.48 C ATOM 1940 C TYR A1945 17.691 -11.245 4.260 1.00 0.42 C ATOM 1941 O TYR A1945 16.490 -11.488 4.132 1.00 0.41 O ATOM 1942 CB TYR A1945 19.307 -12.640 5.592 1.00 0.57 C ATOM 1943 CG TYR A1945 18.295 -13.108 6.615 1.00 0.80 C ATOM 1944 CD1 TYR A1945 17.700 -14.358 6.509 1.00 0.92 C ATOM 1945 CD2 TYR A1945 17.930 -12.297 7.684 1.00 1.17 C ATOM 1946 CE1 TYR A1945 16.770 -14.786 7.437 1.00 1.22 C ATOM 1947 CE2 TYR A1945 17.002 -12.720 8.616 1.00 1.54 C ATOM 1948 CZ TYR A1945 16.443 -13.968 8.505 1.00 1.52 C ATOM 1949 OH TYR A1945 15.497 -14.393 9.413 1.00 1.91 O ATOM 0 H TYR A1945 20.716 -11.964 3.689 1.00 0.48 H new ATOM 0 HA TYR A1945 18.217 -13.272 3.850 1.00 0.48 H new ATOM 0 HB2 TYR A1945 20.092 -13.392 5.505 1.00 0.57 H new ATOM 0 HB3 TYR A1945 19.779 -11.728 5.957 1.00 0.57 H new ATOM 0 HD1 TYR A1945 17.968 -15.006 5.688 1.00 0.92 H new ATOM 0 HD2 TYR A1945 18.379 -11.320 7.787 1.00 1.17 H new ATOM 0 HE1 TYR A1945 16.301 -15.753 7.330 1.00 1.22 H new ATOM 0 HE2 TYR A1945 16.717 -12.070 9.430 1.00 1.54 H new ATOM 0 HH TYR A1945 15.378 -13.710 10.105 1.00 1.91 H new ATOM 1959 N THR A1946 18.167 -10.019 4.439 1.00 0.42 N ATOM 1960 CA THR A1946 17.293 -8.851 4.484 1.00 0.40 C ATOM 1961 C THR A1946 16.516 -8.710 3.176 1.00 0.33 C ATOM 1962 O THR A1946 15.316 -8.421 3.176 1.00 0.33 O ATOM 1963 CB THR A1946 18.104 -7.561 4.736 1.00 0.47 C ATOM 1964 OG1 THR A1946 18.982 -7.746 5.855 1.00 0.60 O ATOM 1965 CG2 THR A1946 17.185 -6.380 5.006 1.00 0.48 C ATOM 0 H THR A1946 19.158 -9.806 4.556 1.00 0.42 H new ATOM 0 HA THR A1946 16.593 -8.996 5.307 1.00 0.40 H new ATOM 0 HB THR A1946 18.687 -7.349 3.840 1.00 0.47 H new ATOM 0 HG1 THR A1946 19.821 -8.149 5.549 1.00 0.60 H new ATOM 0 HG21 THR A1946 17.783 -5.486 5.180 1.00 0.48 H new ATOM 0 HG22 THR A1946 16.535 -6.220 4.145 1.00 0.48 H new ATOM 0 HG23 THR A1946 16.577 -6.586 5.887 1.00 0.48 H new ATOM 1973 N LYS A1947 17.209 -8.937 2.068 1.00 0.32 N ATOM 1974 CA LYS A1947 16.605 -8.852 0.746 1.00 0.31 C ATOM 1975 C LYS A1947 15.552 -9.943 0.567 1.00 0.30 C ATOM 1976 O LYS A1947 14.463 -9.692 0.052 1.00 0.31 O ATOM 1977 CB LYS A1947 17.691 -8.979 -0.322 1.00 0.37 C ATOM 1978 CG LYS A1947 17.181 -8.861 -1.749 1.00 0.42 C ATOM 1979 CD LYS A1947 18.323 -8.953 -2.746 1.00 0.52 C ATOM 1980 CE LYS A1947 19.026 -10.299 -2.670 1.00 0.55 C ATOM 1981 NZ LYS A1947 20.265 -10.321 -3.484 1.00 1.20 N ATOM 0 H LYS A1947 18.199 -9.184 2.060 1.00 0.32 H new ATOM 0 HA LYS A1947 16.113 -7.885 0.642 1.00 0.31 H new ATOM 0 HB2 LYS A1947 18.443 -8.208 -0.152 1.00 0.37 H new ATOM 0 HB3 LYS A1947 18.189 -9.942 -0.205 1.00 0.37 H new ATOM 0 HG2 LYS A1947 16.457 -9.651 -1.946 1.00 0.42 H new ATOM 0 HG3 LYS A1947 16.659 -7.912 -1.875 1.00 0.42 H new ATOM 0 HD2 LYS A1947 17.939 -8.799 -3.755 1.00 0.52 H new ATOM 0 HD3 LYS A1947 19.041 -8.156 -2.553 1.00 0.52 H new ATOM 0 HE2 LYS A1947 19.270 -10.523 -1.632 1.00 0.55 H new ATOM 0 HE3 LYS A1947 18.351 -11.082 -3.015 1.00 0.55 H new ATOM 0 HZ1 LYS A1947 20.715 -11.255 -3.406 1.00 1.20 H new ATOM 0 HZ2 LYS A1947 20.030 -10.132 -4.479 1.00 1.20 H new ATOM 0 HZ3 LYS A1947 20.920 -9.591 -3.138 1.00 1.20 H new ATOM 1995 N LYS A1948 15.886 -11.148 1.018 1.00 0.33 N ATOM 1996 CA LYS A1948 14.979 -12.286 0.939 1.00 0.38 C ATOM 1997 C LYS A1948 13.678 -11.994 1.680 1.00 0.35 C ATOM 1998 O LYS A1948 12.593 -12.322 1.200 1.00 0.37 O ATOM 1999 CB LYS A1948 15.648 -13.537 1.523 1.00 0.47 C ATOM 2000 CG LYS A1948 14.766 -14.778 1.502 1.00 0.57 C ATOM 2001 CD LYS A1948 15.495 -16.004 2.041 1.00 0.80 C ATOM 2002 CE LYS A1948 16.373 -16.673 0.985 1.00 1.84 C ATOM 2003 NZ LYS A1948 17.483 -15.801 0.519 1.00 2.67 N ATOM 0 H LYS A1948 16.787 -11.362 1.446 1.00 0.33 H new ATOM 0 HA LYS A1948 14.745 -12.465 -0.110 1.00 0.38 H new ATOM 0 HB2 LYS A1948 16.561 -13.743 0.964 1.00 0.47 H new ATOM 0 HB3 LYS A1948 15.944 -13.332 2.552 1.00 0.47 H new ATOM 0 HG2 LYS A1948 13.871 -14.597 2.097 1.00 0.57 H new ATOM 0 HG3 LYS A1948 14.436 -14.972 0.481 1.00 0.57 H new ATOM 0 HD2 LYS A1948 16.113 -15.711 2.890 1.00 0.80 H new ATOM 0 HD3 LYS A1948 14.765 -16.724 2.411 1.00 0.80 H new ATOM 0 HE2 LYS A1948 16.788 -17.593 1.395 1.00 1.84 H new ATOM 0 HE3 LYS A1948 15.756 -16.954 0.132 1.00 1.84 H new ATOM 0 HZ1 LYS A1948 18.287 -16.391 0.223 1.00 2.67 H new ATOM 0 HZ2 LYS A1948 17.159 -15.227 -0.286 1.00 2.67 H new ATOM 0 HZ3 LYS A1948 17.780 -15.174 1.294 1.00 2.67 H new ATOM 2017 N GLU A1949 13.789 -11.360 2.841 1.00 0.34 N ATOM 2018 CA GLU A1949 12.615 -11.034 3.635 1.00 0.36 C ATOM 2019 C GLU A1949 11.758 -9.980 2.943 1.00 0.32 C ATOM 2020 O GLU A1949 10.533 -10.011 3.044 1.00 0.34 O ATOM 2021 CB GLU A1949 13.010 -10.558 5.030 1.00 0.42 C ATOM 2022 CG GLU A1949 13.767 -11.602 5.830 1.00 0.49 C ATOM 2023 CD GLU A1949 13.775 -11.299 7.310 1.00 0.86 C ATOM 2024 OE1 GLU A1949 14.554 -10.426 7.741 1.00 1.53 O ATOM 2025 OE2 GLU A1949 12.995 -11.936 8.050 1.00 0.99 O ATOM 0 H GLU A1949 14.675 -11.064 3.250 1.00 0.34 H new ATOM 0 HA GLU A1949 12.026 -11.945 3.735 1.00 0.36 H new ATOM 0 HB2 GLU A1949 13.626 -9.663 4.940 1.00 0.42 H new ATOM 0 HB3 GLU A1949 12.111 -10.273 5.577 1.00 0.42 H new ATOM 0 HG2 GLU A1949 13.316 -12.580 5.665 1.00 0.49 H new ATOM 0 HG3 GLU A1949 14.794 -11.659 5.468 1.00 0.49 H new ATOM 2032 N LEU A1950 12.400 -9.053 2.237 1.00 0.29 N ATOM 2033 CA LEU A1950 11.674 -8.045 1.471 1.00 0.27 C ATOM 2034 C LEU A1950 10.909 -8.714 0.336 1.00 0.25 C ATOM 2035 O LEU A1950 9.785 -8.324 0.019 1.00 0.27 O ATOM 2036 CB LEU A1950 12.635 -6.971 0.935 1.00 0.27 C ATOM 2037 CG LEU A1950 11.996 -5.862 0.087 1.00 0.27 C ATOM 2038 CD1 LEU A1950 12.804 -4.586 0.207 1.00 0.31 C ATOM 2039 CD2 LEU A1950 11.904 -6.270 -1.379 1.00 0.29 C ATOM 0 H LEU A1950 13.416 -8.979 2.180 1.00 0.29 H new ATOM 0 HA LEU A1950 10.959 -7.548 2.127 1.00 0.27 H new ATOM 0 HB2 LEU A1950 13.141 -6.508 1.782 1.00 0.27 H new ATOM 0 HB3 LEU A1950 13.402 -7.463 0.337 1.00 0.27 H new ATOM 0 HG LEU A1950 10.986 -5.694 0.462 1.00 0.27 H new ATOM 0 HD11 LEU A1950 12.343 -3.805 -0.398 1.00 0.31 H new ATOM 0 HD12 LEU A1950 12.831 -4.269 1.250 1.00 0.31 H new ATOM 0 HD13 LEU A1950 13.820 -4.765 -0.144 1.00 0.31 H new ATOM 0 HD21 LEU A1950 11.447 -5.464 -1.953 1.00 0.29 H new ATOM 0 HD22 LEU A1950 12.904 -6.469 -1.765 1.00 0.29 H new ATOM 0 HD23 LEU A1950 11.295 -7.170 -1.469 1.00 0.29 H new ATOM 2051 N ILE A1951 11.525 -9.726 -0.264 1.00 0.25 N ATOM 2052 CA ILE A1951 10.867 -10.535 -1.278 1.00 0.26 C ATOM 2053 C ILE A1951 9.568 -11.110 -0.721 1.00 0.28 C ATOM 2054 O ILE A1951 8.521 -11.058 -1.365 1.00 0.31 O ATOM 2055 CB ILE A1951 11.782 -11.688 -1.750 1.00 0.28 C ATOM 2056 CG1 ILE A1951 13.033 -11.127 -2.430 1.00 0.30 C ATOM 2057 CG2 ILE A1951 11.036 -12.625 -2.689 1.00 0.32 C ATOM 2058 CD1 ILE A1951 14.039 -12.188 -2.824 1.00 0.35 C ATOM 0 H ILE A1951 12.485 -10.005 -0.063 1.00 0.25 H new ATOM 0 HA ILE A1951 10.649 -9.895 -2.133 1.00 0.26 H new ATOM 0 HB ILE A1951 12.088 -12.263 -0.876 1.00 0.28 H new ATOM 0 HG12 ILE A1951 12.735 -10.573 -3.320 1.00 0.30 H new ATOM 0 HG13 ILE A1951 13.513 -10.415 -1.758 1.00 0.30 H new ATOM 0 HG21 ILE A1951 11.702 -13.427 -3.007 1.00 0.32 H new ATOM 0 HG22 ILE A1951 10.176 -13.050 -2.171 1.00 0.32 H new ATOM 0 HG23 ILE A1951 10.695 -12.069 -3.562 1.00 0.32 H new ATOM 0 HD11 ILE A1951 14.898 -11.716 -3.300 1.00 0.35 H new ATOM 0 HD12 ILE A1951 14.367 -12.726 -1.935 1.00 0.35 H new ATOM 0 HD13 ILE A1951 13.577 -12.887 -3.521 1.00 0.35 H new ATOM 2070 N GLU A1952 9.645 -11.624 0.501 1.00 0.30 N ATOM 2071 CA GLU A1952 8.485 -12.187 1.178 1.00 0.35 C ATOM 2072 C GLU A1952 7.444 -11.102 1.455 1.00 0.33 C ATOM 2073 O GLU A1952 6.244 -11.330 1.296 1.00 0.37 O ATOM 2074 CB GLU A1952 8.912 -12.851 2.491 1.00 0.43 C ATOM 2075 CG GLU A1952 10.056 -13.842 2.330 1.00 0.54 C ATOM 2076 CD GLU A1952 10.521 -14.422 3.651 1.00 1.17 C ATOM 2077 OE1 GLU A1952 11.067 -13.664 4.480 1.00 2.11 O ATOM 2078 OE2 GLU A1952 10.349 -15.641 3.872 1.00 1.48 O ATOM 0 H GLU A1952 10.506 -11.662 1.046 1.00 0.30 H new ATOM 0 HA GLU A1952 8.038 -12.939 0.528 1.00 0.35 H new ATOM 0 HB2 GLU A1952 9.209 -12.078 3.199 1.00 0.43 H new ATOM 0 HB3 GLU A1952 8.054 -13.366 2.923 1.00 0.43 H new ATOM 0 HG2 GLU A1952 9.739 -14.653 1.674 1.00 0.54 H new ATOM 0 HG3 GLU A1952 10.894 -13.346 1.841 1.00 0.54 H new ATOM 2085 N CYS A1953 7.911 -9.923 1.862 1.00 0.31 N ATOM 2086 CA CYS A1953 7.027 -8.785 2.107 1.00 0.31 C ATOM 2087 C CYS A1953 6.269 -8.412 0.835 1.00 0.27 C ATOM 2088 O CYS A1953 5.073 -8.119 0.874 1.00 0.30 O ATOM 2089 CB CYS A1953 7.827 -7.578 2.614 1.00 0.33 C ATOM 2090 SG CYS A1953 8.648 -7.845 4.204 1.00 0.88 S ATOM 0 H CYS A1953 8.899 -9.731 2.029 1.00 0.31 H new ATOM 0 HA CYS A1953 6.307 -9.074 2.873 1.00 0.31 H new ATOM 0 HB2 CYS A1953 8.579 -7.316 1.869 1.00 0.33 H new ATOM 0 HB3 CYS A1953 7.156 -6.724 2.704 1.00 0.33 H new ATOM 0 HG CYS A1953 9.562 -8.760 4.072 1.00 0.88 H new ATOM 2096 N ALA A1954 6.974 -8.443 -0.293 1.00 0.23 N ATOM 2097 CA ALA A1954 6.373 -8.137 -1.584 1.00 0.22 C ATOM 2098 C ALA A1954 5.268 -9.131 -1.925 1.00 0.23 C ATOM 2099 O ALA A1954 4.223 -8.752 -2.456 1.00 0.25 O ATOM 2100 CB ALA A1954 7.436 -8.128 -2.672 1.00 0.25 C ATOM 0 H ALA A1954 7.966 -8.678 -0.337 1.00 0.23 H new ATOM 0 HA ALA A1954 5.925 -7.145 -1.523 1.00 0.22 H new ATOM 0 HB1 ALA A1954 6.973 -7.898 -3.631 1.00 0.25 H new ATOM 0 HB2 ALA A1954 8.187 -7.372 -2.441 1.00 0.25 H new ATOM 0 HB3 ALA A1954 7.911 -9.107 -2.724 1.00 0.25 H new ATOM 2106 N ARG A1955 5.495 -10.402 -1.602 1.00 0.28 N ATOM 2107 CA ARG A1955 4.499 -11.440 -1.855 1.00 0.34 C ATOM 2108 C ARG A1955 3.208 -11.112 -1.116 1.00 0.34 C ATOM 2109 O ARG A1955 2.117 -11.202 -1.676 1.00 0.40 O ATOM 2110 CB ARG A1955 5.001 -12.817 -1.400 1.00 0.48 C ATOM 2111 CG ARG A1955 6.371 -13.205 -1.936 1.00 0.92 C ATOM 2112 CD ARG A1955 6.459 -13.060 -3.444 1.00 1.00 C ATOM 2113 NE ARG A1955 7.699 -13.626 -3.971 1.00 1.71 N ATOM 2114 CZ ARG A1955 8.187 -13.379 -5.186 1.00 2.30 C ATOM 2115 NH1 ARG A1955 7.531 -12.596 -6.032 1.00 2.42 N ATOM 2116 NH2 ARG A1955 9.335 -13.934 -5.554 1.00 3.21 N ATOM 0 H ARG A1955 6.355 -10.737 -1.167 1.00 0.28 H new ATOM 0 HA ARG A1955 4.317 -11.472 -2.929 1.00 0.34 H new ATOM 0 HB2 ARG A1955 5.034 -12.834 -0.311 1.00 0.48 H new ATOM 0 HB3 ARG A1955 4.278 -13.572 -1.709 1.00 0.48 H new ATOM 0 HG2 ARG A1955 7.132 -12.581 -1.468 1.00 0.92 H new ATOM 0 HG3 ARG A1955 6.589 -14.236 -1.659 1.00 0.92 H new ATOM 0 HD2 ARG A1955 5.607 -13.557 -3.907 1.00 1.00 H new ATOM 0 HD3 ARG A1955 6.398 -12.005 -3.712 1.00 1.00 H new ATOM 0 HE ARG A1955 8.228 -14.254 -3.366 1.00 1.71 H new ATOM 0 HH11 ARG A1955 6.644 -12.176 -5.755 1.00 2.42 H new ATOM 0 HH12 ARG A1955 7.914 -12.414 -6.960 1.00 2.42 H new ATOM 0 HH21 ARG A1955 9.836 -14.544 -4.909 1.00 3.21 H new ATOM 0 HH22 ARG A1955 9.716 -13.750 -6.482 1.00 3.21 H new ATOM 2130 N ARG A1956 3.358 -10.699 0.140 1.00 0.35 N ATOM 2131 CA ARG A1956 2.225 -10.370 0.999 1.00 0.40 C ATOM 2132 C ARG A1956 1.358 -9.293 0.361 1.00 0.35 C ATOM 2133 O ARG A1956 0.143 -9.448 0.249 1.00 0.42 O ATOM 2134 CB ARG A1956 2.723 -9.870 2.356 1.00 0.50 C ATOM 2135 CG ARG A1956 3.591 -10.861 3.112 1.00 0.89 C ATOM 2136 CD ARG A1956 2.765 -11.856 3.910 1.00 1.05 C ATOM 2137 NE ARG A1956 2.121 -12.876 3.082 1.00 1.60 N ATOM 2138 CZ ARG A1956 1.531 -13.959 3.587 1.00 2.17 C ATOM 2139 NH1 ARG A1956 1.470 -14.127 4.904 1.00 2.22 N ATOM 2140 NH2 ARG A1956 0.996 -14.865 2.780 1.00 3.16 N ATOM 0 H ARG A1956 4.266 -10.583 0.590 1.00 0.35 H new ATOM 0 HA ARG A1956 1.630 -11.273 1.133 1.00 0.40 H new ATOM 0 HB2 ARG A1956 3.290 -8.951 2.205 1.00 0.50 H new ATOM 0 HB3 ARG A1956 1.862 -9.615 2.974 1.00 0.50 H new ATOM 0 HG2 ARG A1956 4.223 -11.400 2.406 1.00 0.89 H new ATOM 0 HG3 ARG A1956 4.255 -10.320 3.786 1.00 0.89 H new ATOM 0 HD2 ARG A1956 3.408 -12.346 4.642 1.00 1.05 H new ATOM 0 HD3 ARG A1956 2.000 -11.316 4.468 1.00 1.05 H new ATOM 0 HE ARG A1956 2.124 -12.752 2.070 1.00 1.60 H new ATOM 0 HH11 ARG A1956 1.874 -13.428 5.527 1.00 2.22 H new ATOM 0 HH12 ARG A1956 1.019 -14.955 5.292 1.00 2.22 H new ATOM 0 HH21 ARG A1956 1.035 -14.734 1.769 1.00 3.16 H new ATOM 0 HH22 ARG A1956 0.545 -15.693 3.170 1.00 3.16 H new ATOM 2154 N VAL A1957 1.998 -8.208 -0.059 1.00 0.26 N ATOM 2155 CA VAL A1957 1.292 -7.081 -0.650 1.00 0.24 C ATOM 2156 C VAL A1957 0.564 -7.507 -1.920 1.00 0.22 C ATOM 2157 O VAL A1957 -0.618 -7.212 -2.090 1.00 0.24 O ATOM 2158 CB VAL A1957 2.254 -5.919 -0.973 1.00 0.25 C ATOM 2159 CG1 VAL A1957 1.485 -4.705 -1.475 1.00 0.28 C ATOM 2160 CG2 VAL A1957 3.086 -5.561 0.246 1.00 0.30 C ATOM 0 H VAL A1957 3.009 -8.086 -0.000 1.00 0.26 H new ATOM 0 HA VAL A1957 0.564 -6.734 0.084 1.00 0.24 H new ATOM 0 HB VAL A1957 2.928 -6.244 -1.765 1.00 0.25 H new ATOM 0 HG11 VAL A1957 2.183 -3.898 -1.696 1.00 0.28 H new ATOM 0 HG12 VAL A1957 0.938 -4.970 -2.380 1.00 0.28 H new ATOM 0 HG13 VAL A1957 0.783 -4.377 -0.709 1.00 0.28 H new ATOM 0 HG21 VAL A1957 3.759 -4.740 -0.001 1.00 0.30 H new ATOM 0 HG22 VAL A1957 2.427 -5.258 1.060 1.00 0.30 H new ATOM 0 HG23 VAL A1957 3.670 -6.428 0.555 1.00 0.30 H new ATOM 2170 N SER A1958 1.268 -8.227 -2.790 1.00 0.21 N ATOM 2171 CA SER A1958 0.691 -8.706 -4.042 1.00 0.25 C ATOM 2172 C SER A1958 -0.566 -9.537 -3.776 1.00 0.27 C ATOM 2173 O SER A1958 -1.575 -9.392 -4.474 1.00 0.30 O ATOM 2174 CB SER A1958 1.728 -9.530 -4.816 1.00 0.29 C ATOM 2175 OG SER A1958 1.225 -9.953 -6.074 1.00 1.13 O ATOM 0 H SER A1958 2.243 -8.492 -2.649 1.00 0.21 H new ATOM 0 HA SER A1958 0.405 -7.845 -4.646 1.00 0.25 H new ATOM 0 HB2 SER A1958 2.629 -8.935 -4.965 1.00 0.29 H new ATOM 0 HB3 SER A1958 2.015 -10.401 -4.227 1.00 0.29 H new ATOM 0 HG SER A1958 1.911 -10.474 -6.542 1.00 1.13 H new ATOM 2181 N GLU A1959 -0.504 -10.385 -2.752 1.00 0.28 N ATOM 2182 CA GLU A1959 -1.646 -11.209 -2.366 1.00 0.35 C ATOM 2183 C GLU A1959 -2.820 -10.340 -1.929 1.00 0.33 C ATOM 2184 O GLU A1959 -3.972 -10.599 -2.281 1.00 0.42 O ATOM 2185 CB GLU A1959 -1.275 -12.154 -1.219 1.00 0.43 C ATOM 2186 CG GLU A1959 -0.246 -13.212 -1.580 1.00 0.51 C ATOM 2187 CD GLU A1959 0.028 -14.156 -0.426 1.00 1.18 C ATOM 2188 OE1 GLU A1959 -0.803 -15.060 -0.187 1.00 1.59 O ATOM 2189 OE2 GLU A1959 1.065 -13.996 0.256 1.00 1.86 O ATOM 0 H GLU A1959 0.326 -10.519 -2.174 1.00 0.28 H new ATOM 0 HA GLU A1959 -1.934 -11.795 -3.239 1.00 0.35 H new ATOM 0 HB2 GLU A1959 -0.892 -11.562 -0.387 1.00 0.43 H new ATOM 0 HB3 GLU A1959 -2.179 -12.650 -0.867 1.00 0.43 H new ATOM 0 HG2 GLU A1959 -0.599 -13.783 -2.439 1.00 0.51 H new ATOM 0 HG3 GLU A1959 0.683 -12.727 -1.880 1.00 0.51 H new ATOM 2196 N LYS A1960 -2.521 -9.297 -1.166 1.00 0.25 N ATOM 2197 CA LYS A1960 -3.559 -8.466 -0.576 1.00 0.27 C ATOM 2198 C LYS A1960 -4.222 -7.569 -1.614 1.00 0.24 C ATOM 2199 O LYS A1960 -5.411 -7.287 -1.506 1.00 0.28 O ATOM 2200 CB LYS A1960 -3.004 -7.627 0.579 1.00 0.32 C ATOM 2201 CG LYS A1960 -2.381 -8.458 1.695 1.00 0.41 C ATOM 2202 CD LYS A1960 -3.294 -9.597 2.129 1.00 0.49 C ATOM 2203 CE LYS A1960 -2.653 -10.460 3.204 1.00 0.64 C ATOM 2204 NZ LYS A1960 -2.544 -9.749 4.503 1.00 0.65 N ATOM 0 H LYS A1960 -1.569 -9.007 -0.942 1.00 0.25 H new ATOM 0 HA LYS A1960 -4.321 -9.138 -0.180 1.00 0.27 H new ATOM 0 HB2 LYS A1960 -2.255 -6.938 0.189 1.00 0.32 H new ATOM 0 HB3 LYS A1960 -3.808 -7.020 0.995 1.00 0.32 H new ATOM 0 HG2 LYS A1960 -1.428 -8.865 1.357 1.00 0.41 H new ATOM 0 HG3 LYS A1960 -2.168 -7.817 2.550 1.00 0.41 H new ATOM 0 HD2 LYS A1960 -4.232 -9.187 2.504 1.00 0.49 H new ATOM 0 HD3 LYS A1960 -3.539 -10.215 1.265 1.00 0.49 H new ATOM 0 HE2 LYS A1960 -3.241 -11.368 3.337 1.00 0.64 H new ATOM 0 HE3 LYS A1960 -1.660 -10.768 2.876 1.00 0.64 H new ATOM 0 HZ1 LYS A1960 -1.861 -10.243 5.113 1.00 0.65 H new ATOM 0 HZ2 LYS A1960 -2.221 -8.774 4.339 1.00 0.65 H new ATOM 0 HZ3 LYS A1960 -3.474 -9.732 4.968 1.00 0.65 H new ATOM 2218 N VAL A1961 -3.467 -7.135 -2.622 1.00 0.21 N ATOM 2219 CA VAL A1961 -4.029 -6.295 -3.682 1.00 0.20 C ATOM 2220 C VAL A1961 -5.216 -6.988 -4.340 1.00 0.19 C ATOM 2221 O VAL A1961 -6.276 -6.390 -4.521 1.00 0.19 O ATOM 2222 CB VAL A1961 -2.994 -5.946 -4.773 1.00 0.23 C ATOM 2223 CG1 VAL A1961 -3.615 -5.038 -5.827 1.00 0.27 C ATOM 2224 CG2 VAL A1961 -1.768 -5.290 -4.163 1.00 0.27 C ATOM 0 H VAL A1961 -2.475 -7.347 -2.728 1.00 0.21 H new ATOM 0 HA VAL A1961 -4.347 -5.369 -3.203 1.00 0.20 H new ATOM 0 HB VAL A1961 -2.681 -6.873 -5.254 1.00 0.23 H new ATOM 0 HG11 VAL A1961 -2.871 -4.802 -6.588 1.00 0.27 H new ATOM 0 HG12 VAL A1961 -4.461 -5.545 -6.291 1.00 0.27 H new ATOM 0 HG13 VAL A1961 -3.958 -4.116 -5.357 1.00 0.27 H new ATOM 0 HG21 VAL A1961 -1.052 -5.053 -4.950 1.00 0.27 H new ATOM 0 HG22 VAL A1961 -2.062 -4.373 -3.652 1.00 0.27 H new ATOM 0 HG23 VAL A1961 -1.308 -5.972 -3.448 1.00 0.27 H new ATOM 2234 N SER A1962 -5.038 -8.261 -4.671 1.00 0.22 N ATOM 2235 CA SER A1962 -6.095 -9.046 -5.289 1.00 0.27 C ATOM 2236 C SER A1962 -7.295 -9.172 -4.350 1.00 0.25 C ATOM 2237 O SER A1962 -8.442 -9.231 -4.794 1.00 0.28 O ATOM 2238 CB SER A1962 -5.561 -10.427 -5.662 1.00 0.35 C ATOM 2239 OG SER A1962 -4.368 -10.317 -6.422 1.00 1.30 O ATOM 0 H SER A1962 -4.168 -8.772 -4.520 1.00 0.22 H new ATOM 0 HA SER A1962 -6.427 -8.537 -6.194 1.00 0.27 H new ATOM 0 HB2 SER A1962 -5.369 -11.004 -4.758 1.00 0.35 H new ATOM 0 HB3 SER A1962 -6.313 -10.971 -6.234 1.00 0.35 H new ATOM 0 HG SER A1962 -4.041 -11.213 -6.649 1.00 1.30 H new ATOM 2245 N HIS A1963 -7.025 -9.187 -3.049 1.00 0.26 N ATOM 2246 CA HIS A1963 -8.081 -9.273 -2.046 1.00 0.30 C ATOM 2247 C HIS A1963 -8.845 -7.956 -1.973 1.00 0.24 C ATOM 2248 O HIS A1963 -10.061 -7.939 -1.785 1.00 0.27 O ATOM 2249 CB HIS A1963 -7.503 -9.620 -0.668 1.00 0.41 C ATOM 2250 CG HIS A1963 -6.907 -10.994 -0.575 1.00 0.53 C ATOM 2251 ND1 HIS A1963 -6.424 -11.524 0.602 1.00 1.08 N ATOM 2252 CD2 HIS A1963 -6.711 -11.948 -1.517 1.00 1.11 C ATOM 2253 CE1 HIS A1963 -5.959 -12.738 0.379 1.00 0.95 C ATOM 2254 NE2 HIS A1963 -6.120 -13.021 -0.898 1.00 0.93 N ATOM 0 H HIS A1963 -6.082 -9.141 -2.664 1.00 0.26 H new ATOM 0 HA HIS A1963 -8.765 -10.068 -2.341 1.00 0.30 H new ATOM 0 HB2 HIS A1963 -6.738 -8.887 -0.413 1.00 0.41 H new ATOM 0 HB3 HIS A1963 -8.293 -9.528 0.078 1.00 0.41 H new ATOM 0 HD2 HIS A1963 -6.972 -11.877 -2.563 1.00 1.11 H new ATOM 0 HE1 HIS A1963 -5.520 -13.391 1.119 1.00 0.95 H new ATOM 0 HE2 HIS A1963 -5.850 -13.894 -1.352 1.00 0.93 H new ATOM 2263 N VAL A1964 -8.118 -6.853 -2.123 1.00 0.24 N ATOM 2264 CA VAL A1964 -8.727 -5.529 -2.154 1.00 0.25 C ATOM 2265 C VAL A1964 -9.590 -5.382 -3.399 1.00 0.24 C ATOM 2266 O VAL A1964 -10.729 -4.928 -3.327 1.00 0.29 O ATOM 2267 CB VAL A1964 -7.663 -4.406 -2.140 1.00 0.28 C ATOM 2268 CG1 VAL A1964 -8.323 -3.034 -2.106 1.00 0.35 C ATOM 2269 CG2 VAL A1964 -6.719 -4.572 -0.961 1.00 0.33 C ATOM 0 H VAL A1964 -7.103 -6.851 -2.225 1.00 0.24 H new ATOM 0 HA VAL A1964 -9.340 -5.431 -1.258 1.00 0.25 H new ATOM 0 HB VAL A1964 -7.081 -4.483 -3.059 1.00 0.28 H new ATOM 0 HG11 VAL A1964 -7.555 -2.261 -2.097 1.00 0.35 H new ATOM 0 HG12 VAL A1964 -8.951 -2.911 -2.988 1.00 0.35 H new ATOM 0 HG13 VAL A1964 -8.936 -2.947 -1.209 1.00 0.35 H new ATOM 0 HG21 VAL A1964 -5.979 -3.771 -0.971 1.00 0.33 H new ATOM 0 HG22 VAL A1964 -7.287 -4.529 -0.032 1.00 0.33 H new ATOM 0 HG23 VAL A1964 -6.213 -5.535 -1.033 1.00 0.33 H new ATOM 2279 N LEU A1965 -9.038 -5.786 -4.538 1.00 0.23 N ATOM 2280 CA LEU A1965 -9.759 -5.754 -5.804 1.00 0.26 C ATOM 2281 C LEU A1965 -11.060 -6.541 -5.702 1.00 0.29 C ATOM 2282 O LEU A1965 -12.120 -6.060 -6.103 1.00 0.35 O ATOM 2283 CB LEU A1965 -8.884 -6.329 -6.921 1.00 0.26 C ATOM 2284 CG LEU A1965 -7.646 -5.498 -7.270 1.00 0.26 C ATOM 2285 CD1 LEU A1965 -6.681 -6.311 -8.115 1.00 0.28 C ATOM 2286 CD2 LEU A1965 -8.049 -4.228 -8.004 1.00 0.28 C ATOM 0 H LEU A1965 -8.085 -6.142 -4.609 1.00 0.23 H new ATOM 0 HA LEU A1965 -10.000 -4.717 -6.038 1.00 0.26 H new ATOM 0 HB2 LEU A1965 -8.561 -7.329 -6.630 1.00 0.26 H new ATOM 0 HB3 LEU A1965 -9.493 -6.439 -7.818 1.00 0.26 H new ATOM 0 HG LEU A1965 -7.145 -5.220 -6.343 1.00 0.26 H new ATOM 0 HD11 LEU A1965 -5.807 -5.705 -8.354 1.00 0.28 H new ATOM 0 HD12 LEU A1965 -6.369 -7.196 -7.561 1.00 0.28 H new ATOM 0 HD13 LEU A1965 -7.174 -6.616 -9.038 1.00 0.28 H new ATOM 0 HD21 LEU A1965 -7.158 -3.649 -8.245 1.00 0.28 H new ATOM 0 HD22 LEU A1965 -8.571 -4.490 -8.924 1.00 0.28 H new ATOM 0 HD23 LEU A1965 -8.707 -3.634 -7.370 1.00 0.28 H new ATOM 2298 N ALA A1966 -10.971 -7.738 -5.133 1.00 0.28 N ATOM 2299 CA ALA A1966 -12.130 -8.607 -4.967 1.00 0.33 C ATOM 2300 C ALA A1966 -13.188 -7.958 -4.077 1.00 0.34 C ATOM 2301 O ALA A1966 -14.388 -8.160 -4.274 1.00 0.40 O ATOM 2302 CB ALA A1966 -11.704 -9.950 -4.393 1.00 0.37 C ATOM 0 H ALA A1966 -10.100 -8.131 -4.776 1.00 0.28 H new ATOM 0 HA ALA A1966 -12.574 -8.767 -5.950 1.00 0.33 H new ATOM 0 HB1 ALA A1966 -12.579 -10.589 -4.274 1.00 0.37 H new ATOM 0 HB2 ALA A1966 -10.996 -10.427 -5.070 1.00 0.37 H new ATOM 0 HB3 ALA A1966 -11.232 -9.798 -3.423 1.00 0.37 H new ATOM 2308 N ALA A1967 -12.737 -7.167 -3.107 1.00 0.32 N ATOM 2309 CA ALA A1967 -13.641 -6.467 -2.203 1.00 0.36 C ATOM 2310 C ALA A1967 -14.543 -5.505 -2.973 1.00 0.36 C ATOM 2311 O ALA A1967 -15.672 -5.231 -2.562 1.00 0.46 O ATOM 2312 CB ALA A1967 -12.854 -5.715 -1.139 1.00 0.40 C ATOM 0 H ALA A1967 -11.748 -6.995 -2.928 1.00 0.32 H new ATOM 0 HA ALA A1967 -14.271 -7.209 -1.713 1.00 0.36 H new ATOM 0 HB1 ALA A1967 -13.545 -5.198 -0.473 1.00 0.40 H new ATOM 0 HB2 ALA A1967 -12.254 -6.420 -0.564 1.00 0.40 H new ATOM 0 HB3 ALA A1967 -12.199 -4.987 -1.618 1.00 0.40 H new ATOM 2318 N LEU A1968 -14.044 -5.008 -4.098 1.00 0.35 N ATOM 2319 CA LEU A1968 -14.809 -4.093 -4.929 1.00 0.36 C ATOM 2320 C LEU A1968 -15.943 -4.811 -5.650 1.00 0.43 C ATOM 2321 O LEU A1968 -17.090 -4.374 -5.593 1.00 0.50 O ATOM 2322 CB LEU A1968 -13.915 -3.384 -5.948 1.00 0.39 C ATOM 2323 CG LEU A1968 -13.232 -2.108 -5.448 1.00 0.38 C ATOM 2324 CD1 LEU A1968 -14.238 -1.196 -4.764 1.00 0.32 C ATOM 2325 CD2 LEU A1968 -12.084 -2.436 -4.511 1.00 0.45 C ATOM 0 H LEU A1968 -13.113 -5.224 -4.454 1.00 0.35 H new ATOM 0 HA LEU A1968 -15.239 -3.345 -4.263 1.00 0.36 H new ATOM 0 HB2 LEU A1968 -13.146 -4.082 -6.278 1.00 0.39 H new ATOM 0 HB3 LEU A1968 -14.516 -3.135 -6.822 1.00 0.39 H new ATOM 0 HG LEU A1968 -12.822 -1.584 -6.312 1.00 0.38 H new ATOM 0 HD11 LEU A1968 -13.734 -0.295 -4.416 1.00 0.32 H new ATOM 0 HD12 LEU A1968 -15.021 -0.923 -5.471 1.00 0.32 H new ATOM 0 HD13 LEU A1968 -14.681 -1.715 -3.914 1.00 0.32 H new ATOM 0 HD21 LEU A1968 -11.617 -1.512 -4.171 1.00 0.45 H new ATOM 0 HD22 LEU A1968 -12.463 -2.989 -3.651 1.00 0.45 H new ATOM 0 HD23 LEU A1968 -11.347 -3.043 -5.037 1.00 0.45 H new ATOM 2337 N GLN A1969 -15.633 -5.913 -6.325 1.00 0.50 N ATOM 2338 CA GLN A1969 -16.656 -6.641 -7.068 1.00 0.63 C ATOM 2339 C GLN A1969 -17.648 -7.293 -6.114 1.00 0.69 C ATOM 2340 O GLN A1969 -18.808 -7.500 -6.463 1.00 0.81 O ATOM 2341 CB GLN A1969 -16.054 -7.703 -7.995 1.00 0.75 C ATOM 2342 CG GLN A1969 -15.182 -7.135 -9.102 1.00 0.79 C ATOM 2343 CD GLN A1969 -13.723 -7.069 -8.711 1.00 0.70 C ATOM 2344 OE1 GLN A1969 -13.241 -7.900 -7.943 1.00 1.70 O ATOM 2345 NE2 GLN A1969 -13.013 -6.082 -9.232 1.00 0.81 N ATOM 0 H GLN A1969 -14.698 -6.317 -6.373 1.00 0.50 H new ATOM 0 HA GLN A1969 -17.175 -5.912 -7.690 1.00 0.63 H new ATOM 0 HB2 GLN A1969 -15.461 -8.396 -7.399 1.00 0.75 H new ATOM 0 HB3 GLN A1969 -16.863 -8.280 -8.444 1.00 0.75 H new ATOM 0 HG2 GLN A1969 -15.288 -7.750 -9.996 1.00 0.79 H new ATOM 0 HG3 GLN A1969 -15.532 -6.135 -9.359 1.00 0.79 H new ATOM 0 HE21 GLN A1969 -13.454 -5.415 -9.865 1.00 0.81 H new ATOM 0 HE22 GLN A1969 -12.024 -5.988 -9.001 1.00 0.81 H new ATOM 2354 N ALA A1970 -17.193 -7.584 -4.900 1.00 0.66 N ATOM 2355 CA ALA A1970 -18.045 -8.213 -3.896 1.00 0.79 C ATOM 2356 C ALA A1970 -19.182 -7.283 -3.484 1.00 0.78 C ATOM 2357 O ALA A1970 -20.244 -7.735 -3.061 1.00 0.93 O ATOM 2358 CB ALA A1970 -17.227 -8.619 -2.680 1.00 0.84 C ATOM 0 H ALA A1970 -16.241 -7.395 -4.587 1.00 0.66 H new ATOM 0 HA ALA A1970 -18.481 -9.109 -4.338 1.00 0.79 H new ATOM 0 HB1 ALA A1970 -17.879 -9.086 -1.942 1.00 0.84 H new ATOM 0 HB2 ALA A1970 -16.454 -9.326 -2.981 1.00 0.84 H new ATOM 0 HB3 ALA A1970 -16.760 -7.736 -2.244 1.00 0.84 H new