USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1097 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: A1988 SER OG : rot -134:sc= 0.686 USER MOD Set 1.2: A2016 SER OG : rot -150:sc= 0.6 USER MOD Set 2.1: A1986 HIS : no HE2:sc= 1.03 K(o=0.6,f=-11!) USER MOD Set 2.2: A2015 THR OG1 : rot -39:sc= -0.431 USER MOD Set 3.1: A1984 MET CE :methyl -127:sc= -0.0727 (180deg=-0.549) USER MOD Set 3.2: A2013 THR OG1 : rot 31:sc= 1.06 USER MOD Set 4.1: A1958 SER OG : rot -77:sc= 1.04 USER MOD Set 4.2: A1960 THR OG1 : rot -171:sc= 0.889 USER MOD Set 5.1: A1918 THR OG1 : rot -150:sc= 1.04 USER MOD Set 5.2: A1924 LYS NZ :NH3+ 150:sc= 1.19 (180deg=0) USER MOD Set 6.1: A1888 ASN : amide:sc= -0.752 K(o=-0.51,f=-1.2!) USER MOD Set 6.2: A1890 GLN : amide:sc= -0.147 K(o=-0.51,f=-2.5) USER MOD Set 6.3: A1910 LYS NZ :NH3+ 150:sc= 0.387 (180deg=0.681) USER MOD Set 7.1: A1887 SER OG : rot 180:sc= -0.99! USER MOD Set 7.2: A1908 SER OG : rot -120:sc= -0.604 USER MOD Set 8.1: A1897 ASN : amide:sc= 0.35 K(o=2.9,f=0.43!) USER MOD Set 8.2: A1900 THR OG1 : rot -71:sc= 0.754 USER MOD Set 8.3: A1966 GLN : amide:sc= 1.78 K(o=2.9,f=-0.19) USER MOD Single : A1885 MET CE :methyl -159:sc= -0.0738 (180deg=-0.526) USER MOD Single : A1886 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1891 ASN : amide:sc= 0.395 X(o=0.39,f=0) USER MOD Single : A1896 THR OG1 : rot 180:sc= -0.271 USER MOD Single : A1902 HIS : no HD1:sc= -0.0657 K(o=-0.066,f=-2.9!) USER MOD Single : A1907 THR OG1 : rot -114:sc= 1.18 USER MOD Single : A1913 SER OG : rot 180:sc= 0.313 USER MOD Single : A1915 TYR OH : rot 111:sc= -0.851 USER MOD Single : A1916 THR OG1 : rot 180:sc= 0 USER MOD Single : A1920 SER OG : rot 180:sc= 0.0247 USER MOD Single : A1921 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1922 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1928 ASN : amide:sc= 0.637 K(o=0.64,f=-3.1!) USER MOD Single : A1934 LYS NZ :NH3+ 174:sc= 1.24 (180deg=1.12) USER MOD Single : A1935 SER OG : rot 99:sc= 1.09 USER MOD Single : A1936 SER OG : rot 180:sc= 0 USER MOD Single : A1939 ASN : amide:sc= -0.263 X(o=-0.26,f=-0.0094) USER MOD Single : A1946 THR OG1 : rot 180:sc= 0 USER MOD Single : A1950 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1951 THR OG1 : rot 180:sc= 0 USER MOD Single : A1953 ASN : amide:sc= -1.94! X(o=-1.9!,f=-2.1) USER MOD Single : A1956 LYS NZ :NH3+ -174:sc= 0.867 (180deg=0.82) USER MOD Single : A1959 LYS NZ :NH3+ 168:sc= -0.0181 (180deg=-0.203) USER MOD Single : A1962 THR OG1 : rot 180:sc= 0 USER MOD Single : A1963 TYR OH : rot 180:sc= 0 USER MOD Single : A1969 LYS NZ :NH3+ -139:sc= -0.345 (180deg=-2.52!) USER MOD Single : A1972 TYR OH : rot 38:sc= -0.0144 USER MOD Single : A1980 THR OG1 : rot 88:sc= 1.49 USER MOD Single : A1983 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1985 LYS NZ :NH3+ -172:sc=-0.00237 (180deg=-0.0907) USER MOD Single : A1987 LYS NZ :NH3+ -122:sc= 1.24 (180deg=0.306) USER MOD Single : A1989 TYR OH : rot 180:sc= 0 USER MOD Single : A1991 SER OG : rot 180:sc= 0 USER MOD Single : A1995 LYS NZ :NH3+ -168:sc= 0.87 (180deg=0.708) USER MOD Single : A1996 SER OG : rot 180:sc= 0 USER MOD Single : A2002 SER OG : rot 180:sc= 0 USER MOD Single : A2003 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2008 SER OG : rot 180:sc= 0 USER MOD Single : A2012 GLN : amide:sc= -1.09! K(o=-1.1!,f=-0.0098) USER MOD Single : A2017 TYR OH : rot 180:sc= 0 USER MOD Single : A2019 SER OG : rot 180:sc= 0 USER MOD Single : A2021 HIS : no HE2:sc= -0.317 K(o=-0.32,f=-3.7!) USER MOD Single : A2022 THR OG1 : rot 128:sc= -0.29 USER MOD Single : A2023 SER OG : rot -57:sc= 0.0641 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A1885 16.792 7.704 2.757 1.00 5.18 N ATOM 2 CA MET A1885 16.040 8.829 3.319 1.00 4.46 C ATOM 3 C MET A1885 14.935 8.320 4.229 1.00 3.65 C ATOM 4 O MET A1885 14.633 7.125 4.230 1.00 3.88 O ATOM 5 CB MET A1885 15.453 9.761 2.222 1.00 4.63 C ATOM 6 CG MET A1885 14.488 9.102 1.237 1.00 4.63 C ATOM 7 SD MET A1885 15.305 8.054 0.011 1.00 5.35 S ATOM 8 CE MET A1885 16.174 9.294 -0.958 1.00 5.61 C ATOM 0 HA MET A1885 16.742 9.426 3.901 1.00 4.46 H new ATOM 0 HB2 MET A1885 14.936 10.586 2.711 1.00 4.63 H new ATOM 0 HB3 MET A1885 16.280 10.193 1.658 1.00 4.63 H new ATOM 0 HG2 MET A1885 13.768 8.502 1.794 1.00 4.63 H new ATOM 0 HG3 MET A1885 13.924 9.878 0.720 1.00 4.63 H new ATOM 0 HE1 MET A1885 16.412 8.887 -1.941 1.00 5.61 H new ATOM 0 HE2 MET A1885 15.542 10.175 -1.073 1.00 5.61 H new ATOM 0 HE3 MET A1885 17.096 9.573 -0.448 1.00 5.61 H new ATOM 20 N LYS A1886 14.355 9.220 5.002 1.00 3.10 N ATOM 21 CA LYS A1886 13.303 8.901 5.951 1.00 2.49 C ATOM 22 C LYS A1886 12.359 10.088 6.076 1.00 1.74 C ATOM 23 O LYS A1886 12.809 11.235 6.121 1.00 2.11 O ATOM 24 CB LYS A1886 13.931 8.619 7.320 1.00 3.19 C ATOM 25 CG LYS A1886 12.940 8.372 8.454 1.00 3.90 C ATOM 26 CD LYS A1886 13.652 8.229 9.788 1.00 4.56 C ATOM 27 CE LYS A1886 14.433 9.491 10.128 1.00 5.38 C ATOM 28 NZ LYS A1886 15.152 9.376 11.400 1.00 5.95 N ATOM 0 H LYS A1886 14.605 10.209 4.988 1.00 3.10 H new ATOM 0 HA LYS A1886 12.752 8.026 5.606 1.00 2.49 H new ATOM 0 HB2 LYS A1886 14.580 7.748 7.231 1.00 3.19 H new ATOM 0 HB3 LYS A1886 14.565 9.463 7.591 1.00 3.19 H new ATOM 0 HG2 LYS A1886 12.230 9.197 8.505 1.00 3.90 H new ATOM 0 HG3 LYS A1886 12.365 7.469 8.247 1.00 3.90 H new ATOM 0 HD2 LYS A1886 12.924 8.025 10.573 1.00 4.56 H new ATOM 0 HD3 LYS A1886 14.330 7.376 9.753 1.00 4.56 H new ATOM 0 HE2 LYS A1886 15.144 9.701 9.329 1.00 5.38 H new ATOM 0 HE3 LYS A1886 13.748 10.337 10.176 1.00 5.38 H new ATOM 0 HZ1 LYS A1886 15.668 10.259 11.588 1.00 5.95 H new ATOM 0 HZ2 LYS A1886 14.473 9.202 12.168 1.00 5.95 H new ATOM 0 HZ3 LYS A1886 15.826 8.586 11.348 1.00 5.95 H new ATOM 42 N SER A1887 11.072 9.832 6.099 1.00 1.11 N ATOM 43 CA SER A1887 10.115 10.889 6.320 1.00 1.23 C ATOM 44 C SER A1887 9.534 10.781 7.734 1.00 1.05 C ATOM 45 O SER A1887 9.357 11.791 8.431 1.00 1.33 O ATOM 46 CB SER A1887 9.031 10.860 5.258 1.00 1.99 C ATOM 47 OG SER A1887 9.626 10.945 3.967 1.00 2.83 O ATOM 0 H SER A1887 10.666 8.906 5.968 1.00 1.11 H new ATOM 0 HA SER A1887 10.619 11.852 6.238 1.00 1.23 H new ATOM 0 HB2 SER A1887 8.450 9.942 5.342 1.00 1.99 H new ATOM 0 HB3 SER A1887 8.340 11.690 5.406 1.00 1.99 H new ATOM 0 HG SER A1887 8.926 10.924 3.282 1.00 2.83 H new ATOM 53 N ASN A1888 9.253 9.560 8.147 1.00 0.86 N ATOM 54 CA ASN A1888 8.796 9.249 9.486 1.00 0.91 C ATOM 55 C ASN A1888 9.106 7.761 9.715 1.00 0.87 C ATOM 56 O ASN A1888 9.739 7.161 8.870 1.00 1.23 O ATOM 57 CB ASN A1888 7.289 9.626 9.676 1.00 1.19 C ATOM 58 CG ASN A1888 6.817 9.492 11.122 1.00 1.37 C ATOM 59 OD1 ASN A1888 7.620 9.470 12.039 1.00 1.91 O ATOM 60 ND2 ASN A1888 5.536 9.490 11.349 1.00 1.53 N ATOM 0 H ASN A1888 9.338 8.739 7.547 1.00 0.86 H new ATOM 0 HA ASN A1888 9.311 9.841 10.242 1.00 0.91 H new ATOM 0 HB2 ASN A1888 7.132 10.652 9.342 1.00 1.19 H new ATOM 0 HB3 ASN A1888 6.677 8.987 9.039 1.00 1.19 H new ATOM 0 HD21 ASN A1888 5.188 9.470 12.308 1.00 1.53 H new ATOM 0 HD22 ASN A1888 4.880 9.509 10.568 1.00 1.53 H new ATOM 67 N VAL A1889 8.692 7.168 10.800 1.00 0.91 N ATOM 68 CA VAL A1889 9.071 5.812 11.096 1.00 1.02 C ATOM 69 C VAL A1889 7.946 5.161 11.860 1.00 1.13 C ATOM 70 O VAL A1889 7.105 5.856 12.437 1.00 1.41 O ATOM 71 CB VAL A1889 10.417 5.778 11.913 1.00 1.34 C ATOM 72 CG1 VAL A1889 10.273 6.411 13.291 1.00 1.98 C ATOM 73 CG2 VAL A1889 11.012 4.372 12.002 1.00 2.12 C ATOM 0 H VAL A1889 8.089 7.604 11.498 1.00 0.91 H new ATOM 0 HA VAL A1889 9.246 5.261 10.172 1.00 1.02 H new ATOM 0 HB VAL A1889 11.125 6.388 11.352 1.00 1.34 H new ATOM 0 HG11 VAL A1889 11.228 6.363 13.815 1.00 1.98 H new ATOM 0 HG12 VAL A1889 9.970 7.453 13.183 1.00 1.98 H new ATOM 0 HG13 VAL A1889 9.518 5.871 13.862 1.00 1.98 H new ATOM 0 HG21 VAL A1889 11.938 4.405 12.575 1.00 2.12 H new ATOM 0 HG22 VAL A1889 10.303 3.707 12.496 1.00 2.12 H new ATOM 0 HG23 VAL A1889 11.219 4.000 10.998 1.00 2.12 H new ATOM 83 N GLN A1890 7.899 3.869 11.802 1.00 1.17 N ATOM 84 CA GLN A1890 6.900 3.083 12.475 1.00 1.48 C ATOM 85 C GLN A1890 7.580 2.052 13.350 1.00 1.69 C ATOM 86 O GLN A1890 8.807 2.094 13.508 1.00 2.49 O ATOM 87 CB GLN A1890 6.024 2.391 11.442 1.00 1.71 C ATOM 88 CG GLN A1890 5.115 3.333 10.690 1.00 1.52 C ATOM 89 CD GLN A1890 4.044 3.961 11.559 1.00 2.03 C ATOM 90 OE1 GLN A1890 4.236 5.020 12.139 1.00 2.63 O ATOM 91 NE2 GLN A1890 2.909 3.341 11.624 1.00 2.40 N ATOM 0 H GLN A1890 8.569 3.311 11.273 1.00 1.17 H new ATOM 0 HA GLN A1890 6.279 3.728 13.097 1.00 1.48 H new ATOM 0 HB2 GLN A1890 6.662 1.869 10.729 1.00 1.71 H new ATOM 0 HB3 GLN A1890 5.417 1.635 11.941 1.00 1.71 H new ATOM 0 HG2 GLN A1890 5.716 4.123 10.240 1.00 1.52 H new ATOM 0 HG3 GLN A1890 4.638 2.791 9.874 1.00 1.52 H new ATOM 0 HE21 GLN A1890 2.781 2.459 11.128 1.00 2.40 H new ATOM 0 HE22 GLN A1890 2.143 3.735 12.171 1.00 2.40 H new ATOM 100 N ASN A1891 6.791 1.142 13.912 1.00 1.59 N ATOM 101 CA ASN A1891 7.293 0.015 14.714 1.00 1.88 C ATOM 102 C ASN A1891 8.285 -0.789 13.903 1.00 1.48 C ATOM 103 O ASN A1891 9.372 -1.146 14.369 1.00 1.86 O ATOM 104 CB ASN A1891 6.123 -0.888 15.139 1.00 2.50 C ATOM 105 CG ASN A1891 6.561 -2.151 15.868 1.00 3.17 C ATOM 106 OD1 ASN A1891 6.736 -2.154 17.094 1.00 3.82 O ATOM 107 ND2 ASN A1891 6.696 -3.240 15.140 1.00 3.53 N ATOM 0 H ASN A1891 5.775 1.160 13.827 1.00 1.59 H new ATOM 0 HA ASN A1891 7.786 0.405 15.604 1.00 1.88 H new ATOM 0 HB2 ASN A1891 5.453 -0.320 15.784 1.00 2.50 H new ATOM 0 HB3 ASN A1891 5.552 -1.169 14.254 1.00 2.50 H new ATOM 0 HD21 ASN A1891 6.952 -4.122 15.584 1.00 3.53 H new ATOM 0 HD22 ASN A1891 6.544 -3.202 14.132 1.00 3.53 H new ATOM 114 N ASP A1892 7.908 -1.061 12.693 1.00 1.00 N ATOM 115 CA ASP A1892 8.758 -1.751 11.779 1.00 1.01 C ATOM 116 C ASP A1892 8.896 -0.969 10.488 1.00 1.00 C ATOM 117 O ASP A1892 9.733 -0.068 10.415 1.00 1.59 O ATOM 118 CB ASP A1892 8.358 -3.241 11.574 1.00 1.40 C ATOM 119 CG ASP A1892 6.882 -3.467 11.290 1.00 2.05 C ATOM 120 OD1 ASP A1892 6.457 -3.304 10.107 1.00 2.66 O ATOM 121 OD2 ASP A1892 6.134 -3.798 12.221 1.00 2.61 O ATOM 0 H ASP A1892 6.997 -0.809 12.311 1.00 1.00 H new ATOM 0 HA ASP A1892 9.751 -1.806 12.225 1.00 1.01 H new ATOM 0 HB2 ASP A1892 8.940 -3.649 10.748 1.00 1.40 H new ATOM 0 HB3 ASP A1892 8.633 -3.803 12.466 1.00 1.40 H new ATOM 126 N CYS A1893 8.048 -1.264 9.498 1.00 0.74 N ATOM 127 CA CYS A1893 8.039 -0.591 8.179 1.00 0.87 C ATOM 128 C CYS A1893 9.349 -0.858 7.416 1.00 0.75 C ATOM 129 O CYS A1893 9.657 -0.232 6.390 1.00 0.80 O ATOM 130 CB CYS A1893 7.755 0.919 8.326 1.00 1.17 C ATOM 131 SG CYS A1893 7.350 1.783 6.769 1.00 1.58 S ATOM 0 H CYS A1893 7.334 -1.987 9.584 1.00 0.74 H new ATOM 0 HA CYS A1893 7.227 -1.014 7.587 1.00 0.87 H new ATOM 0 HB2 CYS A1893 6.928 1.052 9.023 1.00 1.17 H new ATOM 0 HB3 CYS A1893 8.628 1.396 8.772 1.00 1.17 H new ATOM 136 N ARG A1894 10.081 -1.828 7.899 1.00 0.73 N ATOM 137 CA ARG A1894 11.321 -2.210 7.329 1.00 0.73 C ATOM 138 C ARG A1894 11.529 -3.688 7.517 1.00 0.72 C ATOM 139 O ARG A1894 11.499 -4.200 8.642 1.00 0.92 O ATOM 140 CB ARG A1894 12.502 -1.402 7.913 1.00 0.85 C ATOM 141 CG ARG A1894 12.665 -1.481 9.426 1.00 1.21 C ATOM 142 CD ARG A1894 13.903 -0.732 9.893 1.00 1.35 C ATOM 143 NE ARG A1894 13.893 0.665 9.461 1.00 1.45 N ATOM 144 CZ ARG A1894 14.512 1.682 10.056 1.00 1.80 C ATOM 145 NH1 ARG A1894 15.152 1.515 11.218 1.00 2.09 N ATOM 146 NH2 ARG A1894 14.473 2.867 9.482 1.00 2.57 N ATOM 0 H ARG A1894 9.816 -2.378 8.716 1.00 0.73 H new ATOM 0 HA ARG A1894 11.289 -1.986 6.263 1.00 0.73 H new ATOM 0 HB2 ARG A1894 13.424 -1.750 7.447 1.00 0.85 H new ATOM 0 HB3 ARG A1894 12.378 -0.356 7.632 1.00 0.85 H new ATOM 0 HG2 ARG A1894 11.782 -1.064 9.910 1.00 1.21 H new ATOM 0 HG3 ARG A1894 12.733 -2.525 9.732 1.00 1.21 H new ATOM 0 HD2 ARG A1894 13.964 -0.775 10.980 1.00 1.35 H new ATOM 0 HD3 ARG A1894 14.794 -1.225 9.504 1.00 1.35 H new ATOM 0 HE ARG A1894 13.358 0.882 8.620 1.00 1.45 H new ATOM 0 HH11 ARG A1894 15.171 0.597 11.662 1.00 2.09 H new ATOM 0 HH12 ARG A1894 15.621 2.306 11.660 1.00 2.09 H new ATOM 0 HH21 ARG A1894 13.976 2.990 8.600 1.00 2.57 H new ATOM 0 HH22 ARG A1894 14.940 3.661 9.920 1.00 2.57 H new ATOM 160 N VAL A1895 11.707 -4.377 6.444 1.00 0.58 N ATOM 161 CA VAL A1895 11.933 -5.785 6.509 1.00 0.60 C ATOM 162 C VAL A1895 13.265 -6.104 5.877 1.00 0.52 C ATOM 163 O VAL A1895 13.602 -5.590 4.795 1.00 0.47 O ATOM 164 CB VAL A1895 10.770 -6.629 5.877 1.00 0.63 C ATOM 165 CG1 VAL A1895 10.591 -6.347 4.397 1.00 0.57 C ATOM 166 CG2 VAL A1895 10.967 -8.120 6.122 1.00 0.72 C ATOM 0 H VAL A1895 11.701 -3.987 5.501 1.00 0.58 H new ATOM 0 HA VAL A1895 11.953 -6.073 7.560 1.00 0.60 H new ATOM 0 HB VAL A1895 9.854 -6.318 6.379 1.00 0.63 H new ATOM 0 HG11 VAL A1895 9.775 -6.955 4.007 1.00 0.57 H new ATOM 0 HG12 VAL A1895 10.358 -5.292 4.253 1.00 0.57 H new ATOM 0 HG13 VAL A1895 11.511 -6.591 3.866 1.00 0.57 H new ATOM 0 HG21 VAL A1895 10.144 -8.675 5.671 1.00 0.72 H new ATOM 0 HG22 VAL A1895 11.908 -8.441 5.676 1.00 0.72 H new ATOM 0 HG23 VAL A1895 10.990 -8.313 7.195 1.00 0.72 H new ATOM 176 N THR A1896 14.041 -6.855 6.576 1.00 0.63 N ATOM 177 CA THR A1896 15.306 -7.268 6.091 1.00 0.69 C ATOM 178 C THR A1896 15.107 -8.618 5.432 1.00 0.69 C ATOM 179 O THR A1896 14.613 -9.551 6.070 1.00 0.76 O ATOM 180 CB THR A1896 16.308 -7.403 7.260 1.00 0.89 C ATOM 181 OG1 THR A1896 16.265 -6.213 8.073 1.00 0.98 O ATOM 182 CG2 THR A1896 17.724 -7.591 6.737 1.00 1.02 C ATOM 0 H THR A1896 13.812 -7.202 7.508 1.00 0.63 H new ATOM 0 HA THR A1896 15.705 -6.539 5.386 1.00 0.69 H new ATOM 0 HB THR A1896 16.029 -8.274 7.852 1.00 0.89 H new ATOM 0 HG1 THR A1896 16.899 -6.301 8.815 1.00 0.98 H new ATOM 0 HG21 THR A1896 18.413 -7.684 7.577 1.00 1.02 H new ATOM 0 HG22 THR A1896 17.770 -8.494 6.128 1.00 1.02 H new ATOM 0 HG23 THR A1896 18.005 -6.730 6.131 1.00 1.02 H new ATOM 190 N ASN A1897 15.408 -8.718 4.163 1.00 0.75 N ATOM 191 CA ASN A1897 15.270 -9.992 3.490 1.00 0.88 C ATOM 192 C ASN A1897 16.591 -10.705 3.537 1.00 1.04 C ATOM 193 O ASN A1897 17.547 -10.240 2.933 1.00 1.06 O ATOM 194 CB ASN A1897 14.801 -9.839 2.033 1.00 0.95 C ATOM 195 CG ASN A1897 14.626 -11.194 1.331 1.00 1.17 C ATOM 196 OD1 ASN A1897 14.337 -12.208 1.962 1.00 1.65 O ATOM 197 ND2 ASN A1897 14.802 -11.226 0.045 1.00 1.21 N ATOM 0 H ASN A1897 15.744 -7.951 3.580 1.00 0.75 H new ATOM 0 HA ASN A1897 14.503 -10.570 4.006 1.00 0.88 H new ATOM 0 HB2 ASN A1897 13.855 -9.297 2.013 1.00 0.95 H new ATOM 0 HB3 ASN A1897 15.524 -9.238 1.482 1.00 0.95 H new ATOM 0 HD21 ASN A1897 14.701 -12.105 -0.462 1.00 1.21 H new ATOM 0 HD22 ASN A1897 15.041 -10.372 -0.458 1.00 1.21 H new ATOM 204 N PRO A1898 16.675 -11.826 4.268 1.00 1.26 N ATOM 205 CA PRO A1898 17.917 -12.595 4.418 1.00 1.47 C ATOM 206 C PRO A1898 18.481 -13.076 3.081 1.00 1.54 C ATOM 207 O PRO A1898 19.694 -13.149 2.903 1.00 1.71 O ATOM 208 CB PRO A1898 17.510 -13.791 5.292 1.00 1.73 C ATOM 209 CG PRO A1898 16.024 -13.838 5.228 1.00 1.69 C ATOM 210 CD PRO A1898 15.571 -12.431 5.038 1.00 1.40 C ATOM 0 HA PRO A1898 18.710 -11.987 4.854 1.00 1.47 H new ATOM 0 HB2 PRO A1898 17.949 -14.717 4.920 1.00 1.73 H new ATOM 0 HB3 PRO A1898 17.855 -13.664 6.318 1.00 1.73 H new ATOM 0 HG2 PRO A1898 15.690 -14.469 4.405 1.00 1.69 H new ATOM 0 HG3 PRO A1898 15.608 -14.261 6.143 1.00 1.69 H new ATOM 0 HD2 PRO A1898 14.627 -12.381 4.496 1.00 1.40 H new ATOM 0 HD3 PRO A1898 15.419 -11.924 5.991 1.00 1.40 H new ATOM 218 N ALA A1899 17.600 -13.357 2.141 1.00 1.48 N ATOM 219 CA ALA A1899 18.004 -13.837 0.835 1.00 1.62 C ATOM 220 C ALA A1899 18.724 -12.746 0.043 1.00 1.54 C ATOM 221 O ALA A1899 19.785 -12.981 -0.545 1.00 1.69 O ATOM 222 CB ALA A1899 16.804 -14.348 0.073 1.00 1.72 C ATOM 0 H ALA A1899 16.592 -13.260 2.260 1.00 1.48 H new ATOM 0 HA ALA A1899 18.705 -14.660 0.976 1.00 1.62 H new ATOM 0 HB1 ALA A1899 17.121 -14.706 -0.907 1.00 1.72 H new ATOM 0 HB2 ALA A1899 16.343 -15.166 0.627 1.00 1.72 H new ATOM 0 HB3 ALA A1899 16.082 -13.541 -0.051 1.00 1.72 H new ATOM 228 N THR A1900 18.159 -11.559 0.039 1.00 1.37 N ATOM 229 CA THR A1900 18.754 -10.451 -0.669 1.00 1.38 C ATOM 230 C THR A1900 19.905 -9.836 0.149 1.00 1.36 C ATOM 231 O THR A1900 20.955 -9.491 -0.389 1.00 1.53 O ATOM 232 CB THR A1900 17.694 -9.364 -0.961 1.00 1.31 C ATOM 233 OG1 THR A1900 16.553 -9.973 -1.554 1.00 1.45 O ATOM 234 CG2 THR A1900 18.243 -8.332 -1.920 1.00 1.46 C ATOM 0 H THR A1900 17.287 -11.338 0.519 1.00 1.37 H new ATOM 0 HA THR A1900 19.151 -10.830 -1.611 1.00 1.38 H new ATOM 0 HB THR A1900 17.426 -8.876 -0.024 1.00 1.31 H new ATOM 0 HG1 THR A1900 16.772 -10.261 -2.465 1.00 1.45 H new ATOM 0 HG21 THR A1900 17.483 -7.575 -2.114 1.00 1.46 H new ATOM 0 HG22 THR A1900 19.122 -7.860 -1.482 1.00 1.46 H new ATOM 0 HG23 THR A1900 18.520 -8.816 -2.856 1.00 1.46 H new ATOM 242 N GLY A1901 19.693 -9.701 1.443 1.00 1.23 N ATOM 243 CA GLY A1901 20.667 -9.082 2.311 1.00 1.29 C ATOM 244 C GLY A1901 20.306 -7.636 2.569 1.00 1.27 C ATOM 245 O GLY A1901 20.710 -7.048 3.567 1.00 1.46 O ATOM 0 H GLY A1901 18.846 -10.016 1.917 1.00 1.23 H new ATOM 0 HA2 GLY A1901 20.717 -9.624 3.255 1.00 1.29 H new ATOM 0 HA3 GLY A1901 21.656 -9.140 1.857 1.00 1.29 H new ATOM 249 N HIS A1902 19.494 -7.097 1.688 1.00 1.12 N ATOM 250 CA HIS A1902 19.083 -5.701 1.732 1.00 1.15 C ATOM 251 C HIS A1902 17.865 -5.488 2.610 1.00 0.91 C ATOM 252 O HIS A1902 17.120 -6.440 2.933 1.00 0.84 O ATOM 253 CB HIS A1902 18.806 -5.145 0.334 1.00 1.34 C ATOM 254 CG HIS A1902 20.018 -4.900 -0.522 1.00 2.00 C ATOM 255 ND1 HIS A1902 20.342 -3.658 -1.000 1.00 2.46 N ATOM 256 CD2 HIS A1902 20.924 -5.750 -1.064 1.00 2.87 C ATOM 257 CE1 HIS A1902 21.381 -3.747 -1.791 1.00 3.18 C ATOM 258 NE2 HIS A1902 21.760 -5.003 -1.854 1.00 3.41 N ATOM 0 H HIS A1902 19.092 -7.618 0.908 1.00 1.12 H new ATOM 0 HA HIS A1902 19.921 -5.158 2.168 1.00 1.15 H new ATOM 0 HB2 HIS A1902 18.149 -5.839 -0.189 1.00 1.34 H new ATOM 0 HB3 HIS A1902 18.261 -4.207 0.438 1.00 1.34 H new ATOM 0 HD2 HIS A1902 20.978 -6.817 -0.904 1.00 2.87 H new ATOM 0 HE1 HIS A1902 21.850 -2.923 -2.307 1.00 3.18 H new ATOM 0 HE2 HIS A1902 22.544 -5.362 -2.399 1.00 3.41 H new ATOM 267 N LEU A1903 17.683 -4.255 2.983 1.00 0.87 N ATOM 268 CA LEU A1903 16.603 -3.821 3.825 1.00 0.75 C ATOM 269 C LEU A1903 15.619 -2.994 3.012 1.00 0.70 C ATOM 270 O LEU A1903 16.017 -2.073 2.288 1.00 0.88 O ATOM 271 CB LEU A1903 17.166 -2.946 4.958 1.00 0.94 C ATOM 272 CG LEU A1903 16.144 -2.327 5.925 1.00 0.99 C ATOM 273 CD1 LEU A1903 15.461 -3.390 6.750 1.00 1.34 C ATOM 274 CD2 LEU A1903 16.801 -1.296 6.818 1.00 1.48 C ATOM 0 H LEU A1903 18.303 -3.496 2.700 1.00 0.87 H new ATOM 0 HA LEU A1903 16.096 -4.693 4.238 1.00 0.75 H new ATOM 0 HB2 LEU A1903 17.863 -3.549 5.540 1.00 0.94 H new ATOM 0 HB3 LEU A1903 17.743 -2.137 4.509 1.00 0.94 H new ATOM 0 HG LEU A1903 15.383 -1.825 5.327 1.00 0.99 H new ATOM 0 HD11 LEU A1903 14.744 -2.922 7.425 1.00 1.34 H new ATOM 0 HD12 LEU A1903 14.940 -4.084 6.090 1.00 1.34 H new ATOM 0 HD13 LEU A1903 16.206 -3.933 7.332 1.00 1.34 H new ATOM 0 HD21 LEU A1903 16.057 -0.873 7.493 1.00 1.48 H new ATOM 0 HD22 LEU A1903 17.592 -1.770 7.400 1.00 1.48 H new ATOM 0 HD23 LEU A1903 17.228 -0.502 6.205 1.00 1.48 H new ATOM 286 N PHE A1904 14.365 -3.333 3.106 1.00 0.53 N ATOM 287 CA PHE A1904 13.324 -2.531 2.510 1.00 0.51 C ATOM 288 C PHE A1904 12.833 -1.622 3.608 1.00 0.48 C ATOM 289 O PHE A1904 12.310 -2.116 4.600 1.00 0.49 O ATOM 290 CB PHE A1904 12.148 -3.388 2.053 1.00 0.51 C ATOM 291 CG PHE A1904 12.446 -4.463 1.050 1.00 0.58 C ATOM 292 CD1 PHE A1904 12.797 -5.738 1.465 1.00 1.01 C ATOM 293 CD2 PHE A1904 12.337 -4.212 -0.304 1.00 0.71 C ATOM 294 CE1 PHE A1904 13.040 -6.737 0.550 1.00 1.17 C ATOM 295 CE2 PHE A1904 12.573 -5.208 -1.225 1.00 0.79 C ATOM 296 CZ PHE A1904 12.926 -6.473 -0.798 1.00 0.86 C ATOM 0 H PHE A1904 14.033 -4.165 3.593 1.00 0.53 H new ATOM 0 HA PHE A1904 13.712 -1.999 1.641 1.00 0.51 H new ATOM 0 HB2 PHE A1904 11.707 -3.857 2.933 1.00 0.51 H new ATOM 0 HB3 PHE A1904 11.391 -2.728 1.629 1.00 0.51 H new ATOM 0 HD1 PHE A1904 12.881 -5.950 2.521 1.00 1.01 H new ATOM 0 HD2 PHE A1904 12.064 -3.224 -0.644 1.00 0.71 H new ATOM 0 HE1 PHE A1904 13.319 -7.724 0.887 1.00 1.17 H new ATOM 0 HE2 PHE A1904 12.482 -5.000 -2.281 1.00 0.79 H new ATOM 0 HZ PHE A1904 13.113 -7.255 -1.520 1.00 0.86 H new ATOM 306 N ASP A1905 13.005 -0.338 3.462 1.00 0.57 N ATOM 307 CA ASP A1905 12.655 0.605 4.528 1.00 0.61 C ATOM 308 C ASP A1905 11.780 1.714 3.978 1.00 0.55 C ATOM 309 O ASP A1905 12.255 2.582 3.254 1.00 0.71 O ATOM 310 CB ASP A1905 13.941 1.177 5.162 1.00 0.88 C ATOM 311 CG ASP A1905 13.690 2.178 6.267 1.00 1.37 C ATOM 312 OD1 ASP A1905 12.962 1.858 7.247 1.00 1.97 O ATOM 313 OD2 ASP A1905 14.138 3.312 6.156 1.00 1.95 O ATOM 0 H ASP A1905 13.385 0.096 2.621 1.00 0.57 H new ATOM 0 HA ASP A1905 12.092 0.083 5.301 1.00 0.61 H new ATOM 0 HB2 ASP A1905 14.535 0.354 5.560 1.00 0.88 H new ATOM 0 HB3 ASP A1905 14.537 1.653 4.383 1.00 0.88 H new ATOM 318 N LEU A1906 10.506 1.691 4.325 1.00 0.48 N ATOM 319 CA LEU A1906 9.530 2.626 3.757 1.00 0.48 C ATOM 320 C LEU A1906 9.258 3.803 4.684 1.00 0.52 C ATOM 321 O LEU A1906 8.135 4.320 4.755 1.00 0.71 O ATOM 322 CB LEU A1906 8.217 1.912 3.435 1.00 0.50 C ATOM 323 CG LEU A1906 8.267 0.787 2.409 1.00 0.47 C ATOM 324 CD1 LEU A1906 6.868 0.270 2.156 1.00 0.53 C ATOM 325 CD2 LEU A1906 8.901 1.255 1.107 1.00 0.54 C ATOM 0 H LEU A1906 10.114 1.035 5.000 1.00 0.48 H new ATOM 0 HA LEU A1906 9.966 3.015 2.837 1.00 0.48 H new ATOM 0 HB2 LEU A1906 7.818 1.504 4.364 1.00 0.50 H new ATOM 0 HB3 LEU A1906 7.505 2.658 3.083 1.00 0.50 H new ATOM 0 HG LEU A1906 8.885 -0.017 2.808 1.00 0.47 H new ATOM 0 HD11 LEU A1906 6.905 -0.535 1.422 1.00 0.53 H new ATOM 0 HD12 LEU A1906 6.446 -0.107 3.087 1.00 0.53 H new ATOM 0 HD13 LEU A1906 6.244 1.079 1.776 1.00 0.53 H new ATOM 0 HD21 LEU A1906 8.922 0.430 0.395 1.00 0.54 H new ATOM 0 HD22 LEU A1906 8.317 2.077 0.693 1.00 0.54 H new ATOM 0 HD23 LEU A1906 9.919 1.594 1.299 1.00 0.54 H new ATOM 337 N THR A1907 10.284 4.277 5.317 1.00 0.66 N ATOM 338 CA THR A1907 10.191 5.385 6.236 1.00 0.74 C ATOM 339 C THR A1907 9.733 6.689 5.543 1.00 0.69 C ATOM 340 O THR A1907 9.097 7.549 6.153 1.00 0.70 O ATOM 341 CB THR A1907 11.532 5.575 6.912 1.00 1.11 C ATOM 342 OG1 THR A1907 12.568 5.366 5.932 1.00 1.59 O ATOM 343 CG2 THR A1907 11.687 4.609 8.076 1.00 1.13 C ATOM 0 H THR A1907 11.228 3.905 5.214 1.00 0.66 H new ATOM 0 HA THR A1907 9.429 5.151 6.980 1.00 0.74 H new ATOM 0 HB THR A1907 11.605 6.585 7.315 1.00 1.11 H new ATOM 0 HG1 THR A1907 13.081 4.564 6.165 1.00 1.59 H new ATOM 0 HG21 THR A1907 12.657 4.761 8.549 1.00 1.13 H new ATOM 0 HG22 THR A1907 10.896 4.788 8.805 1.00 1.13 H new ATOM 0 HG23 THR A1907 11.619 3.585 7.710 1.00 1.13 H new ATOM 351 N SER A1908 10.082 6.839 4.291 1.00 0.83 N ATOM 352 CA SER A1908 9.622 7.957 3.503 1.00 1.00 C ATOM 353 C SER A1908 8.262 7.694 2.866 1.00 0.94 C ATOM 354 O SER A1908 7.670 8.585 2.261 1.00 1.16 O ATOM 355 CB SER A1908 10.649 8.321 2.445 1.00 1.28 C ATOM 356 OG SER A1908 11.850 8.730 3.060 1.00 1.36 O ATOM 0 H SER A1908 10.691 6.193 3.789 1.00 0.83 H new ATOM 0 HA SER A1908 9.499 8.801 4.181 1.00 1.00 H new ATOM 0 HB2 SER A1908 10.836 7.464 1.798 1.00 1.28 H new ATOM 0 HB3 SER A1908 10.264 9.121 1.812 1.00 1.28 H new ATOM 0 HG SER A1908 12.058 9.650 2.793 1.00 1.36 H new ATOM 362 N LEU A1909 7.764 6.493 3.007 1.00 0.76 N ATOM 363 CA LEU A1909 6.531 6.149 2.440 1.00 0.87 C ATOM 364 C LEU A1909 5.398 6.386 3.396 1.00 0.82 C ATOM 365 O LEU A1909 4.370 6.943 3.000 1.00 1.00 O ATOM 366 CB LEU A1909 6.546 4.712 1.969 1.00 0.89 C ATOM 367 CG LEU A1909 6.879 4.461 0.491 1.00 1.28 C ATOM 368 CD1 LEU A1909 5.907 5.187 -0.422 1.00 2.03 C ATOM 369 CD2 LEU A1909 8.296 4.865 0.175 1.00 1.67 C ATOM 0 H LEU A1909 8.220 5.740 3.523 1.00 0.76 H new ATOM 0 HA LEU A1909 6.370 6.795 1.577 1.00 0.87 H new ATOM 0 HB2 LEU A1909 7.268 4.165 2.575 1.00 0.89 H new ATOM 0 HB3 LEU A1909 5.566 4.280 2.173 1.00 0.89 H new ATOM 0 HG LEU A1909 6.781 3.390 0.313 1.00 1.28 H new ATOM 0 HD11 LEU A1909 6.168 4.990 -1.462 1.00 2.03 H new ATOM 0 HD12 LEU A1909 4.894 4.834 -0.229 1.00 2.03 H new ATOM 0 HD13 LEU A1909 5.960 6.259 -0.231 1.00 2.03 H new ATOM 0 HD21 LEU A1909 8.502 4.675 -0.878 1.00 1.67 H new ATOM 0 HD22 LEU A1909 8.427 5.926 0.385 1.00 1.67 H new ATOM 0 HD23 LEU A1909 8.985 4.286 0.789 1.00 1.67 H new ATOM 381 N LYS A1910 5.550 5.968 4.650 1.00 0.69 N ATOM 382 CA LYS A1910 4.484 6.147 5.588 1.00 0.78 C ATOM 383 C LYS A1910 4.322 7.628 5.871 1.00 0.81 C ATOM 384 O LYS A1910 5.305 8.358 6.070 1.00 0.92 O ATOM 385 CB LYS A1910 4.716 5.372 6.899 1.00 0.85 C ATOM 386 CG LYS A1910 5.880 5.895 7.727 1.00 1.10 C ATOM 387 CD LYS A1910 5.450 6.192 9.165 1.00 1.40 C ATOM 388 CE LYS A1910 4.278 7.175 9.244 1.00 2.20 C ATOM 389 NZ LYS A1910 3.753 7.333 10.624 1.00 2.72 N ATOM 0 H LYS A1910 6.386 5.515 5.019 1.00 0.69 H new ATOM 0 HA LYS A1910 3.573 5.744 5.146 1.00 0.78 H new ATOM 0 HB2 LYS A1910 3.808 5.414 7.500 1.00 0.85 H new ATOM 0 HB3 LYS A1910 4.894 4.323 6.663 1.00 0.85 H new ATOM 0 HG2 LYS A1910 6.686 5.161 7.730 1.00 1.10 H new ATOM 0 HG3 LYS A1910 6.277 6.801 7.269 1.00 1.10 H new ATOM 0 HD2 LYS A1910 5.170 5.260 9.655 1.00 1.40 H new ATOM 0 HD3 LYS A1910 6.298 6.600 9.716 1.00 1.40 H new ATOM 0 HE2 LYS A1910 4.599 8.147 8.868 1.00 2.20 H new ATOM 0 HE3 LYS A1910 3.476 6.830 8.592 1.00 2.20 H new ATOM 0 HZ1 LYS A1910 3.366 8.291 10.741 1.00 2.72 H new ATOM 0 HZ2 LYS A1910 3.002 6.633 10.792 1.00 2.72 H new ATOM 0 HZ3 LYS A1910 4.523 7.185 11.307 1.00 2.72 H new ATOM 403 N ARG A1911 3.124 8.063 5.881 1.00 0.82 N ATOM 404 CA ARG A1911 2.839 9.438 6.109 1.00 0.91 C ATOM 405 C ARG A1911 1.691 9.528 7.070 1.00 0.98 C ATOM 406 O ARG A1911 1.050 8.503 7.353 1.00 1.03 O ATOM 407 CB ARG A1911 2.607 10.146 4.771 1.00 0.99 C ATOM 408 CG ARG A1911 1.528 9.533 3.902 1.00 1.05 C ATOM 409 CD ARG A1911 1.813 9.780 2.425 1.00 1.26 C ATOM 410 NE ARG A1911 2.044 11.192 2.116 1.00 1.50 N ATOM 411 CZ ARG A1911 2.621 11.656 1.000 1.00 1.86 C ATOM 412 NH1 ARG A1911 2.997 10.815 0.032 1.00 1.90 N ATOM 413 NH2 ARG A1911 2.819 12.959 0.867 1.00 2.60 N ATOM 0 H ARG A1911 2.302 7.478 5.731 1.00 0.82 H new ATOM 0 HA ARG A1911 3.679 9.958 6.570 1.00 0.91 H new ATOM 0 HB2 ARG A1911 2.347 11.186 4.968 1.00 0.99 H new ATOM 0 HB3 ARG A1911 3.543 10.151 4.213 1.00 0.99 H new ATOM 0 HG2 ARG A1911 1.469 8.461 4.091 1.00 1.05 H new ATOM 0 HG3 ARG A1911 0.559 9.957 4.165 1.00 1.05 H new ATOM 0 HD2 ARG A1911 2.687 9.201 2.127 1.00 1.26 H new ATOM 0 HD3 ARG A1911 0.973 9.417 1.833 1.00 1.26 H new ATOM 0 HE ARG A1911 1.741 11.878 2.807 1.00 1.50 H new ATOM 0 HH11 ARG A1911 2.845 9.812 0.140 1.00 1.90 H new ATOM 0 HH12 ARG A1911 3.436 11.176 -0.815 1.00 1.90 H new ATOM 0 HH21 ARG A1911 2.533 13.597 1.610 1.00 2.60 H new ATOM 0 HH22 ARG A1911 3.258 13.325 0.022 1.00 2.60 H new ATOM 427 N GLU A1912 1.444 10.689 7.607 1.00 1.18 N ATOM 428 CA GLU A1912 0.444 10.832 8.644 1.00 1.43 C ATOM 429 C GLU A1912 -0.970 10.804 8.095 1.00 1.27 C ATOM 430 O GLU A1912 -1.886 10.322 8.757 1.00 1.48 O ATOM 431 CB GLU A1912 0.714 12.068 9.500 1.00 1.83 C ATOM 432 CG GLU A1912 2.090 12.043 10.168 1.00 2.47 C ATOM 433 CD GLU A1912 2.308 10.792 10.993 1.00 2.80 C ATOM 434 OE1 GLU A1912 1.903 10.751 12.174 1.00 3.25 O ATOM 435 OE2 GLU A1912 2.926 9.832 10.490 1.00 3.16 O ATOM 0 H GLU A1912 1.918 11.555 7.349 1.00 1.18 H new ATOM 0 HA GLU A1912 0.525 9.962 9.295 1.00 1.43 H new ATOM 0 HB2 GLU A1912 0.635 12.959 8.877 1.00 1.83 H new ATOM 0 HB3 GLU A1912 -0.055 12.146 10.268 1.00 1.83 H new ATOM 0 HG2 GLU A1912 2.864 12.110 9.403 1.00 2.47 H new ATOM 0 HG3 GLU A1912 2.197 12.920 10.807 1.00 2.47 H new ATOM 442 N SER A1913 -1.130 11.281 6.892 1.00 1.09 N ATOM 443 CA SER A1913 -2.405 11.273 6.246 1.00 1.05 C ATOM 444 C SER A1913 -2.608 9.967 5.463 1.00 0.93 C ATOM 445 O SER A1913 -3.306 9.051 5.917 1.00 1.08 O ATOM 446 CB SER A1913 -2.492 12.497 5.339 1.00 1.25 C ATOM 447 OG SER A1913 -1.286 12.628 4.578 1.00 1.86 O ATOM 0 H SER A1913 -0.378 11.686 6.335 1.00 1.09 H new ATOM 0 HA SER A1913 -3.203 11.321 6.987 1.00 1.05 H new ATOM 0 HB2 SER A1913 -3.347 12.404 4.669 1.00 1.25 H new ATOM 0 HB3 SER A1913 -2.653 13.393 5.938 1.00 1.25 H new ATOM 0 HG SER A1913 -1.350 13.415 3.997 1.00 1.86 H new ATOM 453 N GLY A1914 -1.965 9.880 4.328 1.00 0.88 N ATOM 454 CA GLY A1914 -2.063 8.740 3.475 1.00 0.88 C ATOM 455 C GLY A1914 -1.769 9.147 2.062 1.00 0.86 C ATOM 456 O GLY A1914 -1.376 10.296 1.819 1.00 1.14 O ATOM 0 H GLY A1914 -1.352 10.613 3.971 1.00 0.88 H new ATOM 0 HA2 GLY A1914 -1.361 7.970 3.797 1.00 0.88 H new ATOM 0 HA3 GLY A1914 -3.062 8.308 3.540 1.00 0.88 H new ATOM 460 N TYR A1915 -1.947 8.257 1.148 1.00 0.70 N ATOM 461 CA TYR A1915 -1.717 8.512 -0.243 1.00 0.82 C ATOM 462 C TYR A1915 -3.053 8.702 -0.889 1.00 0.65 C ATOM 463 O TYR A1915 -4.028 7.970 -0.567 1.00 0.66 O ATOM 464 CB TYR A1915 -1.050 7.332 -0.942 1.00 1.06 C ATOM 465 CG TYR A1915 0.135 6.733 -0.248 1.00 1.50 C ATOM 466 CD1 TYR A1915 1.404 7.268 -0.369 1.00 1.97 C ATOM 467 CD2 TYR A1915 -0.024 5.603 0.514 1.00 2.32 C ATOM 468 CE1 TYR A1915 2.472 6.670 0.265 1.00 2.95 C ATOM 469 CE2 TYR A1915 1.016 5.011 1.134 1.00 3.26 C ATOM 470 CZ TYR A1915 2.255 5.532 1.017 1.00 3.50 C ATOM 471 OH TYR A1915 3.283 4.924 1.649 1.00 4.60 O ATOM 0 H TYR A1915 -2.264 7.308 1.345 1.00 0.70 H new ATOM 0 HA TYR A1915 -1.067 9.383 -0.328 1.00 0.82 H new ATOM 0 HB2 TYR A1915 -1.797 6.550 -1.081 1.00 1.06 H new ATOM 0 HB3 TYR A1915 -0.738 7.655 -1.935 1.00 1.06 H new ATOM 0 HD1 TYR A1915 1.559 8.157 -0.962 1.00 1.97 H new ATOM 0 HD2 TYR A1915 -1.010 5.176 0.620 1.00 2.32 H new ATOM 0 HE1 TYR A1915 3.465 7.086 0.175 1.00 2.95 H new ATOM 0 HE2 TYR A1915 0.858 4.120 1.724 1.00 3.26 H new ATOM 0 HH TYR A1915 3.184 5.036 2.617 1.00 4.60 H new ATOM 481 N THR A1916 -3.108 9.618 -1.789 1.00 0.65 N ATOM 482 CA THR A1916 -4.308 9.913 -2.470 1.00 0.60 C ATOM 483 C THR A1916 -4.186 9.526 -3.920 1.00 0.60 C ATOM 484 O THR A1916 -3.297 9.989 -4.671 1.00 0.76 O ATOM 485 CB THR A1916 -4.736 11.398 -2.269 1.00 0.79 C ATOM 486 OG1 THR A1916 -5.959 11.694 -2.977 1.00 1.21 O ATOM 487 CG2 THR A1916 -3.628 12.356 -2.706 1.00 1.26 C ATOM 0 H THR A1916 -2.311 10.187 -2.073 1.00 0.65 H new ATOM 0 HA THR A1916 -5.113 9.317 -2.040 1.00 0.60 H new ATOM 0 HB THR A1916 -4.915 11.541 -1.203 1.00 0.79 H new ATOM 0 HG1 THR A1916 -6.203 12.632 -2.831 1.00 1.21 H new ATOM 0 HG21 THR A1916 -3.955 13.385 -2.554 1.00 1.26 H new ATOM 0 HG22 THR A1916 -2.732 12.169 -2.115 1.00 1.26 H new ATOM 0 HG23 THR A1916 -3.406 12.198 -3.761 1.00 1.26 H new ATOM 495 N ILE A1917 -5.016 8.621 -4.287 1.00 0.52 N ATOM 496 CA ILE A1917 -5.087 8.138 -5.608 1.00 0.56 C ATOM 497 C ILE A1917 -6.544 8.014 -6.003 1.00 0.57 C ATOM 498 O ILE A1917 -7.449 8.283 -5.201 1.00 0.59 O ATOM 499 CB ILE A1917 -4.372 6.771 -5.787 1.00 0.59 C ATOM 500 CG1 ILE A1917 -3.859 6.185 -4.448 1.00 0.69 C ATOM 501 CG2 ILE A1917 -3.239 6.886 -6.806 1.00 0.74 C ATOM 502 CD1 ILE A1917 -3.222 4.814 -4.575 1.00 0.74 C ATOM 0 H ILE A1917 -5.685 8.184 -3.653 1.00 0.52 H new ATOM 0 HA ILE A1917 -4.569 8.848 -6.253 1.00 0.56 H new ATOM 0 HB ILE A1917 -5.115 6.070 -6.167 1.00 0.59 H new ATOM 0 HG12 ILE A1917 -3.132 6.873 -4.018 1.00 0.69 H new ATOM 0 HG13 ILE A1917 -4.692 6.123 -3.748 1.00 0.69 H new ATOM 0 HG21 ILE A1917 -2.750 5.918 -6.917 1.00 0.74 H new ATOM 0 HG22 ILE A1917 -3.645 7.200 -7.767 1.00 0.74 H new ATOM 0 HG23 ILE A1917 -2.512 7.622 -6.461 1.00 0.74 H new ATOM 0 HD11 ILE A1917 -2.890 4.475 -3.594 1.00 0.74 H new ATOM 0 HD12 ILE A1917 -3.952 4.109 -4.974 1.00 0.74 H new ATOM 0 HD13 ILE A1917 -2.367 4.871 -5.248 1.00 0.74 H new ATOM 514 N THR A1918 -6.783 7.636 -7.200 1.00 0.65 N ATOM 515 CA THR A1918 -8.111 7.508 -7.682 1.00 0.72 C ATOM 516 C THR A1918 -8.319 6.083 -8.162 1.00 0.68 C ATOM 517 O THR A1918 -7.365 5.416 -8.558 1.00 0.76 O ATOM 518 CB THR A1918 -8.338 8.507 -8.843 1.00 0.94 C ATOM 519 OG1 THR A1918 -7.835 9.795 -8.440 1.00 1.07 O ATOM 520 CG2 THR A1918 -9.819 8.651 -9.164 1.00 1.06 C ATOM 0 H THR A1918 -6.060 7.404 -7.882 1.00 0.65 H new ATOM 0 HA THR A1918 -8.824 7.730 -6.888 1.00 0.72 H new ATOM 0 HB THR A1918 -7.822 8.135 -9.728 1.00 0.94 H new ATOM 0 HG1 THR A1918 -8.351 10.501 -8.883 1.00 1.07 H new ATOM 0 HG21 THR A1918 -9.947 9.359 -9.983 1.00 1.06 H new ATOM 0 HG22 THR A1918 -10.224 7.682 -9.455 1.00 1.06 H new ATOM 0 HG23 THR A1918 -10.348 9.016 -8.284 1.00 1.06 H new ATOM 528 N ASP A1919 -9.534 5.624 -8.073 1.00 0.69 N ATOM 529 CA ASP A1919 -9.917 4.325 -8.563 1.00 0.74 C ATOM 530 C ASP A1919 -10.291 4.494 -10.061 1.00 0.99 C ATOM 531 O ASP A1919 -10.016 5.557 -10.624 1.00 1.30 O ATOM 532 CB ASP A1919 -11.073 3.774 -7.663 1.00 0.76 C ATOM 533 CG ASP A1919 -11.715 2.482 -8.151 1.00 0.99 C ATOM 534 OD1 ASP A1919 -11.050 1.447 -8.236 1.00 1.28 O ATOM 535 OD2 ASP A1919 -12.896 2.523 -8.532 1.00 1.62 O ATOM 0 H ASP A1919 -10.301 6.148 -7.652 1.00 0.69 H new ATOM 0 HA ASP A1919 -9.117 3.586 -8.508 1.00 0.74 H new ATOM 0 HB2 ASP A1919 -10.683 3.610 -6.658 1.00 0.76 H new ATOM 0 HB3 ASP A1919 -11.846 4.538 -7.584 1.00 0.76 H new ATOM 540 N SER A1920 -10.902 3.491 -10.664 1.00 1.06 N ATOM 541 CA SER A1920 -11.241 3.407 -12.084 1.00 1.32 C ATOM 542 C SER A1920 -11.623 4.767 -12.766 1.00 1.30 C ATOM 543 O SER A1920 -10.989 5.152 -13.754 1.00 1.75 O ATOM 544 CB SER A1920 -12.376 2.389 -12.189 1.00 1.64 C ATOM 545 OG SER A1920 -11.963 1.146 -11.618 1.00 2.13 O ATOM 0 H SER A1920 -11.195 2.660 -10.150 1.00 1.06 H new ATOM 0 HA SER A1920 -10.351 3.102 -12.635 1.00 1.32 H new ATOM 0 HB2 SER A1920 -13.260 2.762 -11.672 1.00 1.64 H new ATOM 0 HB3 SER A1920 -12.654 2.246 -13.233 1.00 1.64 H new ATOM 0 HG SER A1920 -12.694 0.496 -11.685 1.00 2.13 H new ATOM 551 N HIS A1921 -12.586 5.514 -12.201 1.00 1.22 N ATOM 552 CA HIS A1921 -12.983 6.844 -12.763 1.00 1.77 C ATOM 553 C HIS A1921 -14.030 7.519 -11.918 1.00 1.73 C ATOM 554 O HIS A1921 -14.652 8.487 -12.340 1.00 2.31 O ATOM 555 CB HIS A1921 -13.471 6.760 -14.245 1.00 2.44 C ATOM 556 CG HIS A1921 -14.730 5.964 -14.479 1.00 3.25 C ATOM 557 ND1 HIS A1921 -15.937 6.544 -14.788 1.00 4.13 N ATOM 558 CD2 HIS A1921 -14.951 4.633 -14.477 1.00 3.75 C ATOM 559 CE1 HIS A1921 -16.843 5.607 -14.962 1.00 4.85 C ATOM 560 NE2 HIS A1921 -16.269 4.442 -14.779 1.00 4.66 N ATOM 0 H HIS A1921 -13.105 5.237 -11.368 1.00 1.22 H new ATOM 0 HA HIS A1921 -12.075 7.447 -12.749 1.00 1.77 H new ATOM 0 HB2 HIS A1921 -13.631 7.774 -14.613 1.00 2.44 H new ATOM 0 HB3 HIS A1921 -12.672 6.326 -14.846 1.00 2.44 H new ATOM 0 HD2 HIS A1921 -14.222 3.863 -14.274 1.00 3.75 H new ATOM 0 HE1 HIS A1921 -17.881 5.769 -15.212 1.00 4.85 H new ATOM 0 HE2 HIS A1921 -16.733 3.537 -14.851 1.00 4.66 H new ATOM 569 N ASN A1922 -14.210 7.045 -10.733 1.00 1.59 N ATOM 570 CA ASN A1922 -15.232 7.581 -9.889 1.00 1.80 C ATOM 571 C ASN A1922 -14.789 7.535 -8.471 1.00 1.38 C ATOM 572 O ASN A1922 -14.617 8.574 -7.821 1.00 1.72 O ATOM 573 CB ASN A1922 -16.499 6.765 -10.060 1.00 2.28 C ATOM 574 CG ASN A1922 -17.674 7.369 -9.353 1.00 3.05 C ATOM 575 OD1 ASN A1922 -17.987 7.019 -8.220 1.00 3.29 O ATOM 576 ND2 ASN A1922 -18.299 8.291 -10.002 1.00 3.89 N ATOM 0 H ASN A1922 -13.665 6.287 -10.323 1.00 1.59 H new ATOM 0 HA ASN A1922 -15.427 8.617 -10.165 1.00 1.80 H new ATOM 0 HB2 ASN A1922 -16.727 6.673 -11.122 1.00 2.28 H new ATOM 0 HB3 ASN A1922 -16.331 5.757 -9.682 1.00 2.28 H new ATOM 0 HD21 ASN A1922 -19.094 8.766 -9.575 1.00 3.89 H new ATOM 0 HD22 ASN A1922 -17.999 8.545 -10.943 1.00 3.89 H new ATOM 583 N ARG A1923 -14.547 6.332 -8.013 1.00 0.98 N ATOM 584 CA ARG A1923 -14.133 6.105 -6.648 1.00 0.97 C ATOM 585 C ARG A1923 -12.737 6.663 -6.418 1.00 0.83 C ATOM 586 O ARG A1923 -11.944 6.798 -7.353 1.00 0.99 O ATOM 587 CB ARG A1923 -14.157 4.604 -6.263 1.00 1.46 C ATOM 588 CG ARG A1923 -15.534 3.939 -6.182 1.00 1.89 C ATOM 589 CD ARG A1923 -16.182 3.661 -7.527 1.00 2.66 C ATOM 590 NE ARG A1923 -15.519 2.548 -8.223 1.00 2.93 N ATOM 591 CZ ARG A1923 -16.140 1.623 -8.967 1.00 3.73 C ATOM 592 NH1 ARG A1923 -17.422 1.765 -9.289 1.00 4.35 N ATOM 593 NH2 ARG A1923 -15.457 0.588 -9.436 1.00 4.26 N ATOM 0 H ARG A1923 -14.631 5.484 -8.573 1.00 0.98 H new ATOM 0 HA ARG A1923 -14.851 6.623 -6.012 1.00 0.97 H new ATOM 0 HB2 ARG A1923 -13.556 4.056 -6.989 1.00 1.46 H new ATOM 0 HB3 ARG A1923 -13.667 4.493 -5.296 1.00 1.46 H new ATOM 0 HG2 ARG A1923 -15.438 2.999 -5.639 1.00 1.89 H new ATOM 0 HG3 ARG A1923 -16.198 4.578 -5.599 1.00 1.89 H new ATOM 0 HD2 ARG A1923 -17.236 3.425 -7.383 1.00 2.66 H new ATOM 0 HD3 ARG A1923 -16.138 4.557 -8.146 1.00 2.66 H new ATOM 0 HE ARG A1923 -14.506 2.474 -8.132 1.00 2.93 H new ATOM 0 HH11 ARG A1923 -17.941 2.583 -8.969 1.00 4.35 H new ATOM 0 HH12 ARG A1923 -17.887 1.056 -9.856 1.00 4.35 H new ATOM 0 HH21 ARG A1923 -14.462 0.498 -9.230 1.00 4.26 H new ATOM 0 HH22 ARG A1923 -15.926 -0.118 -10.003 1.00 4.26 H new ATOM 607 N LYS A1924 -12.454 7.012 -5.208 1.00 0.68 N ATOM 608 CA LYS A1924 -11.145 7.496 -4.848 1.00 0.67 C ATOM 609 C LYS A1924 -10.451 6.443 -4.032 1.00 0.53 C ATOM 610 O LYS A1924 -11.089 5.752 -3.243 1.00 0.55 O ATOM 611 CB LYS A1924 -11.239 8.794 -4.037 1.00 0.87 C ATOM 612 CG LYS A1924 -11.814 9.986 -4.795 1.00 1.32 C ATOM 613 CD LYS A1924 -10.910 10.441 -5.941 1.00 1.59 C ATOM 614 CE LYS A1924 -9.543 10.898 -5.438 1.00 2.07 C ATOM 615 NZ LYS A1924 -8.713 11.470 -6.523 1.00 2.72 N ATOM 0 H LYS A1924 -13.117 6.973 -4.434 1.00 0.68 H new ATOM 0 HA LYS A1924 -10.583 7.707 -5.758 1.00 0.67 H new ATOM 0 HB2 LYS A1924 -11.855 8.611 -3.156 1.00 0.87 H new ATOM 0 HB3 LYS A1924 -10.243 9.055 -3.681 1.00 0.87 H new ATOM 0 HG2 LYS A1924 -12.794 9.722 -5.192 1.00 1.32 H new ATOM 0 HG3 LYS A1924 -11.964 10.815 -4.103 1.00 1.32 H new ATOM 0 HD2 LYS A1924 -10.782 9.623 -6.649 1.00 1.59 H new ATOM 0 HD3 LYS A1924 -11.390 11.257 -6.481 1.00 1.59 H new ATOM 0 HE2 LYS A1924 -9.676 11.643 -4.653 1.00 2.07 H new ATOM 0 HE3 LYS A1924 -9.021 10.053 -4.990 1.00 2.07 H new ATOM 0 HZ1 LYS A1924 -8.074 12.190 -6.129 1.00 2.72 H new ATOM 0 HZ2 LYS A1924 -8.152 10.715 -6.966 1.00 2.72 H new ATOM 0 HZ3 LYS A1924 -9.329 11.908 -7.237 1.00 2.72 H new ATOM 629 N ILE A1925 -9.183 6.295 -4.215 1.00 0.49 N ATOM 630 CA ILE A1925 -8.449 5.338 -3.455 1.00 0.44 C ATOM 631 C ILE A1925 -7.608 6.063 -2.445 1.00 0.44 C ATOM 632 O ILE A1925 -6.642 6.749 -2.784 1.00 0.51 O ATOM 633 CB ILE A1925 -7.589 4.382 -4.325 1.00 0.51 C ATOM 634 CG1 ILE A1925 -8.506 3.575 -5.259 1.00 0.53 C ATOM 635 CG2 ILE A1925 -6.791 3.441 -3.428 1.00 0.56 C ATOM 636 CD1 ILE A1925 -7.786 2.576 -6.168 1.00 0.64 C ATOM 0 H ILE A1925 -8.630 6.827 -4.887 1.00 0.49 H new ATOM 0 HA ILE A1925 -9.168 4.692 -2.951 1.00 0.44 H new ATOM 0 HB ILE A1925 -6.892 4.966 -4.926 1.00 0.51 H new ATOM 0 HG12 ILE A1925 -9.232 3.033 -4.652 1.00 0.53 H new ATOM 0 HG13 ILE A1925 -9.068 4.271 -5.882 1.00 0.53 H new ATOM 0 HG21 ILE A1925 -6.190 2.773 -4.045 1.00 0.56 H new ATOM 0 HG22 ILE A1925 -6.136 4.024 -2.780 1.00 0.56 H new ATOM 0 HG23 ILE A1925 -7.476 2.853 -2.817 1.00 0.56 H new ATOM 0 HD11 ILE A1925 -8.516 2.056 -6.788 1.00 0.64 H new ATOM 0 HD12 ILE A1925 -7.081 3.108 -6.807 1.00 0.64 H new ATOM 0 HD13 ILE A1925 -7.247 1.851 -5.557 1.00 0.64 H new ATOM 648 N GLU A1926 -8.023 5.958 -1.240 1.00 0.43 N ATOM 649 CA GLU A1926 -7.363 6.598 -0.135 1.00 0.48 C ATOM 650 C GLU A1926 -6.717 5.497 0.664 1.00 0.46 C ATOM 651 O GLU A1926 -7.408 4.597 1.163 1.00 0.56 O ATOM 652 CB GLU A1926 -8.419 7.357 0.690 1.00 0.67 C ATOM 653 CG GLU A1926 -7.901 8.457 1.618 1.00 1.40 C ATOM 654 CD GLU A1926 -7.179 7.997 2.878 1.00 1.65 C ATOM 655 OE1 GLU A1926 -7.853 7.833 3.923 1.00 1.95 O ATOM 656 OE2 GLU A1926 -5.941 7.951 2.880 1.00 2.28 O ATOM 0 H GLU A1926 -8.846 5.417 -0.974 1.00 0.43 H new ATOM 0 HA GLU A1926 -6.608 7.319 -0.449 1.00 0.48 H new ATOM 0 HB2 GLU A1926 -9.135 7.803 -0.000 1.00 0.67 H new ATOM 0 HB3 GLU A1926 -8.966 6.632 1.293 1.00 0.67 H new ATOM 0 HG2 GLU A1926 -7.223 9.093 1.049 1.00 1.40 H new ATOM 0 HG3 GLU A1926 -8.746 9.078 1.916 1.00 1.40 H new ATOM 663 N LEU A1927 -5.419 5.499 0.727 1.00 0.44 N ATOM 664 CA LEU A1927 -4.731 4.441 1.432 1.00 0.51 C ATOM 665 C LEU A1927 -3.444 4.892 2.033 1.00 0.46 C ATOM 666 O LEU A1927 -2.907 5.890 1.631 1.00 0.61 O ATOM 667 CB LEU A1927 -4.553 3.164 0.554 1.00 0.68 C ATOM 668 CG LEU A1927 -4.009 3.299 -0.886 1.00 0.87 C ATOM 669 CD1 LEU A1927 -2.619 3.890 -0.945 1.00 1.54 C ATOM 670 CD2 LEU A1927 -3.999 1.949 -1.536 1.00 1.48 C ATOM 0 H LEU A1927 -4.816 6.207 0.308 1.00 0.44 H new ATOM 0 HA LEU A1927 -5.377 4.163 2.265 1.00 0.51 H new ATOM 0 HB2 LEU A1927 -3.888 2.488 1.092 1.00 0.68 H new ATOM 0 HB3 LEU A1927 -5.524 2.673 0.491 1.00 0.68 H new ATOM 0 HG LEU A1927 -4.670 3.986 -1.414 1.00 0.87 H new ATOM 0 HD11 LEU A1927 -2.296 3.958 -1.984 1.00 1.54 H new ATOM 0 HD12 LEU A1927 -2.628 4.886 -0.502 1.00 1.54 H new ATOM 0 HD13 LEU A1927 -1.929 3.253 -0.391 1.00 1.54 H new ATOM 0 HD21 LEU A1927 -3.616 2.038 -2.553 1.00 1.48 H new ATOM 0 HD22 LEU A1927 -3.360 1.275 -0.965 1.00 1.48 H new ATOM 0 HD23 LEU A1927 -5.013 1.551 -1.564 1.00 1.48 H new ATOM 682 N ASN A1928 -2.946 4.163 2.984 1.00 0.51 N ATOM 683 CA ASN A1928 -1.679 4.499 3.592 1.00 0.51 C ATOM 684 C ASN A1928 -0.923 3.218 3.898 1.00 0.64 C ATOM 685 O ASN A1928 -1.534 2.185 4.197 1.00 0.81 O ATOM 686 CB ASN A1928 -1.893 5.368 4.844 1.00 0.55 C ATOM 687 CG ASN A1928 -0.614 5.973 5.414 1.00 0.54 C ATOM 688 OD1 ASN A1928 0.374 6.204 4.700 1.00 0.88 O ATOM 689 ND2 ASN A1928 -0.639 6.292 6.680 1.00 0.80 N ATOM 0 H ASN A1928 -3.393 3.328 3.362 1.00 0.51 H new ATOM 0 HA ASN A1928 -1.078 5.092 2.903 1.00 0.51 H new ATOM 0 HB2 ASN A1928 -2.584 6.174 4.599 1.00 0.55 H new ATOM 0 HB3 ASN A1928 -2.370 4.763 5.615 1.00 0.55 H new ATOM 0 HD21 ASN A1928 0.169 6.744 7.108 1.00 0.80 H new ATOM 0 HD22 ASN A1928 -1.466 6.089 7.241 1.00 0.80 H new ATOM 696 N VAL A1929 0.383 3.273 3.768 1.00 0.65 N ATOM 697 CA VAL A1929 1.241 2.119 3.947 1.00 0.82 C ATOM 698 C VAL A1929 2.070 2.285 5.203 1.00 0.87 C ATOM 699 O VAL A1929 2.473 3.401 5.542 1.00 1.69 O ATOM 700 CB VAL A1929 2.147 1.895 2.695 1.00 0.99 C ATOM 701 CG1 VAL A1929 3.187 0.803 2.923 1.00 1.51 C ATOM 702 CG2 VAL A1929 1.283 1.538 1.496 1.00 1.73 C ATOM 0 H VAL A1929 0.887 4.128 3.533 1.00 0.65 H new ATOM 0 HA VAL A1929 0.618 1.232 4.058 1.00 0.82 H new ATOM 0 HB VAL A1929 2.684 2.825 2.508 1.00 0.99 H new ATOM 0 HG11 VAL A1929 3.793 0.684 2.025 1.00 1.51 H new ATOM 0 HG12 VAL A1929 3.829 1.081 3.759 1.00 1.51 H new ATOM 0 HG13 VAL A1929 2.684 -0.137 3.148 1.00 1.51 H new ATOM 0 HG21 VAL A1929 1.918 1.382 0.624 1.00 1.73 H new ATOM 0 HG22 VAL A1929 0.726 0.625 1.708 1.00 1.73 H new ATOM 0 HG23 VAL A1929 0.585 2.351 1.296 1.00 1.73 H new ATOM 712 N CYS A1930 2.242 1.174 5.937 1.00 0.74 N ATOM 713 CA CYS A1930 2.979 1.105 7.232 1.00 0.83 C ATOM 714 C CYS A1930 2.184 1.729 8.367 1.00 0.74 C ATOM 715 O CYS A1930 2.359 1.378 9.540 1.00 0.97 O ATOM 716 CB CYS A1930 4.375 1.749 7.180 1.00 1.01 C ATOM 717 SG CYS A1930 5.612 0.920 6.145 1.00 1.20 S ATOM 0 H CYS A1930 1.867 0.270 5.649 1.00 0.74 H new ATOM 0 HA CYS A1930 3.112 0.040 7.421 1.00 0.83 H new ATOM 0 HB2 CYS A1930 4.265 2.774 6.825 1.00 1.01 H new ATOM 0 HB3 CYS A1930 4.763 1.804 8.197 1.00 1.01 H new ATOM 722 N ALA A1931 1.337 2.636 8.030 1.00 0.63 N ATOM 723 CA ALA A1931 0.518 3.306 8.951 1.00 0.65 C ATOM 724 C ALA A1931 -0.877 3.336 8.397 1.00 0.75 C ATOM 725 O ALA A1931 -1.079 3.139 7.209 1.00 1.31 O ATOM 726 CB ALA A1931 1.034 4.711 9.198 1.00 0.62 C ATOM 0 H ALA A1931 1.197 2.936 7.065 1.00 0.63 H new ATOM 0 HA ALA A1931 0.524 2.786 9.909 1.00 0.65 H new ATOM 0 HB1 ALA A1931 0.386 5.216 9.915 1.00 0.62 H new ATOM 0 HB2 ALA A1931 2.047 4.662 9.596 1.00 0.62 H new ATOM 0 HB3 ALA A1931 1.040 5.267 8.260 1.00 0.62 H new ATOM 732 N GLU A1932 -1.792 3.546 9.254 1.00 0.53 N ATOM 733 CA GLU A1932 -3.209 3.571 8.927 1.00 0.58 C ATOM 734 C GLU A1932 -3.602 4.842 8.148 1.00 0.48 C ATOM 735 O GLU A1932 -3.000 5.922 8.345 1.00 0.49 O ATOM 736 CB GLU A1932 -4.096 3.337 10.197 1.00 0.84 C ATOM 737 CG GLU A1932 -3.853 4.265 11.401 1.00 0.82 C ATOM 738 CD GLU A1932 -2.510 4.077 12.080 1.00 1.32 C ATOM 739 OE1 GLU A1932 -2.410 3.234 12.987 1.00 1.72 O ATOM 740 OE2 GLU A1932 -1.536 4.752 11.718 1.00 2.07 O ATOM 0 H GLU A1932 -1.599 3.714 10.242 1.00 0.53 H new ATOM 0 HA GLU A1932 -3.403 2.736 8.254 1.00 0.58 H new ATOM 0 HB2 GLU A1932 -5.141 3.432 9.902 1.00 0.84 H new ATOM 0 HB3 GLU A1932 -3.950 2.309 10.527 1.00 0.84 H new ATOM 0 HG2 GLU A1932 -3.936 5.300 11.068 1.00 0.82 H new ATOM 0 HG3 GLU A1932 -4.643 4.102 12.134 1.00 0.82 H new ATOM 747 N ALA A1933 -4.587 4.699 7.270 1.00 0.51 N ATOM 748 CA ALA A1933 -5.048 5.769 6.378 1.00 0.57 C ATOM 749 C ALA A1933 -5.933 6.749 7.119 1.00 0.59 C ATOM 750 O ALA A1933 -6.963 6.371 7.697 1.00 0.77 O ATOM 751 CB ALA A1933 -5.788 5.179 5.190 1.00 0.74 C ATOM 0 H ALA A1933 -5.099 3.825 7.152 1.00 0.51 H new ATOM 0 HA ALA A1933 -4.175 6.311 6.015 1.00 0.57 H new ATOM 0 HB1 ALA A1933 -6.125 5.983 4.536 1.00 0.74 H new ATOM 0 HB2 ALA A1933 -5.121 4.517 4.638 1.00 0.74 H new ATOM 0 HB3 ALA A1933 -6.650 4.613 5.543 1.00 0.74 H new ATOM 757 N LYS A1934 -5.537 8.003 7.111 1.00 0.62 N ATOM 758 CA LYS A1934 -6.236 9.023 7.861 1.00 0.76 C ATOM 759 C LYS A1934 -6.625 10.207 6.985 1.00 0.88 C ATOM 760 O LYS A1934 -7.087 11.232 7.503 1.00 1.28 O ATOM 761 CB LYS A1934 -5.346 9.524 9.001 1.00 0.98 C ATOM 762 CG LYS A1934 -4.796 8.425 9.881 1.00 1.65 C ATOM 763 CD LYS A1934 -3.902 8.972 10.967 1.00 2.13 C ATOM 764 CE LYS A1934 -3.176 7.851 11.669 1.00 2.78 C ATOM 765 NZ LYS A1934 -2.265 7.132 10.742 1.00 3.10 N ATOM 0 H LYS A1934 -4.729 8.342 6.589 1.00 0.62 H new ATOM 0 HA LYS A1934 -7.148 8.573 8.254 1.00 0.76 H new ATOM 0 HB2 LYS A1934 -4.514 10.087 8.578 1.00 0.98 H new ATOM 0 HB3 LYS A1934 -5.919 10.217 9.618 1.00 0.98 H new ATOM 0 HG2 LYS A1934 -5.621 7.874 10.332 1.00 1.65 H new ATOM 0 HG3 LYS A1934 -4.235 7.717 9.271 1.00 1.65 H new ATOM 0 HD2 LYS A1934 -3.181 9.667 10.537 1.00 2.13 H new ATOM 0 HD3 LYS A1934 -4.497 9.535 11.687 1.00 2.13 H new ATOM 0 HE2 LYS A1934 -2.604 8.253 12.505 1.00 2.78 H new ATOM 0 HE3 LYS A1934 -3.900 7.151 12.086 1.00 2.78 H new ATOM 0 HZ1 LYS A1934 -1.706 6.435 11.275 1.00 3.10 H new ATOM 0 HZ2 LYS A1934 -2.825 6.643 10.014 1.00 3.10 H new ATOM 0 HZ3 LYS A1934 -1.625 7.813 10.286 1.00 3.10 H new ATOM 779 N SER A1935 -6.456 10.094 5.675 1.00 0.93 N ATOM 780 CA SER A1935 -6.778 11.220 4.809 1.00 1.23 C ATOM 781 C SER A1935 -8.298 11.360 4.698 1.00 1.17 C ATOM 782 O SER A1935 -8.852 12.463 4.790 1.00 2.00 O ATOM 783 CB SER A1935 -6.202 11.029 3.409 1.00 1.67 C ATOM 784 OG SER A1935 -4.922 10.429 3.444 1.00 2.17 O ATOM 0 H SER A1935 -6.109 9.261 5.199 1.00 0.93 H new ATOM 0 HA SER A1935 -6.340 12.116 5.248 1.00 1.23 H new ATOM 0 HB2 SER A1935 -6.878 10.409 2.820 1.00 1.67 H new ATOM 0 HB3 SER A1935 -6.137 11.995 2.908 1.00 1.67 H new ATOM 0 HG SER A1935 -5.005 9.470 3.262 1.00 2.17 H new ATOM 790 N SER A1936 -8.960 10.249 4.466 1.00 0.99 N ATOM 791 CA SER A1936 -10.407 10.215 4.342 1.00 1.20 C ATOM 792 C SER A1936 -11.026 8.944 4.968 1.00 0.95 C ATOM 793 O SER A1936 -12.225 8.917 5.250 1.00 1.08 O ATOM 794 CB SER A1936 -10.801 10.325 2.869 1.00 1.80 C ATOM 795 OG SER A1936 -10.243 11.502 2.292 1.00 2.28 O ATOM 0 H SER A1936 -8.512 9.339 4.357 1.00 0.99 H new ATOM 0 HA SER A1936 -10.803 11.066 4.896 1.00 1.20 H new ATOM 0 HB2 SER A1936 -10.453 9.446 2.326 1.00 1.80 H new ATOM 0 HB3 SER A1936 -11.887 10.347 2.777 1.00 1.80 H new ATOM 0 HG SER A1936 -10.502 11.558 1.349 1.00 2.28 H new ATOM 801 N CYS A1937 -10.232 7.896 5.171 1.00 0.87 N ATOM 802 CA CYS A1937 -10.727 6.673 5.758 1.00 0.93 C ATOM 803 C CYS A1937 -10.981 6.863 7.283 1.00 1.22 C ATOM 804 O CYS A1937 -10.826 7.979 7.810 1.00 1.98 O ATOM 805 CB CYS A1937 -9.755 5.525 5.472 1.00 1.06 C ATOM 806 SG CYS A1937 -10.468 3.878 5.776 1.00 1.44 S ATOM 0 H CYS A1937 -9.240 7.878 4.933 1.00 0.87 H new ATOM 0 HA CYS A1937 -11.684 6.415 5.305 1.00 0.93 H new ATOM 0 HB2 CYS A1937 -9.429 5.585 4.434 1.00 1.06 H new ATOM 0 HB3 CYS A1937 -8.867 5.648 6.092 1.00 1.06 H new ATOM 811 N ALA A1938 -11.356 5.800 7.990 1.00 0.97 N ATOM 812 CA ALA A1938 -11.767 5.937 9.380 1.00 1.24 C ATOM 813 C ALA A1938 -10.620 5.950 10.391 1.00 1.13 C ATOM 814 O ALA A1938 -10.057 7.006 10.695 1.00 1.32 O ATOM 815 CB ALA A1938 -12.786 4.867 9.769 1.00 1.48 C ATOM 0 H ALA A1938 -11.383 4.847 7.627 1.00 0.97 H new ATOM 0 HA ALA A1938 -12.226 6.924 9.429 1.00 1.24 H new ATOM 0 HB1 ALA A1938 -13.071 4.999 10.813 1.00 1.48 H new ATOM 0 HB2 ALA A1938 -13.669 4.959 9.137 1.00 1.48 H new ATOM 0 HB3 ALA A1938 -12.345 3.879 9.635 1.00 1.48 H new ATOM 821 N ASN A1939 -10.270 4.784 10.894 1.00 0.94 N ATOM 822 CA ASN A1939 -9.355 4.692 11.982 1.00 0.94 C ATOM 823 C ASN A1939 -8.111 3.853 11.703 1.00 0.69 C ATOM 824 O ASN A1939 -7.051 4.385 11.434 1.00 0.89 O ATOM 825 CB ASN A1939 -10.097 4.283 13.278 1.00 1.19 C ATOM 826 CG ASN A1939 -9.188 3.907 14.434 1.00 1.51 C ATOM 827 OD1 ASN A1939 -8.735 4.759 15.205 1.00 2.13 O ATOM 828 ND2 ASN A1939 -8.964 2.639 14.597 1.00 2.10 N ATOM 0 H ASN A1939 -10.616 3.887 10.554 1.00 0.94 H new ATOM 0 HA ASN A1939 -8.946 5.692 12.128 1.00 0.94 H new ATOM 0 HB2 ASN A1939 -10.738 5.108 13.590 1.00 1.19 H new ATOM 0 HB3 ASN A1939 -10.750 3.439 13.056 1.00 1.19 H new ATOM 0 HD21 ASN A1939 -8.397 2.318 15.382 1.00 2.10 H new ATOM 0 HD22 ASN A1939 -9.355 1.964 13.940 1.00 2.10 H new ATOM 835 N GLY A1940 -8.275 2.543 11.729 1.00 0.57 N ATOM 836 CA GLY A1940 -7.159 1.620 11.654 1.00 0.70 C ATOM 837 C GLY A1940 -7.063 0.947 10.330 1.00 0.61 C ATOM 838 O GLY A1940 -6.387 -0.068 10.184 1.00 0.79 O ATOM 0 H GLY A1940 -9.186 2.090 11.803 1.00 0.57 H new ATOM 0 HA2 GLY A1940 -6.232 2.159 11.852 1.00 0.70 H new ATOM 0 HA3 GLY A1940 -7.262 0.866 12.434 1.00 0.70 H new ATOM 842 N ALA A1941 -7.798 1.450 9.395 1.00 0.47 N ATOM 843 CA ALA A1941 -7.831 0.901 8.080 1.00 0.46 C ATOM 844 C ALA A1941 -6.634 1.378 7.264 1.00 0.42 C ATOM 845 O ALA A1941 -5.997 2.364 7.616 1.00 0.62 O ATOM 846 CB ALA A1941 -9.117 1.268 7.415 1.00 0.52 C ATOM 0 H ALA A1941 -8.400 2.263 9.524 1.00 0.47 H new ATOM 0 HA ALA A1941 -7.770 -0.185 8.146 1.00 0.46 H new ATOM 0 HB1 ALA A1941 -9.140 0.847 6.410 1.00 0.52 H new ATOM 0 HB2 ALA A1941 -9.952 0.872 7.993 1.00 0.52 H new ATOM 0 HB3 ALA A1941 -9.199 2.353 7.356 1.00 0.52 H new ATOM 852 N ALA A1942 -6.317 0.674 6.196 1.00 0.36 N ATOM 853 CA ALA A1942 -5.190 1.052 5.374 1.00 0.38 C ATOM 854 C ALA A1942 -5.610 1.316 3.956 1.00 0.40 C ATOM 855 O ALA A1942 -5.325 2.357 3.433 1.00 0.49 O ATOM 856 CB ALA A1942 -4.102 0.011 5.417 1.00 0.44 C ATOM 0 H ALA A1942 -6.820 -0.155 5.881 1.00 0.36 H new ATOM 0 HA ALA A1942 -4.788 1.977 5.787 1.00 0.38 H new ATOM 0 HB1 ALA A1942 -3.270 0.328 4.788 1.00 0.44 H new ATOM 0 HB2 ALA A1942 -3.755 -0.110 6.443 1.00 0.44 H new ATOM 0 HB3 ALA A1942 -4.492 -0.939 5.051 1.00 0.44 H new ATOM 862 N VAL A1943 -6.282 0.364 3.327 1.00 0.41 N ATOM 863 CA VAL A1943 -6.744 0.559 1.958 1.00 0.42 C ATOM 864 C VAL A1943 -8.233 0.842 1.983 1.00 0.39 C ATOM 865 O VAL A1943 -9.043 -0.017 2.396 1.00 0.43 O ATOM 866 CB VAL A1943 -6.455 -0.680 1.057 1.00 0.52 C ATOM 867 CG1 VAL A1943 -6.978 -0.464 -0.361 1.00 0.73 C ATOM 868 CG2 VAL A1943 -4.965 -0.971 1.017 1.00 0.75 C ATOM 0 H VAL A1943 -6.518 -0.541 3.734 1.00 0.41 H new ATOM 0 HA VAL A1943 -6.199 1.401 1.530 1.00 0.42 H new ATOM 0 HB VAL A1943 -6.975 -1.535 1.490 1.00 0.52 H new ATOM 0 HG11 VAL A1943 -6.762 -1.344 -0.966 1.00 0.73 H new ATOM 0 HG12 VAL A1943 -8.055 -0.300 -0.330 1.00 0.73 H new ATOM 0 HG13 VAL A1943 -6.491 0.407 -0.800 1.00 0.73 H new ATOM 0 HG21 VAL A1943 -4.781 -1.839 0.384 1.00 0.75 H new ATOM 0 HG22 VAL A1943 -4.436 -0.108 0.613 1.00 0.75 H new ATOM 0 HG23 VAL A1943 -4.607 -1.176 2.026 1.00 0.75 H new ATOM 878 N CYS A1944 -8.605 2.011 1.549 1.00 0.41 N ATOM 879 CA CYS A1944 -9.970 2.425 1.606 1.00 0.49 C ATOM 880 C CYS A1944 -10.442 3.015 0.280 1.00 0.47 C ATOM 881 O CYS A1944 -9.947 4.040 -0.194 1.00 0.54 O ATOM 882 CB CYS A1944 -10.139 3.409 2.763 1.00 0.70 C ATOM 883 SG CYS A1944 -9.616 2.700 4.368 1.00 1.15 S ATOM 0 H CYS A1944 -7.970 2.700 1.147 1.00 0.41 H new ATOM 0 HA CYS A1944 -10.601 1.554 1.784 1.00 0.49 H new ATOM 0 HB2 CYS A1944 -9.557 4.308 2.559 1.00 0.70 H new ATOM 0 HB3 CYS A1944 -11.184 3.714 2.827 1.00 0.70 H new ATOM 888 N ILE A1945 -11.398 2.358 -0.311 1.00 0.46 N ATOM 889 CA ILE A1945 -11.969 2.782 -1.558 1.00 0.49 C ATOM 890 C ILE A1945 -13.114 3.712 -1.218 1.00 0.49 C ATOM 891 O ILE A1945 -14.081 3.300 -0.598 1.00 0.54 O ATOM 892 CB ILE A1945 -12.518 1.564 -2.357 1.00 0.56 C ATOM 893 CG1 ILE A1945 -11.439 0.471 -2.516 1.00 0.54 C ATOM 894 CG2 ILE A1945 -13.057 1.995 -3.722 1.00 0.68 C ATOM 895 CD1 ILE A1945 -10.184 0.914 -3.245 1.00 0.56 C ATOM 0 H ILE A1945 -11.808 1.503 0.063 1.00 0.46 H new ATOM 0 HA ILE A1945 -11.215 3.273 -2.173 1.00 0.49 H new ATOM 0 HB ILE A1945 -13.345 1.142 -1.786 1.00 0.56 H new ATOM 0 HG12 ILE A1945 -11.159 0.111 -1.526 1.00 0.54 H new ATOM 0 HG13 ILE A1945 -11.874 -0.373 -3.051 1.00 0.54 H new ATOM 0 HG21 ILE A1945 -13.433 1.123 -4.256 1.00 0.68 H new ATOM 0 HG22 ILE A1945 -13.866 2.713 -3.584 1.00 0.68 H new ATOM 0 HG23 ILE A1945 -12.257 2.457 -4.300 1.00 0.68 H new ATOM 0 HD11 ILE A1945 -9.486 0.079 -3.307 1.00 0.56 H new ATOM 0 HD12 ILE A1945 -10.445 1.245 -4.250 1.00 0.56 H new ATOM 0 HD13 ILE A1945 -9.719 1.736 -2.702 1.00 0.56 H new ATOM 907 N THR A1946 -12.995 4.952 -1.552 1.00 0.48 N ATOM 908 CA THR A1946 -14.022 5.879 -1.221 1.00 0.51 C ATOM 909 C THR A1946 -15.003 5.966 -2.380 1.00 0.53 C ATOM 910 O THR A1946 -14.683 6.504 -3.451 1.00 0.61 O ATOM 911 CB THR A1946 -13.446 7.263 -0.904 1.00 0.61 C ATOM 912 OG1 THR A1946 -12.258 7.101 -0.106 1.00 0.91 O ATOM 913 CG2 THR A1946 -14.454 8.059 -0.090 1.00 0.79 C ATOM 0 H THR A1946 -12.199 5.346 -2.053 1.00 0.48 H new ATOM 0 HA THR A1946 -14.536 5.528 -0.326 1.00 0.51 H new ATOM 0 HB THR A1946 -13.220 7.782 -1.835 1.00 0.61 H new ATOM 0 HG1 THR A1946 -11.880 7.981 0.101 1.00 0.91 H new ATOM 0 HG21 THR A1946 -14.044 9.043 0.135 1.00 0.79 H new ATOM 0 HG22 THR A1946 -15.375 8.172 -0.662 1.00 0.79 H new ATOM 0 HG23 THR A1946 -14.667 7.533 0.841 1.00 0.79 H new ATOM 921 N ASP A1947 -16.147 5.396 -2.171 1.00 0.58 N ATOM 922 CA ASP A1947 -17.198 5.353 -3.145 1.00 0.74 C ATOM 923 C ASP A1947 -18.153 6.475 -2.820 1.00 0.78 C ATOM 924 O ASP A1947 -18.967 6.370 -1.896 1.00 0.77 O ATOM 925 CB ASP A1947 -17.904 3.991 -3.081 1.00 0.91 C ATOM 926 CG ASP A1947 -18.983 3.817 -4.120 1.00 1.21 C ATOM 927 OD1 ASP A1947 -18.674 3.458 -5.271 1.00 1.94 O ATOM 928 OD2 ASP A1947 -20.170 4.070 -3.818 1.00 1.24 O ATOM 0 H ASP A1947 -16.385 4.934 -1.294 1.00 0.58 H new ATOM 0 HA ASP A1947 -16.810 5.475 -4.156 1.00 0.74 H new ATOM 0 HB2 ASP A1947 -17.163 3.202 -3.204 1.00 0.91 H new ATOM 0 HB3 ASP A1947 -18.342 3.865 -2.091 1.00 0.91 H new ATOM 933 N GLY A1948 -17.991 7.577 -3.512 1.00 0.91 N ATOM 934 CA GLY A1948 -18.766 8.749 -3.219 1.00 1.03 C ATOM 935 C GLY A1948 -18.286 9.356 -1.920 1.00 1.03 C ATOM 936 O GLY A1948 -17.114 9.751 -1.817 1.00 1.07 O ATOM 0 H GLY A1948 -17.329 7.683 -4.281 1.00 0.91 H new ATOM 0 HA2 GLY A1948 -18.671 9.473 -4.028 1.00 1.03 H new ATOM 0 HA3 GLY A1948 -19.822 8.491 -3.144 1.00 1.03 H new ATOM 940 N PRO A1949 -19.150 9.470 -0.920 1.00 1.06 N ATOM 941 CA PRO A1949 -18.763 9.914 0.406 1.00 1.15 C ATOM 942 C PRO A1949 -18.583 8.729 1.375 1.00 1.00 C ATOM 943 O PRO A1949 -18.227 8.910 2.542 1.00 1.12 O ATOM 944 CB PRO A1949 -19.978 10.731 0.821 1.00 1.37 C ATOM 945 CG PRO A1949 -21.145 10.038 0.176 1.00 1.27 C ATOM 946 CD PRO A1949 -20.610 9.264 -1.010 1.00 1.09 C ATOM 0 HA PRO A1949 -17.815 10.452 0.419 1.00 1.15 H new ATOM 0 HB2 PRO A1949 -20.084 10.759 1.905 1.00 1.37 H new ATOM 0 HB3 PRO A1949 -19.895 11.764 0.482 1.00 1.37 H new ATOM 0 HG2 PRO A1949 -21.633 9.368 0.884 1.00 1.27 H new ATOM 0 HG3 PRO A1949 -21.893 10.763 -0.144 1.00 1.27 H new ATOM 0 HD2 PRO A1949 -20.871 8.207 -0.952 1.00 1.09 H new ATOM 0 HD3 PRO A1949 -21.012 9.641 -1.951 1.00 1.09 H new ATOM 954 N LYS A1950 -18.814 7.532 0.881 1.00 0.86 N ATOM 955 CA LYS A1950 -18.820 6.358 1.706 1.00 0.83 C ATOM 956 C LYS A1950 -17.523 5.587 1.523 1.00 0.66 C ATOM 957 O LYS A1950 -17.047 5.402 0.411 1.00 0.71 O ATOM 958 CB LYS A1950 -20.060 5.521 1.367 1.00 0.95 C ATOM 959 CG LYS A1950 -20.273 4.298 2.229 1.00 1.31 C ATOM 960 CD LYS A1950 -21.643 3.696 1.963 1.00 1.91 C ATOM 961 CE LYS A1950 -21.867 2.454 2.792 1.00 2.18 C ATOM 962 NZ LYS A1950 -23.236 1.943 2.665 1.00 2.52 N ATOM 0 H LYS A1950 -19.002 7.352 -0.105 1.00 0.86 H new ATOM 0 HA LYS A1950 -18.877 6.628 2.760 1.00 0.83 H new ATOM 0 HB2 LYS A1950 -20.941 6.159 1.447 1.00 0.95 H new ATOM 0 HB3 LYS A1950 -19.990 5.203 0.327 1.00 0.95 H new ATOM 0 HG2 LYS A1950 -19.498 3.560 2.023 1.00 1.31 H new ATOM 0 HG3 LYS A1950 -20.185 4.567 3.282 1.00 1.31 H new ATOM 0 HD2 LYS A1950 -22.416 4.431 2.189 1.00 1.91 H new ATOM 0 HD3 LYS A1950 -21.736 3.451 0.905 1.00 1.91 H new ATOM 0 HE2 LYS A1950 -21.163 1.681 2.484 1.00 2.18 H new ATOM 0 HE3 LYS A1950 -21.659 2.676 3.839 1.00 2.18 H new ATOM 0 HZ1 LYS A1950 -23.344 1.090 3.251 1.00 2.52 H new ATOM 0 HZ2 LYS A1950 -23.909 2.669 2.983 1.00 2.52 H new ATOM 0 HZ3 LYS A1950 -23.427 1.706 1.671 1.00 2.52 H new ATOM 976 N THR A1951 -16.940 5.176 2.601 1.00 0.68 N ATOM 977 CA THR A1951 -15.677 4.506 2.556 1.00 0.60 C ATOM 978 C THR A1951 -15.849 2.984 2.602 1.00 0.57 C ATOM 979 O THR A1951 -16.498 2.458 3.495 1.00 0.72 O ATOM 980 CB THR A1951 -14.820 4.976 3.737 1.00 0.73 C ATOM 981 OG1 THR A1951 -14.797 6.412 3.735 1.00 1.05 O ATOM 982 CG2 THR A1951 -13.401 4.460 3.615 1.00 1.07 C ATOM 0 H THR A1951 -17.324 5.294 3.539 1.00 0.68 H new ATOM 0 HA THR A1951 -15.184 4.753 1.616 1.00 0.60 H new ATOM 0 HB THR A1951 -15.248 4.593 4.663 1.00 0.73 H new ATOM 0 HG1 THR A1951 -14.254 6.732 4.486 1.00 1.05 H new ATOM 0 HG21 THR A1951 -12.813 4.807 4.465 1.00 1.07 H new ATOM 0 HG22 THR A1951 -13.410 3.370 3.601 1.00 1.07 H new ATOM 0 HG23 THR A1951 -12.957 4.831 2.691 1.00 1.07 H new ATOM 990 N LEU A1952 -15.314 2.312 1.605 1.00 0.52 N ATOM 991 CA LEU A1952 -15.277 0.867 1.548 1.00 0.52 C ATOM 992 C LEU A1952 -13.887 0.417 1.964 1.00 0.47 C ATOM 993 O LEU A1952 -12.890 0.769 1.319 1.00 0.52 O ATOM 994 CB LEU A1952 -15.585 0.385 0.117 1.00 0.57 C ATOM 995 CG LEU A1952 -15.434 -1.122 -0.153 1.00 0.63 C ATOM 996 CD1 LEU A1952 -16.380 -1.935 0.710 1.00 1.14 C ATOM 997 CD2 LEU A1952 -15.658 -1.424 -1.628 1.00 1.15 C ATOM 0 H LEU A1952 -14.885 2.763 0.797 1.00 0.52 H new ATOM 0 HA LEU A1952 -16.026 0.443 2.217 1.00 0.52 H new ATOM 0 HB2 LEU A1952 -16.608 0.673 -0.126 1.00 0.57 H new ATOM 0 HB3 LEU A1952 -14.931 0.921 -0.571 1.00 0.57 H new ATOM 0 HG LEU A1952 -14.416 -1.409 0.110 1.00 0.63 H new ATOM 0 HD11 LEU A1952 -16.248 -2.995 0.495 1.00 1.14 H new ATOM 0 HD12 LEU A1952 -16.164 -1.749 1.762 1.00 1.14 H new ATOM 0 HD13 LEU A1952 -17.409 -1.646 0.494 1.00 1.14 H new ATOM 0 HD21 LEU A1952 -15.547 -2.494 -1.801 1.00 1.15 H new ATOM 0 HD22 LEU A1952 -16.662 -1.112 -1.915 1.00 1.15 H new ATOM 0 HD23 LEU A1952 -14.925 -0.882 -2.226 1.00 1.15 H new ATOM 1009 N ASN A1953 -13.796 -0.317 3.024 1.00 0.48 N ATOM 1010 CA ASN A1953 -12.508 -0.743 3.506 1.00 0.45 C ATOM 1011 C ASN A1953 -12.156 -2.096 2.907 1.00 0.46 C ATOM 1012 O ASN A1953 -12.821 -3.087 3.165 1.00 0.64 O ATOM 1013 CB ASN A1953 -12.487 -0.791 5.045 1.00 0.59 C ATOM 1014 CG ASN A1953 -11.112 -1.110 5.623 1.00 1.20 C ATOM 1015 OD1 ASN A1953 -10.992 -1.714 6.684 1.00 1.86 O ATOM 1016 ND2 ASN A1953 -10.070 -0.673 4.964 1.00 1.93 N ATOM 0 H ASN A1953 -14.591 -0.637 3.577 1.00 0.48 H new ATOM 0 HA ASN A1953 -11.756 -0.019 3.192 1.00 0.45 H new ATOM 0 HB2 ASN A1953 -12.823 0.170 5.436 1.00 0.59 H new ATOM 0 HB3 ASN A1953 -13.200 -1.541 5.387 1.00 0.59 H new ATOM 0 HD21 ASN A1953 -9.131 -0.832 5.330 1.00 1.93 H new ATOM 0 HD22 ASN A1953 -10.196 -0.173 4.084 1.00 1.93 H new ATOM 1023 N ALA A1954 -11.132 -2.122 2.083 1.00 0.43 N ATOM 1024 CA ALA A1954 -10.705 -3.357 1.442 1.00 0.58 C ATOM 1025 C ALA A1954 -9.714 -4.092 2.330 1.00 0.70 C ATOM 1026 O ALA A1954 -9.569 -5.320 2.258 1.00 1.17 O ATOM 1027 CB ALA A1954 -10.088 -3.064 0.080 1.00 0.69 C ATOM 0 H ALA A1954 -10.575 -1.303 1.837 1.00 0.43 H new ATOM 0 HA ALA A1954 -11.577 -3.994 1.293 1.00 0.58 H new ATOM 0 HB1 ALA A1954 -9.774 -3.998 -0.386 1.00 0.69 H new ATOM 0 HB2 ALA A1954 -10.825 -2.572 -0.555 1.00 0.69 H new ATOM 0 HB3 ALA A1954 -9.223 -2.412 0.205 1.00 0.69 H new ATOM 1033 N GLY A1955 -9.041 -3.340 3.171 1.00 0.42 N ATOM 1034 CA GLY A1955 -8.088 -3.916 4.064 1.00 0.51 C ATOM 1035 C GLY A1955 -7.690 -2.948 5.136 1.00 0.43 C ATOM 1036 O GLY A1955 -7.471 -1.746 4.857 1.00 0.47 O ATOM 0 H GLY A1955 -9.143 -2.328 3.248 1.00 0.42 H new ATOM 0 HA2 GLY A1955 -8.509 -4.813 4.519 1.00 0.51 H new ATOM 0 HA3 GLY A1955 -7.205 -4.226 3.506 1.00 0.51 H new ATOM 1040 N LYS A1956 -7.613 -3.417 6.348 1.00 0.43 N ATOM 1041 CA LYS A1956 -7.222 -2.585 7.448 1.00 0.45 C ATOM 1042 C LYS A1956 -5.716 -2.505 7.489 1.00 0.38 C ATOM 1043 O LYS A1956 -5.031 -3.177 6.702 1.00 0.40 O ATOM 1044 CB LYS A1956 -7.750 -3.114 8.793 1.00 0.61 C ATOM 1045 CG LYS A1956 -7.166 -4.466 9.213 1.00 0.70 C ATOM 1046 CD LYS A1956 -7.673 -4.906 10.579 1.00 0.97 C ATOM 1047 CE LYS A1956 -7.227 -3.961 11.695 1.00 1.54 C ATOM 1048 NZ LYS A1956 -5.749 -3.934 11.872 1.00 2.43 N ATOM 0 H LYS A1956 -7.819 -4.384 6.601 1.00 0.43 H new ATOM 0 HA LYS A1956 -7.656 -1.597 7.296 1.00 0.45 H new ATOM 0 HB2 LYS A1956 -7.532 -2.381 9.569 1.00 0.61 H new ATOM 0 HB3 LYS A1956 -8.835 -3.203 8.734 1.00 0.61 H new ATOM 0 HG2 LYS A1956 -7.426 -5.220 8.470 1.00 0.70 H new ATOM 0 HG3 LYS A1956 -6.078 -4.400 9.234 1.00 0.70 H new ATOM 0 HD2 LYS A1956 -8.762 -4.956 10.561 1.00 0.97 H new ATOM 0 HD3 LYS A1956 -7.311 -5.912 10.792 1.00 0.97 H new ATOM 0 HE2 LYS A1956 -7.580 -2.954 11.475 1.00 1.54 H new ATOM 0 HE3 LYS A1956 -7.695 -4.265 12.631 1.00 1.54 H new ATOM 0 HZ1 LYS A1956 -5.509 -3.358 12.704 1.00 2.43 H new ATOM 0 HZ2 LYS A1956 -5.398 -4.903 12.009 1.00 2.43 H new ATOM 0 HZ3 LYS A1956 -5.306 -3.522 11.026 1.00 2.43 H new ATOM 1062 N LEU A1957 -5.194 -1.700 8.377 1.00 0.42 N ATOM 1063 CA LEU A1957 -3.788 -1.603 8.523 1.00 0.45 C ATOM 1064 C LEU A1957 -3.238 -2.858 9.109 1.00 0.45 C ATOM 1065 O LEU A1957 -3.632 -3.279 10.196 1.00 0.53 O ATOM 1066 CB LEU A1957 -3.362 -0.426 9.396 1.00 0.57 C ATOM 1067 CG LEU A1957 -1.865 -0.388 9.738 1.00 0.77 C ATOM 1068 CD1 LEU A1957 -1.009 -0.170 8.502 1.00 1.24 C ATOM 1069 CD2 LEU A1957 -1.578 0.641 10.798 1.00 1.30 C ATOM 0 H LEU A1957 -5.734 -1.105 9.006 1.00 0.42 H new ATOM 0 HA LEU A1957 -3.388 -1.441 7.522 1.00 0.45 H new ATOM 0 HB2 LEU A1957 -3.628 0.501 8.888 1.00 0.57 H new ATOM 0 HB3 LEU A1957 -3.932 -0.455 10.325 1.00 0.57 H new ATOM 0 HG LEU A1957 -1.597 -1.364 10.142 1.00 0.77 H new ATOM 0 HD11 LEU A1957 0.043 -0.149 8.787 1.00 1.24 H new ATOM 0 HD12 LEU A1957 -1.178 -0.982 7.795 1.00 1.24 H new ATOM 0 HD13 LEU A1957 -1.277 0.778 8.036 1.00 1.24 H new ATOM 0 HD21 LEU A1957 -0.511 0.646 11.021 1.00 1.30 H new ATOM 0 HD22 LEU A1957 -1.879 1.626 10.440 1.00 1.30 H new ATOM 0 HD23 LEU A1957 -2.136 0.397 11.702 1.00 1.30 H new ATOM 1081 N SER A1958 -2.419 -3.468 8.360 1.00 0.56 N ATOM 1082 CA SER A1958 -1.640 -4.536 8.799 1.00 0.67 C ATOM 1083 C SER A1958 -0.287 -4.230 8.253 1.00 0.65 C ATOM 1084 O SER A1958 -0.053 -4.355 7.052 1.00 0.84 O ATOM 1085 CB SER A1958 -2.188 -5.882 8.274 1.00 0.96 C ATOM 1086 OG SER A1958 -1.451 -6.991 8.787 1.00 1.62 O ATOM 0 H SER A1958 -2.268 -3.224 7.381 1.00 0.56 H new ATOM 0 HA SER A1958 -1.633 -4.643 9.884 1.00 0.67 H new ATOM 0 HB2 SER A1958 -3.237 -5.982 8.554 1.00 0.96 H new ATOM 0 HB3 SER A1958 -2.147 -5.891 7.185 1.00 0.96 H new ATOM 0 HG SER A1958 -0.600 -7.068 8.307 1.00 1.62 H new ATOM 1092 N LYS A1959 0.578 -3.739 9.096 1.00 0.59 N ATOM 1093 CA LYS A1959 1.892 -3.358 8.667 1.00 0.71 C ATOM 1094 C LYS A1959 2.771 -4.605 8.474 1.00 0.76 C ATOM 1095 O LYS A1959 3.617 -4.940 9.282 1.00 1.04 O ATOM 1096 CB LYS A1959 2.505 -2.261 9.601 1.00 0.86 C ATOM 1097 CG LYS A1959 2.613 -2.667 11.071 1.00 0.96 C ATOM 1098 CD LYS A1959 3.091 -1.528 11.962 1.00 1.10 C ATOM 1099 CE LYS A1959 2.039 -0.426 12.108 1.00 0.98 C ATOM 1100 NZ LYS A1959 0.805 -0.886 12.797 1.00 1.48 N ATOM 0 H LYS A1959 0.394 -3.593 10.089 1.00 0.59 H new ATOM 0 HA LYS A1959 1.833 -2.881 7.689 1.00 0.71 H new ATOM 0 HB2 LYS A1959 3.499 -2.004 9.234 1.00 0.86 H new ATOM 0 HB3 LYS A1959 1.896 -1.360 9.530 1.00 0.86 H new ATOM 0 HG2 LYS A1959 1.640 -3.013 11.421 1.00 0.96 H new ATOM 0 HG3 LYS A1959 3.301 -3.507 11.162 1.00 0.96 H new ATOM 0 HD2 LYS A1959 3.342 -1.921 12.947 1.00 1.10 H new ATOM 0 HD3 LYS A1959 4.004 -1.103 11.546 1.00 1.10 H new ATOM 0 HE2 LYS A1959 2.469 0.407 12.664 1.00 0.98 H new ATOM 0 HE3 LYS A1959 1.777 -0.049 11.120 1.00 0.98 H new ATOM 0 HZ1 LYS A1959 0.220 -0.063 13.048 1.00 1.48 H new ATOM 0 HZ2 LYS A1959 0.268 -1.513 12.165 1.00 1.48 H new ATOM 0 HZ3 LYS A1959 1.063 -1.404 13.661 1.00 1.48 H new ATOM 1114 N THR A1960 2.447 -5.336 7.442 1.00 0.74 N ATOM 1115 CA THR A1960 3.112 -6.545 7.089 1.00 0.81 C ATOM 1116 C THR A1960 4.007 -6.292 5.882 1.00 0.77 C ATOM 1117 O THR A1960 3.541 -6.246 4.745 1.00 1.05 O ATOM 1118 CB THR A1960 2.071 -7.633 6.744 1.00 0.92 C ATOM 1119 OG1 THR A1960 1.053 -7.665 7.778 1.00 1.63 O ATOM 1120 CG2 THR A1960 2.731 -9.007 6.651 1.00 1.27 C ATOM 0 H THR A1960 1.687 -5.092 6.808 1.00 0.74 H new ATOM 0 HA THR A1960 3.718 -6.885 7.929 1.00 0.81 H new ATOM 0 HB THR A1960 1.625 -7.393 5.779 1.00 0.92 H new ATOM 0 HG1 THR A1960 0.472 -8.442 7.641 1.00 1.63 H new ATOM 0 HG21 THR A1960 1.978 -9.757 6.407 1.00 1.27 H new ATOM 0 HG22 THR A1960 3.494 -8.992 5.873 1.00 1.27 H new ATOM 0 HG23 THR A1960 3.193 -9.254 7.607 1.00 1.27 H new ATOM 1128 N LEU A1961 5.251 -6.062 6.154 1.00 0.55 N ATOM 1129 CA LEU A1961 6.255 -5.818 5.150 1.00 0.51 C ATOM 1130 C LEU A1961 6.865 -7.157 4.834 1.00 0.51 C ATOM 1131 O LEU A1961 7.572 -7.725 5.666 1.00 0.58 O ATOM 1132 CB LEU A1961 7.350 -4.851 5.704 1.00 0.62 C ATOM 1133 CG LEU A1961 7.003 -3.340 5.879 1.00 0.71 C ATOM 1134 CD1 LEU A1961 6.836 -2.666 4.544 1.00 1.35 C ATOM 1135 CD2 LEU A1961 5.760 -3.117 6.740 1.00 1.32 C ATOM 0 H LEU A1961 5.615 -6.036 7.107 1.00 0.55 H new ATOM 0 HA LEU A1961 5.824 -5.354 4.263 1.00 0.51 H new ATOM 0 HB2 LEU A1961 7.665 -5.232 6.676 1.00 0.62 H new ATOM 0 HB3 LEU A1961 8.213 -4.916 5.041 1.00 0.62 H new ATOM 0 HG LEU A1961 7.846 -2.890 6.403 1.00 0.71 H new ATOM 0 HD11 LEU A1961 6.595 -1.614 4.695 1.00 1.35 H new ATOM 0 HD12 LEU A1961 7.763 -2.748 3.977 1.00 1.35 H new ATOM 0 HD13 LEU A1961 6.029 -3.148 3.992 1.00 1.35 H new ATOM 0 HD21 LEU A1961 5.565 -2.048 6.828 1.00 1.32 H new ATOM 0 HD22 LEU A1961 4.903 -3.605 6.275 1.00 1.32 H new ATOM 0 HD23 LEU A1961 5.924 -3.539 7.732 1.00 1.32 H new ATOM 1147 N THR A1962 6.559 -7.705 3.698 1.00 0.51 N ATOM 1148 CA THR A1962 7.034 -9.024 3.412 1.00 0.58 C ATOM 1149 C THR A1962 7.626 -9.135 2.007 1.00 0.51 C ATOM 1150 O THR A1962 7.212 -8.444 1.086 1.00 0.72 O ATOM 1151 CB THR A1962 5.913 -10.077 3.703 1.00 0.72 C ATOM 1152 OG1 THR A1962 6.290 -11.405 3.312 1.00 1.19 O ATOM 1153 CG2 THR A1962 4.586 -9.679 3.075 1.00 0.61 C ATOM 0 H THR A1962 5.995 -7.271 2.968 1.00 0.51 H new ATOM 0 HA THR A1962 7.865 -9.246 4.082 1.00 0.58 H new ATOM 0 HB THR A1962 5.781 -10.088 4.785 1.00 0.72 H new ATOM 0 HG1 THR A1962 5.559 -12.026 3.515 1.00 1.19 H new ATOM 0 HG21 THR A1962 3.835 -10.436 3.301 1.00 0.61 H new ATOM 0 HG22 THR A1962 4.266 -8.719 3.479 1.00 0.61 H new ATOM 0 HG23 THR A1962 4.705 -9.597 1.995 1.00 0.61 H new ATOM 1161 N TYR A1963 8.621 -9.973 1.880 1.00 0.47 N ATOM 1162 CA TYR A1963 9.335 -10.185 0.634 1.00 0.48 C ATOM 1163 C TYR A1963 8.737 -11.346 -0.156 1.00 0.55 C ATOM 1164 O TYR A1963 8.503 -12.438 0.387 1.00 0.75 O ATOM 1165 CB TYR A1963 10.846 -10.417 0.913 1.00 0.62 C ATOM 1166 CG TYR A1963 11.126 -11.278 2.145 1.00 0.78 C ATOM 1167 CD1 TYR A1963 11.078 -12.670 2.096 1.00 1.03 C ATOM 1168 CD2 TYR A1963 11.437 -10.681 3.361 1.00 0.78 C ATOM 1169 CE1 TYR A1963 11.321 -13.433 3.225 1.00 1.27 C ATOM 1170 CE2 TYR A1963 11.684 -11.434 4.486 1.00 1.01 C ATOM 1171 CZ TYR A1963 11.625 -12.807 4.415 1.00 1.25 C ATOM 1172 OH TYR A1963 11.853 -13.547 5.548 1.00 1.52 O ATOM 0 H TYR A1963 8.970 -10.542 2.651 1.00 0.47 H new ATOM 0 HA TYR A1963 9.231 -9.288 0.023 1.00 0.48 H new ATOM 0 HB2 TYR A1963 11.297 -10.891 0.041 1.00 0.62 H new ATOM 0 HB3 TYR A1963 11.334 -9.451 1.039 1.00 0.62 H new ATOM 0 HD1 TYR A1963 10.848 -13.161 1.162 1.00 1.03 H new ATOM 0 HD2 TYR A1963 11.486 -9.604 3.424 1.00 0.78 H new ATOM 0 HE1 TYR A1963 11.273 -14.511 3.174 1.00 1.27 H new ATOM 0 HE2 TYR A1963 11.923 -10.949 5.421 1.00 1.01 H new ATOM 0 HH TYR A1963 12.055 -12.947 6.296 1.00 1.52 H new ATOM 1182 N GLU A1964 8.462 -11.111 -1.411 1.00 0.54 N ATOM 1183 CA GLU A1964 7.943 -12.133 -2.292 1.00 0.70 C ATOM 1184 C GLU A1964 8.388 -11.730 -3.705 1.00 0.80 C ATOM 1185 O GLU A1964 8.145 -10.598 -4.118 1.00 0.78 O ATOM 1186 CB GLU A1964 6.406 -12.192 -2.131 1.00 0.87 C ATOM 1187 CG GLU A1964 5.747 -13.537 -2.428 1.00 1.25 C ATOM 1188 CD GLU A1964 5.777 -13.932 -3.869 1.00 1.87 C ATOM 1189 OE1 GLU A1964 6.762 -14.582 -4.284 1.00 2.22 O ATOM 1190 OE2 GLU A1964 4.831 -13.610 -4.608 1.00 2.75 O ATOM 0 H GLU A1964 8.591 -10.203 -1.857 1.00 0.54 H new ATOM 0 HA GLU A1964 8.314 -13.134 -2.070 1.00 0.70 H new ATOM 0 HB2 GLU A1964 6.158 -11.907 -1.109 1.00 0.87 H new ATOM 0 HB3 GLU A1964 5.964 -11.442 -2.787 1.00 0.87 H new ATOM 0 HG2 GLU A1964 6.244 -14.309 -1.841 1.00 1.25 H new ATOM 0 HG3 GLU A1964 4.710 -13.502 -2.095 1.00 1.25 H new ATOM 1197 N ASP A1965 9.080 -12.644 -4.401 1.00 1.04 N ATOM 1198 CA ASP A1965 9.773 -12.397 -5.714 1.00 1.25 C ATOM 1199 C ASP A1965 10.723 -11.206 -5.638 1.00 1.07 C ATOM 1200 O ASP A1965 10.989 -10.530 -6.627 1.00 1.08 O ATOM 1201 CB ASP A1965 8.848 -12.374 -7.006 1.00 1.46 C ATOM 1202 CG ASP A1965 7.829 -11.230 -7.173 1.00 2.18 C ATOM 1203 OD1 ASP A1965 6.712 -11.327 -6.612 1.00 2.64 O ATOM 1204 OD2 ASP A1965 8.079 -10.283 -7.974 1.00 2.74 O ATOM 0 H ASP A1965 9.187 -13.605 -4.075 1.00 1.04 H new ATOM 0 HA ASP A1965 10.370 -13.295 -5.869 1.00 1.25 H new ATOM 0 HB2 ASP A1965 9.501 -12.363 -7.879 1.00 1.46 H new ATOM 0 HB3 ASP A1965 8.296 -13.313 -7.033 1.00 1.46 H new ATOM 1209 N GLN A1966 11.292 -11.026 -4.432 1.00 1.03 N ATOM 1210 CA GLN A1966 12.208 -9.969 -4.060 1.00 1.04 C ATOM 1211 C GLN A1966 11.542 -8.583 -4.077 1.00 0.84 C ATOM 1212 O GLN A1966 12.168 -7.566 -3.850 1.00 1.05 O ATOM 1213 CB GLN A1966 13.509 -10.036 -4.855 1.00 1.33 C ATOM 1214 CG GLN A1966 14.624 -9.352 -4.136 1.00 1.71 C ATOM 1215 CD GLN A1966 15.987 -9.589 -4.738 1.00 2.12 C ATOM 1216 OE1 GLN A1966 16.688 -10.544 -4.363 1.00 2.66 O ATOM 1217 NE2 GLN A1966 16.402 -8.729 -5.626 1.00 2.40 N ATOM 0 H GLN A1966 11.104 -11.660 -3.656 1.00 1.03 H new ATOM 0 HA GLN A1966 12.489 -10.136 -3.020 1.00 1.04 H new ATOM 0 HB2 GLN A1966 13.775 -11.078 -5.033 1.00 1.33 H new ATOM 0 HB3 GLN A1966 13.365 -9.572 -5.831 1.00 1.33 H new ATOM 0 HG2 GLN A1966 14.428 -8.280 -4.121 1.00 1.71 H new ATOM 0 HG3 GLN A1966 14.634 -9.689 -3.099 1.00 1.71 H new ATOM 0 HE21 GLN A1966 15.798 -7.957 -5.910 1.00 2.40 H new ATOM 0 HE22 GLN A1966 17.330 -8.828 -6.037 1.00 2.40 H new ATOM 1226 N VAL A1967 10.263 -8.572 -4.286 1.00 0.60 N ATOM 1227 CA VAL A1967 9.508 -7.365 -4.266 1.00 0.49 C ATOM 1228 C VAL A1967 8.863 -7.254 -2.902 1.00 0.41 C ATOM 1229 O VAL A1967 8.522 -8.282 -2.278 1.00 0.41 O ATOM 1230 CB VAL A1967 8.440 -7.358 -5.405 1.00 0.52 C ATOM 1231 CG1 VAL A1967 7.570 -6.108 -5.382 1.00 1.01 C ATOM 1232 CG2 VAL A1967 9.129 -7.468 -6.743 1.00 1.06 C ATOM 0 H VAL A1967 9.712 -9.409 -4.477 1.00 0.60 H new ATOM 0 HA VAL A1967 10.155 -6.506 -4.442 1.00 0.49 H new ATOM 0 HB VAL A1967 7.785 -8.213 -5.241 1.00 0.52 H new ATOM 0 HG11 VAL A1967 6.845 -6.154 -6.194 1.00 1.01 H new ATOM 0 HG12 VAL A1967 7.044 -6.048 -4.429 1.00 1.01 H new ATOM 0 HG13 VAL A1967 8.198 -5.226 -5.506 1.00 1.01 H new ATOM 0 HG21 VAL A1967 8.383 -7.463 -7.538 1.00 1.06 H new ATOM 0 HG22 VAL A1967 9.805 -6.623 -6.875 1.00 1.06 H new ATOM 0 HG23 VAL A1967 9.697 -8.397 -6.784 1.00 1.06 H new ATOM 1242 N LEU A1968 8.722 -6.053 -2.426 1.00 0.41 N ATOM 1243 CA LEU A1968 8.143 -5.821 -1.154 1.00 0.38 C ATOM 1244 C LEU A1968 6.643 -5.844 -1.297 1.00 0.37 C ATOM 1245 O LEU A1968 6.051 -5.015 -1.989 1.00 0.49 O ATOM 1246 CB LEU A1968 8.603 -4.479 -0.603 1.00 0.42 C ATOM 1247 CG LEU A1968 8.053 -4.093 0.759 1.00 0.43 C ATOM 1248 CD1 LEU A1968 8.503 -5.070 1.824 1.00 0.47 C ATOM 1249 CD2 LEU A1968 8.466 -2.688 1.107 1.00 0.50 C ATOM 0 H LEU A1968 9.010 -5.208 -2.919 1.00 0.41 H new ATOM 0 HA LEU A1968 8.457 -6.598 -0.457 1.00 0.38 H new ATOM 0 HB2 LEU A1968 9.691 -4.487 -0.544 1.00 0.42 H new ATOM 0 HB3 LEU A1968 8.328 -3.702 -1.317 1.00 0.42 H new ATOM 0 HG LEU A1968 6.965 -4.132 0.715 1.00 0.43 H new ATOM 0 HD11 LEU A1968 8.095 -4.770 2.789 1.00 0.47 H new ATOM 0 HD12 LEU A1968 8.147 -6.070 1.575 1.00 0.47 H new ATOM 0 HD13 LEU A1968 9.592 -5.075 1.876 1.00 0.47 H new ATOM 0 HD21 LEU A1968 8.066 -2.423 2.086 1.00 0.50 H new ATOM 0 HD22 LEU A1968 9.554 -2.624 1.130 1.00 0.50 H new ATOM 0 HD23 LEU A1968 8.078 -1.998 0.357 1.00 0.50 H new ATOM 1261 N LYS A1969 6.049 -6.806 -0.700 1.00 0.33 N ATOM 1262 CA LYS A1969 4.644 -6.969 -0.760 1.00 0.36 C ATOM 1263 C LYS A1969 4.028 -6.442 0.510 1.00 0.34 C ATOM 1264 O LYS A1969 4.475 -6.779 1.627 1.00 0.36 O ATOM 1265 CB LYS A1969 4.272 -8.451 -0.951 1.00 0.47 C ATOM 1266 CG LYS A1969 4.908 -9.115 -2.173 1.00 0.73 C ATOM 1267 CD LYS A1969 4.454 -8.489 -3.484 1.00 1.19 C ATOM 1268 CE LYS A1969 5.196 -9.098 -4.677 1.00 1.19 C ATOM 1269 NZ LYS A1969 4.943 -10.553 -4.849 1.00 1.29 N ATOM 0 H LYS A1969 6.531 -7.515 -0.147 1.00 0.33 H new ATOM 0 HA LYS A1969 4.260 -6.411 -1.614 1.00 0.36 H new ATOM 0 HB2 LYS A1969 4.567 -9.004 -0.059 1.00 0.47 H new ATOM 0 HB3 LYS A1969 3.188 -8.532 -1.033 1.00 0.47 H new ATOM 0 HG2 LYS A1969 5.993 -9.043 -2.097 1.00 0.73 H new ATOM 0 HG3 LYS A1969 4.658 -10.176 -2.176 1.00 0.73 H new ATOM 0 HD2 LYS A1969 3.381 -8.635 -3.607 1.00 1.19 H new ATOM 0 HD3 LYS A1969 4.628 -7.413 -3.455 1.00 1.19 H new ATOM 0 HE2 LYS A1969 4.899 -8.575 -5.586 1.00 1.19 H new ATOM 0 HE3 LYS A1969 6.266 -8.935 -4.551 1.00 1.19 H new ATOM 0 HZ1 LYS A1969 5.831 -11.032 -5.100 1.00 1.29 H new ATOM 0 HZ2 LYS A1969 4.575 -10.949 -3.960 1.00 1.29 H new ATOM 0 HZ3 LYS A1969 4.245 -10.697 -5.607 1.00 1.29 H new ATOM 1283 N LEU A1970 3.090 -5.559 0.340 1.00 0.42 N ATOM 1284 CA LEU A1970 2.284 -5.055 1.411 1.00 0.49 C ATOM 1285 C LEU A1970 0.897 -5.563 1.212 1.00 0.46 C ATOM 1286 O LEU A1970 0.226 -5.216 0.234 1.00 0.57 O ATOM 1287 CB LEU A1970 2.278 -3.512 1.462 1.00 0.60 C ATOM 1288 CG LEU A1970 3.385 -2.828 2.278 1.00 0.91 C ATOM 1289 CD1 LEU A1970 3.230 -3.151 3.752 1.00 1.11 C ATOM 1290 CD2 LEU A1970 4.761 -3.235 1.802 1.00 1.75 C ATOM 0 H LEU A1970 2.859 -5.160 -0.570 1.00 0.42 H new ATOM 0 HA LEU A1970 2.699 -5.398 2.359 1.00 0.49 H new ATOM 0 HB2 LEU A1970 2.335 -3.141 0.439 1.00 0.60 H new ATOM 0 HB3 LEU A1970 1.317 -3.192 1.864 1.00 0.60 H new ATOM 0 HG LEU A1970 3.284 -1.753 2.132 1.00 0.91 H new ATOM 0 HD11 LEU A1970 4.022 -2.659 4.317 1.00 1.11 H new ATOM 0 HD12 LEU A1970 2.260 -2.797 4.102 1.00 1.11 H new ATOM 0 HD13 LEU A1970 3.296 -4.229 3.897 1.00 1.11 H new ATOM 0 HD21 LEU A1970 5.518 -2.731 2.403 1.00 1.75 H new ATOM 0 HD22 LEU A1970 4.877 -4.314 1.903 1.00 1.75 H new ATOM 0 HD23 LEU A1970 4.882 -2.954 0.756 1.00 1.75 H new ATOM 1302 N VAL A1971 0.485 -6.404 2.092 1.00 0.46 N ATOM 1303 CA VAL A1971 -0.804 -7.004 2.002 1.00 0.48 C ATOM 1304 C VAL A1971 -1.745 -6.370 3.015 1.00 0.45 C ATOM 1305 O VAL A1971 -1.470 -6.336 4.218 1.00 0.60 O ATOM 1306 CB VAL A1971 -0.733 -8.553 2.198 1.00 0.64 C ATOM 1307 CG1 VAL A1971 0.058 -9.184 1.071 1.00 0.73 C ATOM 1308 CG2 VAL A1971 -0.107 -8.932 3.539 1.00 0.74 C ATOM 0 H VAL A1971 1.033 -6.699 2.900 1.00 0.46 H new ATOM 0 HA VAL A1971 -1.193 -6.824 1.000 1.00 0.48 H new ATOM 0 HB VAL A1971 -1.756 -8.930 2.188 1.00 0.64 H new ATOM 0 HG11 VAL A1971 0.102 -10.263 1.217 1.00 0.73 H new ATOM 0 HG12 VAL A1971 -0.427 -8.966 0.120 1.00 0.73 H new ATOM 0 HG13 VAL A1971 1.069 -8.778 1.064 1.00 0.73 H new ATOM 0 HG21 VAL A1971 -0.078 -10.018 3.633 1.00 0.74 H new ATOM 0 HG22 VAL A1971 0.907 -8.536 3.592 1.00 0.74 H new ATOM 0 HG23 VAL A1971 -0.703 -8.514 4.350 1.00 0.74 H new ATOM 1318 N TYR A1972 -2.808 -5.824 2.533 1.00 0.38 N ATOM 1319 CA TYR A1972 -3.785 -5.224 3.391 1.00 0.39 C ATOM 1320 C TYR A1972 -5.073 -5.980 3.287 1.00 0.45 C ATOM 1321 O TYR A1972 -5.623 -6.158 2.188 1.00 0.55 O ATOM 1322 CB TYR A1972 -3.926 -3.717 3.137 1.00 0.43 C ATOM 1323 CG TYR A1972 -2.668 -2.956 3.529 1.00 0.56 C ATOM 1324 CD1 TYR A1972 -2.303 -2.868 4.860 1.00 0.75 C ATOM 1325 CD2 TYR A1972 -1.831 -2.365 2.583 1.00 0.79 C ATOM 1326 CE1 TYR A1972 -1.160 -2.215 5.251 1.00 0.97 C ATOM 1327 CE2 TYR A1972 -0.667 -1.710 2.972 1.00 0.98 C ATOM 1328 CZ TYR A1972 -0.344 -1.640 4.317 1.00 1.04 C ATOM 1329 OH TYR A1972 0.822 -1.020 4.733 1.00 1.27 O ATOM 0 H TYR A1972 -3.029 -5.778 1.538 1.00 0.38 H new ATOM 0 HA TYR A1972 -3.450 -5.296 4.426 1.00 0.39 H new ATOM 0 HB2 TYR A1972 -4.141 -3.545 2.082 1.00 0.43 H new ATOM 0 HB3 TYR A1972 -4.775 -3.331 3.702 1.00 0.43 H new ATOM 0 HD1 TYR A1972 -2.932 -3.324 5.610 1.00 0.75 H new ATOM 0 HD2 TYR A1972 -2.090 -2.416 1.536 1.00 0.79 H new ATOM 0 HE1 TYR A1972 -0.905 -2.156 6.299 1.00 0.97 H new ATOM 0 HE2 TYR A1972 -0.021 -1.260 2.232 1.00 0.98 H new ATOM 0 HH TYR A1972 1.222 -1.533 5.466 1.00 1.27 H new ATOM 1339 N GLU A1973 -5.531 -6.449 4.420 1.00 0.57 N ATOM 1340 CA GLU A1973 -6.646 -7.358 4.502 1.00 0.73 C ATOM 1341 C GLU A1973 -7.597 -6.964 5.613 1.00 0.58 C ATOM 1342 O GLU A1973 -7.229 -6.181 6.490 1.00 0.57 O ATOM 1343 CB GLU A1973 -6.097 -8.758 4.776 1.00 1.09 C ATOM 1344 CG GLU A1973 -5.169 -8.830 5.990 1.00 1.33 C ATOM 1345 CD GLU A1973 -4.555 -10.188 6.176 1.00 1.89 C ATOM 1346 OE1 GLU A1973 -5.278 -11.131 6.582 1.00 2.17 O ATOM 1347 OE2 GLU A1973 -3.350 -10.340 5.915 1.00 2.75 O ATOM 0 H GLU A1973 -5.133 -6.206 5.327 1.00 0.57 H new ATOM 0 HA GLU A1973 -7.200 -7.331 3.564 1.00 0.73 H new ATOM 0 HB2 GLU A1973 -6.932 -9.442 4.927 1.00 1.09 H new ATOM 0 HB3 GLU A1973 -5.556 -9.105 3.896 1.00 1.09 H new ATOM 0 HG2 GLU A1973 -4.376 -8.090 5.879 1.00 1.33 H new ATOM 0 HG3 GLU A1973 -5.730 -8.564 6.886 1.00 1.33 H new ATOM 1354 N ASP A1974 -8.816 -7.490 5.526 1.00 0.73 N ATOM 1355 CA ASP A1974 -9.873 -7.361 6.548 1.00 0.79 C ATOM 1356 C ASP A1974 -10.434 -5.956 6.620 1.00 0.83 C ATOM 1357 O ASP A1974 -9.865 -5.068 7.250 1.00 1.13 O ATOM 1358 CB ASP A1974 -9.409 -7.842 7.946 1.00 1.03 C ATOM 1359 CG ASP A1974 -10.536 -7.905 8.971 1.00 1.29 C ATOM 1360 OD1 ASP A1974 -11.210 -8.956 9.048 1.00 1.56 O ATOM 1361 OD2 ASP A1974 -10.745 -6.940 9.732 1.00 1.57 O ATOM 0 H ASP A1974 -9.114 -8.038 4.719 1.00 0.73 H new ATOM 0 HA ASP A1974 -10.678 -8.022 6.227 1.00 0.79 H new ATOM 0 HB2 ASP A1974 -8.959 -8.830 7.851 1.00 1.03 H new ATOM 0 HB3 ASP A1974 -8.632 -7.172 8.313 1.00 1.03 H new ATOM 1366 N GLY A1975 -11.514 -5.748 5.936 1.00 1.18 N ATOM 1367 CA GLY A1975 -12.186 -4.492 5.971 1.00 1.43 C ATOM 1368 C GLY A1975 -13.659 -4.710 6.036 1.00 1.27 C ATOM 1369 O GLY A1975 -14.200 -5.053 7.087 1.00 1.57 O ATOM 0 H GLY A1975 -11.954 -6.447 5.337 1.00 1.18 H new ATOM 0 HA2 GLY A1975 -11.856 -3.916 6.836 1.00 1.43 H new ATOM 0 HA3 GLY A1975 -11.934 -3.909 5.085 1.00 1.43 H new ATOM 1373 N ASP A1976 -14.312 -4.527 4.936 1.00 0.96 N ATOM 1374 CA ASP A1976 -15.717 -4.814 4.831 1.00 0.90 C ATOM 1375 C ASP A1976 -15.871 -6.110 4.092 1.00 0.95 C ATOM 1376 O ASP A1976 -15.232 -6.305 3.046 1.00 1.08 O ATOM 1377 CB ASP A1976 -16.497 -3.695 4.121 1.00 0.95 C ATOM 1378 CG ASP A1976 -16.525 -2.404 4.900 1.00 1.57 C ATOM 1379 OD1 ASP A1976 -17.063 -2.387 6.035 1.00 2.24 O ATOM 1380 OD2 ASP A1976 -16.007 -1.367 4.404 1.00 2.08 O ATOM 0 H ASP A1976 -13.890 -4.173 4.077 1.00 0.96 H new ATOM 0 HA ASP A1976 -16.135 -4.886 5.835 1.00 0.90 H new ATOM 0 HB2 ASP A1976 -16.050 -3.513 3.144 1.00 0.95 H new ATOM 0 HB3 ASP A1976 -17.520 -4.029 3.946 1.00 0.95 H new ATOM 1385 N PRO A1977 -16.643 -7.046 4.640 1.00 1.16 N ATOM 1386 CA PRO A1977 -16.863 -8.338 4.008 1.00 1.39 C ATOM 1387 C PRO A1977 -17.612 -8.193 2.688 1.00 1.45 C ATOM 1388 O PRO A1977 -18.790 -7.826 2.658 1.00 1.66 O ATOM 1389 CB PRO A1977 -17.695 -9.116 5.032 1.00 1.68 C ATOM 1390 CG PRO A1977 -18.310 -8.080 5.906 1.00 1.68 C ATOM 1391 CD PRO A1977 -17.353 -6.926 5.925 1.00 1.41 C ATOM 0 HA PRO A1977 -15.929 -8.841 3.757 1.00 1.39 H new ATOM 0 HB2 PRO A1977 -18.458 -9.720 4.541 1.00 1.68 H new ATOM 0 HB3 PRO A1977 -17.071 -9.798 5.609 1.00 1.68 H new ATOM 0 HG2 PRO A1977 -19.282 -7.773 5.521 1.00 1.68 H new ATOM 0 HG3 PRO A1977 -18.473 -8.467 6.912 1.00 1.68 H new ATOM 0 HD2 PRO A1977 -17.875 -5.973 6.007 1.00 1.41 H new ATOM 0 HD3 PRO A1977 -16.667 -6.988 6.770 1.00 1.41 H new ATOM 1399 N CYS A1978 -16.910 -8.428 1.614 1.00 1.46 N ATOM 1400 CA CYS A1978 -17.470 -8.342 0.287 1.00 1.62 C ATOM 1401 C CYS A1978 -18.419 -9.501 0.067 1.00 1.87 C ATOM 1402 O CYS A1978 -18.226 -10.540 0.661 1.00 1.90 O ATOM 1403 CB CYS A1978 -16.339 -8.352 -0.736 1.00 1.58 C ATOM 1404 SG CYS A1978 -15.172 -6.977 -0.525 1.00 1.81 S ATOM 0 H CYS A1978 -15.924 -8.687 1.632 1.00 1.46 H new ATOM 0 HA CYS A1978 -18.031 -7.415 0.171 1.00 1.62 H new ATOM 0 HB2 CYS A1978 -15.797 -9.295 -0.660 1.00 1.58 H new ATOM 0 HB3 CYS A1978 -16.764 -8.309 -1.739 1.00 1.58 H new ATOM 1409 N PRO A1979 -19.457 -9.342 -0.791 1.00 2.20 N ATOM 1410 CA PRO A1979 -20.491 -10.378 -1.033 1.00 2.55 C ATOM 1411 C PRO A1979 -19.918 -11.769 -1.345 1.00 2.56 C ATOM 1412 O PRO A1979 -20.479 -12.793 -0.940 1.00 2.76 O ATOM 1413 CB PRO A1979 -21.274 -9.836 -2.249 1.00 2.93 C ATOM 1414 CG PRO A1979 -20.467 -8.693 -2.771 1.00 2.90 C ATOM 1415 CD PRO A1979 -19.723 -8.141 -1.596 1.00 2.38 C ATOM 0 HA PRO A1979 -21.098 -10.533 -0.141 1.00 2.55 H new ATOM 0 HB2 PRO A1979 -21.399 -10.607 -3.010 1.00 2.93 H new ATOM 0 HB3 PRO A1979 -22.273 -9.510 -1.958 1.00 2.93 H new ATOM 0 HG2 PRO A1979 -19.778 -9.025 -3.548 1.00 2.90 H new ATOM 0 HG3 PRO A1979 -21.109 -7.934 -3.217 1.00 2.90 H new ATOM 0 HD2 PRO A1979 -18.802 -7.643 -1.897 1.00 2.38 H new ATOM 0 HD3 PRO A1979 -20.316 -7.409 -1.048 1.00 2.38 H new ATOM 1423 N THR A1980 -18.819 -11.793 -2.035 1.00 2.44 N ATOM 1424 CA THR A1980 -18.160 -12.965 -2.431 1.00 2.58 C ATOM 1425 C THR A1980 -17.058 -13.356 -1.445 1.00 2.52 C ATOM 1426 O THR A1980 -16.598 -14.507 -1.426 1.00 2.86 O ATOM 1427 CB THR A1980 -17.502 -12.597 -3.734 1.00 2.52 C ATOM 1428 OG1 THR A1980 -17.086 -11.202 -3.643 1.00 2.72 O ATOM 1429 CG2 THR A1980 -18.426 -12.798 -4.911 1.00 2.83 C ATOM 0 H THR A1980 -18.347 -10.944 -2.345 1.00 2.44 H new ATOM 0 HA THR A1980 -18.857 -13.801 -2.493 1.00 2.58 H new ATOM 0 HB THR A1980 -16.643 -13.248 -3.901 1.00 2.52 H new ATOM 0 HG1 THR A1980 -16.189 -11.153 -3.251 1.00 2.72 H new ATOM 0 HG21 THR A1980 -17.910 -12.520 -5.830 1.00 2.83 H new ATOM 0 HG22 THR A1980 -18.724 -13.845 -4.965 1.00 2.83 H new ATOM 0 HG23 THR A1980 -19.311 -12.174 -4.789 1.00 2.83 H new ATOM 1437 N ASP A1981 -16.689 -12.425 -0.595 1.00 2.25 N ATOM 1438 CA ASP A1981 -15.511 -12.582 0.215 1.00 2.32 C ATOM 1439 C ASP A1981 -15.776 -12.367 1.705 1.00 2.24 C ATOM 1440 O ASP A1981 -15.161 -11.509 2.343 1.00 2.36 O ATOM 1441 CB ASP A1981 -14.376 -11.637 -0.279 1.00 2.46 C ATOM 1442 CG ASP A1981 -13.988 -11.866 -1.734 1.00 2.87 C ATOM 1443 OD1 ASP A1981 -14.680 -11.326 -2.627 1.00 3.37 O ATOM 1444 OD2 ASP A1981 -13.001 -12.603 -2.024 1.00 3.20 O ATOM 0 H ASP A1981 -17.192 -11.550 -0.449 1.00 2.25 H new ATOM 0 HA ASP A1981 -15.192 -13.618 0.101 1.00 2.32 H new ATOM 0 HB2 ASP A1981 -14.695 -10.602 -0.154 1.00 2.46 H new ATOM 0 HB3 ASP A1981 -13.497 -11.777 0.350 1.00 2.46 H new ATOM 1449 N LEU A1982 -16.747 -13.075 2.247 1.00 2.24 N ATOM 1450 CA LEU A1982 -16.901 -13.098 3.691 1.00 2.35 C ATOM 1451 C LEU A1982 -16.195 -14.345 4.193 1.00 2.41 C ATOM 1452 O LEU A1982 -15.492 -14.343 5.215 1.00 2.56 O ATOM 1453 CB LEU A1982 -18.376 -13.146 4.167 1.00 2.55 C ATOM 1454 CG LEU A1982 -19.330 -12.041 3.696 1.00 2.64 C ATOM 1455 CD1 LEU A1982 -19.945 -12.377 2.358 1.00 2.83 C ATOM 1456 CD2 LEU A1982 -20.400 -11.763 4.733 1.00 2.91 C ATOM 0 H LEU A1982 -17.427 -13.630 1.727 1.00 2.24 H new ATOM 0 HA LEU A1982 -16.480 -12.173 4.085 1.00 2.35 H new ATOM 0 HB2 LEU A1982 -18.795 -14.102 3.854 1.00 2.55 H new ATOM 0 HB3 LEU A1982 -18.374 -13.140 5.257 1.00 2.55 H new ATOM 0 HG LEU A1982 -18.742 -11.132 3.570 1.00 2.64 H new ATOM 0 HD11 LEU A1982 -20.616 -11.573 2.054 1.00 2.83 H new ATOM 0 HD12 LEU A1982 -19.157 -12.493 1.614 1.00 2.83 H new ATOM 0 HD13 LEU A1982 -20.507 -13.307 2.439 1.00 2.83 H new ATOM 0 HD21 LEU A1982 -21.061 -10.976 4.371 1.00 2.91 H new ATOM 0 HD22 LEU A1982 -20.979 -12.669 4.911 1.00 2.91 H new ATOM 0 HD23 LEU A1982 -19.931 -11.444 5.664 1.00 2.91 H new ATOM 1468 N LYS A1983 -16.364 -15.407 3.425 1.00 2.40 N ATOM 1469 CA LYS A1983 -15.862 -16.734 3.757 1.00 2.57 C ATOM 1470 C LYS A1983 -14.414 -16.934 3.277 1.00 2.46 C ATOM 1471 O LYS A1983 -13.790 -17.971 3.532 1.00 2.62 O ATOM 1472 CB LYS A1983 -16.783 -17.776 3.129 1.00 2.75 C ATOM 1473 CG LYS A1983 -16.761 -17.760 1.615 1.00 2.91 C ATOM 1474 CD LYS A1983 -17.746 -18.750 1.004 1.00 3.23 C ATOM 1475 CE LYS A1983 -19.187 -18.411 1.359 1.00 3.77 C ATOM 1476 NZ LYS A1983 -20.145 -19.343 0.733 1.00 4.43 N ATOM 0 H LYS A1983 -16.863 -15.373 2.536 1.00 2.40 H new ATOM 0 HA LYS A1983 -15.854 -16.846 4.841 1.00 2.57 H new ATOM 0 HB2 LYS A1983 -16.492 -18.766 3.479 1.00 2.75 H new ATOM 0 HB3 LYS A1983 -17.803 -17.603 3.473 1.00 2.75 H new ATOM 0 HG2 LYS A1983 -16.995 -16.756 1.263 1.00 2.91 H new ATOM 0 HG3 LYS A1983 -15.755 -17.993 1.267 1.00 2.91 H new ATOM 0 HD2 LYS A1983 -17.631 -18.754 -0.080 1.00 3.23 H new ATOM 0 HD3 LYS A1983 -17.513 -19.756 1.353 1.00 3.23 H new ATOM 0 HE2 LYS A1983 -19.310 -18.438 2.442 1.00 3.77 H new ATOM 0 HE3 LYS A1983 -19.409 -17.393 1.039 1.00 3.77 H new ATOM 0 HZ1 LYS A1983 -21.114 -19.076 1.001 1.00 4.43 H new ATOM 0 HZ2 LYS A1983 -20.047 -19.299 -0.301 1.00 4.43 H new ATOM 0 HZ3 LYS A1983 -19.950 -20.311 1.058 1.00 4.43 H new ATOM 1490 N MET A1984 -13.892 -15.930 2.629 1.00 2.32 N ATOM 1491 CA MET A1984 -12.589 -15.916 2.060 1.00 2.29 C ATOM 1492 C MET A1984 -12.243 -14.477 1.937 1.00 2.18 C ATOM 1493 O MET A1984 -13.113 -13.678 1.736 1.00 2.40 O ATOM 1494 CB MET A1984 -12.573 -16.571 0.656 1.00 2.28 C ATOM 1495 CG MET A1984 -13.563 -15.958 -0.345 1.00 2.33 C ATOM 1496 SD MET A1984 -13.362 -16.582 -2.025 1.00 2.53 S ATOM 1497 CE MET A1984 -11.776 -15.864 -2.453 1.00 2.68 C ATOM 0 H MET A1984 -14.398 -15.057 2.480 1.00 2.32 H new ATOM 0 HA MET A1984 -11.885 -16.477 2.675 1.00 2.29 H new ATOM 0 HB2 MET A1984 -11.566 -16.495 0.245 1.00 2.28 H new ATOM 0 HB3 MET A1984 -12.794 -17.633 0.762 1.00 2.28 H new ATOM 0 HG2 MET A1984 -14.580 -16.161 -0.009 1.00 2.33 H new ATOM 0 HG3 MET A1984 -13.439 -14.875 -0.350 1.00 2.33 H new ATOM 0 HE1 MET A1984 -11.866 -15.316 -3.391 1.00 2.68 H new ATOM 0 HE2 MET A1984 -11.460 -15.182 -1.663 1.00 2.68 H new ATOM 0 HE3 MET A1984 -11.036 -16.657 -2.565 1.00 2.68 H new ATOM 1507 N LYS A1985 -11.047 -14.147 2.153 1.00 2.14 N ATOM 1508 CA LYS A1985 -10.601 -12.788 1.980 1.00 2.09 C ATOM 1509 C LYS A1985 -9.363 -12.754 1.135 1.00 1.89 C ATOM 1510 O LYS A1985 -8.274 -13.077 1.616 1.00 2.34 O ATOM 1511 CB LYS A1985 -10.329 -12.078 3.321 1.00 2.67 C ATOM 1512 CG LYS A1985 -11.555 -11.862 4.204 1.00 3.08 C ATOM 1513 CD LYS A1985 -11.202 -11.094 5.480 1.00 3.73 C ATOM 1514 CE LYS A1985 -10.217 -11.862 6.361 1.00 4.42 C ATOM 1515 NZ LYS A1985 -10.793 -13.125 6.869 1.00 4.89 N ATOM 0 H LYS A1985 -10.321 -14.795 2.458 1.00 2.14 H new ATOM 0 HA LYS A1985 -11.409 -12.251 1.483 1.00 2.09 H new ATOM 0 HB2 LYS A1985 -9.597 -12.661 3.880 1.00 2.67 H new ATOM 0 HB3 LYS A1985 -9.875 -11.109 3.115 1.00 2.67 H new ATOM 0 HG2 LYS A1985 -12.314 -11.313 3.646 1.00 3.08 H new ATOM 0 HG3 LYS A1985 -11.989 -12.827 4.467 1.00 3.08 H new ATOM 0 HD2 LYS A1985 -10.772 -10.128 5.214 1.00 3.73 H new ATOM 0 HD3 LYS A1985 -12.112 -10.893 6.045 1.00 3.73 H new ATOM 0 HE2 LYS A1985 -9.314 -12.080 5.790 1.00 4.42 H new ATOM 0 HE3 LYS A1985 -9.919 -11.236 7.202 1.00 4.42 H new ATOM 0 HZ1 LYS A1985 -10.147 -13.545 7.567 1.00 4.89 H new ATOM 0 HZ2 LYS A1985 -11.710 -12.932 7.319 1.00 4.89 H new ATOM 0 HZ3 LYS A1985 -10.928 -13.788 6.079 1.00 4.89 H new ATOM 1529 N HIS A1986 -9.502 -12.423 -0.118 1.00 1.63 N ATOM 1530 CA HIS A1986 -8.330 -12.244 -0.927 1.00 1.68 C ATOM 1531 C HIS A1986 -7.957 -10.789 -0.789 1.00 1.14 C ATOM 1532 O HIS A1986 -8.686 -9.903 -1.215 1.00 1.35 O ATOM 1533 CB HIS A1986 -8.565 -12.636 -2.378 1.00 2.46 C ATOM 1534 CG HIS A1986 -7.304 -12.760 -3.182 1.00 3.48 C ATOM 1535 ND1 HIS A1986 -6.870 -11.806 -4.054 1.00 4.38 N ATOM 1536 CD2 HIS A1986 -6.390 -13.751 -3.242 1.00 4.21 C ATOM 1537 CE1 HIS A1986 -5.754 -12.192 -4.614 1.00 5.37 C ATOM 1538 NE2 HIS A1986 -5.440 -13.362 -4.141 1.00 5.32 N ATOM 0 H HIS A1986 -10.393 -12.275 -0.593 1.00 1.63 H new ATOM 0 HA HIS A1986 -7.521 -12.894 -0.593 1.00 1.68 H new ATOM 0 HB2 HIS A1986 -9.098 -13.586 -2.406 1.00 2.46 H new ATOM 0 HB3 HIS A1986 -9.212 -11.893 -2.845 1.00 2.46 H new ATOM 0 HD1 HIS A1986 -7.345 -10.923 -4.241 1.00 4.38 H new ATOM 0 HD2 HIS A1986 -6.407 -14.676 -2.685 1.00 4.21 H new ATOM 0 HE1 HIS A1986 -5.188 -11.634 -5.346 1.00 5.37 H new ATOM 1547 N LYS A1987 -6.857 -10.557 -0.171 1.00 1.12 N ATOM 1548 CA LYS A1987 -6.475 -9.235 0.235 1.00 1.18 C ATOM 1549 C LYS A1987 -5.854 -8.402 -0.858 1.00 1.02 C ATOM 1550 O LYS A1987 -5.632 -8.869 -1.967 1.00 1.30 O ATOM 1551 CB LYS A1987 -5.597 -9.325 1.461 1.00 1.91 C ATOM 1552 CG LYS A1987 -4.393 -10.228 1.325 1.00 2.70 C ATOM 1553 CD LYS A1987 -3.887 -10.575 2.693 1.00 3.34 C ATOM 1554 CE LYS A1987 -2.728 -11.526 2.671 1.00 3.96 C ATOM 1555 NZ LYS A1987 -2.417 -11.981 4.033 1.00 4.45 N ATOM 0 H LYS A1987 -6.182 -11.281 0.075 1.00 1.12 H new ATOM 0 HA LYS A1987 -7.389 -8.696 0.482 1.00 1.18 H new ATOM 0 HB2 LYS A1987 -5.253 -8.323 1.716 1.00 1.91 H new ATOM 0 HB3 LYS A1987 -6.202 -9.676 2.297 1.00 1.91 H new ATOM 0 HG2 LYS A1987 -4.661 -11.134 0.782 1.00 2.70 H new ATOM 0 HG3 LYS A1987 -3.612 -9.731 0.750 1.00 2.70 H new ATOM 0 HD2 LYS A1987 -3.588 -9.661 3.206 1.00 3.34 H new ATOM 0 HD3 LYS A1987 -4.699 -11.015 3.273 1.00 3.34 H new ATOM 0 HE2 LYS A1987 -2.963 -12.382 2.039 1.00 3.96 H new ATOM 0 HE3 LYS A1987 -1.856 -11.038 2.235 1.00 3.96 H new ATOM 0 HZ1 LYS A1987 -1.431 -11.742 4.262 1.00 4.45 H new ATOM 0 HZ2 LYS A1987 -3.053 -11.512 4.709 1.00 4.45 H new ATOM 0 HZ3 LYS A1987 -2.547 -13.011 4.093 1.00 4.45 H new ATOM 1569 N SER A1988 -5.562 -7.171 -0.521 1.00 0.68 N ATOM 1570 CA SER A1988 -5.022 -6.234 -1.447 1.00 0.60 C ATOM 1571 C SER A1988 -3.507 -6.252 -1.374 1.00 0.50 C ATOM 1572 O SER A1988 -2.930 -6.369 -0.283 1.00 0.57 O ATOM 1573 CB SER A1988 -5.574 -4.857 -1.129 1.00 0.64 C ATOM 1574 OG SER A1988 -7.002 -4.864 -1.234 1.00 1.41 O ATOM 0 H SER A1988 -5.698 -6.796 0.418 1.00 0.68 H new ATOM 0 HA SER A1988 -5.308 -6.500 -2.464 1.00 0.60 H new ATOM 0 HB2 SER A1988 -5.277 -4.561 -0.123 1.00 0.64 H new ATOM 0 HB3 SER A1988 -5.155 -4.121 -1.815 1.00 0.64 H new ATOM 0 HG SER A1988 -7.297 -4.075 -1.736 1.00 1.41 H new ATOM 1580 N TYR A1989 -2.883 -6.146 -2.521 1.00 0.51 N ATOM 1581 CA TYR A1989 -1.460 -6.248 -2.650 1.00 0.49 C ATOM 1582 C TYR A1989 -0.876 -4.965 -3.166 1.00 0.41 C ATOM 1583 O TYR A1989 -1.187 -4.519 -4.283 1.00 0.42 O ATOM 1584 CB TYR A1989 -1.098 -7.372 -3.612 1.00 0.63 C ATOM 1585 CG TYR A1989 -1.331 -8.766 -3.091 1.00 0.75 C ATOM 1586 CD1 TYR A1989 -2.585 -9.357 -3.148 1.00 1.18 C ATOM 1587 CD2 TYR A1989 -0.290 -9.490 -2.538 1.00 1.69 C ATOM 1588 CE1 TYR A1989 -2.789 -10.630 -2.667 1.00 1.40 C ATOM 1589 CE2 TYR A1989 -0.486 -10.761 -2.056 1.00 2.13 C ATOM 1590 CZ TYR A1989 -1.736 -11.326 -2.122 1.00 1.66 C ATOM 1591 OH TYR A1989 -1.930 -12.599 -1.632 1.00 2.20 O ATOM 0 H TYR A1989 -3.364 -5.983 -3.405 1.00 0.51 H new ATOM 0 HA TYR A1989 -1.051 -6.458 -1.662 1.00 0.49 H new ATOM 0 HB2 TYR A1989 -1.674 -7.243 -4.528 1.00 0.63 H new ATOM 0 HB3 TYR A1989 -0.046 -7.273 -3.881 1.00 0.63 H new ATOM 0 HD1 TYR A1989 -3.412 -8.810 -3.576 1.00 1.18 H new ATOM 0 HD2 TYR A1989 0.694 -9.048 -2.484 1.00 1.69 H new ATOM 0 HE1 TYR A1989 -3.770 -11.079 -2.717 1.00 1.40 H new ATOM 0 HE2 TYR A1989 0.338 -11.313 -1.628 1.00 2.13 H new ATOM 0 HH TYR A1989 -1.083 -12.948 -1.284 1.00 2.20 H new ATOM 1601 N PHE A1990 -0.058 -4.363 -2.372 1.00 0.40 N ATOM 1602 CA PHE A1990 0.650 -3.202 -2.779 1.00 0.40 C ATOM 1603 C PHE A1990 2.098 -3.642 -2.960 1.00 0.40 C ATOM 1604 O PHE A1990 2.746 -4.059 -2.006 1.00 0.51 O ATOM 1605 CB PHE A1990 0.545 -2.109 -1.708 1.00 0.49 C ATOM 1606 CG PHE A1990 0.774 -0.711 -2.223 1.00 0.84 C ATOM 1607 CD1 PHE A1990 1.802 -0.461 -3.113 1.00 1.31 C ATOM 1608 CD2 PHE A1990 -0.029 0.349 -1.825 1.00 1.45 C ATOM 1609 CE1 PHE A1990 2.023 0.809 -3.593 1.00 2.02 C ATOM 1610 CE2 PHE A1990 0.189 1.615 -2.301 1.00 2.10 C ATOM 1611 CZ PHE A1990 1.176 1.865 -3.150 1.00 2.31 C ATOM 0 H PHE A1990 0.138 -4.665 -1.418 1.00 0.40 H new ATOM 0 HA PHE A1990 0.243 -2.783 -3.699 1.00 0.40 H new ATOM 0 HB2 PHE A1990 -0.444 -2.158 -1.252 1.00 0.49 H new ATOM 0 HB3 PHE A1990 1.270 -2.317 -0.921 1.00 0.49 H new ATOM 0 HD1 PHE A1990 2.439 -1.272 -3.435 1.00 1.31 H new ATOM 0 HD2 PHE A1990 -0.837 0.173 -1.130 1.00 1.45 H new ATOM 0 HE1 PHE A1990 2.823 1.002 -4.292 1.00 2.02 H new ATOM 0 HE2 PHE A1990 -0.453 2.422 -1.980 1.00 2.10 H new ATOM 0 HZ PHE A1990 1.338 2.871 -3.507 1.00 2.31 H new ATOM 1621 N SER A1991 2.568 -3.617 -4.168 1.00 0.35 N ATOM 1622 CA SER A1991 3.901 -4.061 -4.462 1.00 0.36 C ATOM 1623 C SER A1991 4.873 -2.884 -4.528 1.00 0.40 C ATOM 1624 O SER A1991 4.748 -2.010 -5.383 1.00 0.55 O ATOM 1625 CB SER A1991 3.888 -4.825 -5.781 1.00 0.36 C ATOM 1626 OG SER A1991 2.898 -5.849 -5.737 1.00 1.09 O ATOM 0 H SER A1991 2.043 -3.290 -4.979 1.00 0.35 H new ATOM 0 HA SER A1991 4.243 -4.718 -3.663 1.00 0.36 H new ATOM 0 HB2 SER A1991 3.681 -4.142 -6.605 1.00 0.36 H new ATOM 0 HB3 SER A1991 4.869 -5.263 -5.968 1.00 0.36 H new ATOM 0 HG SER A1991 2.893 -6.336 -6.588 1.00 1.09 H new ATOM 1632 N PHE A1992 5.796 -2.854 -3.620 1.00 0.36 N ATOM 1633 CA PHE A1992 6.832 -1.857 -3.608 1.00 0.37 C ATOM 1634 C PHE A1992 8.082 -2.455 -4.185 1.00 0.39 C ATOM 1635 O PHE A1992 8.559 -3.491 -3.728 1.00 0.40 O ATOM 1636 CB PHE A1992 7.095 -1.329 -2.205 1.00 0.40 C ATOM 1637 CG PHE A1992 6.015 -0.454 -1.661 1.00 0.48 C ATOM 1638 CD1 PHE A1992 4.908 -1.013 -1.054 1.00 0.58 C ATOM 1639 CD2 PHE A1992 6.095 0.913 -1.762 1.00 0.56 C ATOM 1640 CE1 PHE A1992 3.899 -0.224 -0.561 1.00 0.71 C ATOM 1641 CE2 PHE A1992 5.091 1.712 -1.271 1.00 0.68 C ATOM 1642 CZ PHE A1992 4.044 1.188 -0.637 1.00 0.74 C ATOM 0 H PHE A1992 5.857 -3.526 -2.855 1.00 0.36 H new ATOM 0 HA PHE A1992 6.507 -1.009 -4.211 1.00 0.37 H new ATOM 0 HB2 PHE A1992 7.233 -2.175 -1.532 1.00 0.40 H new ATOM 0 HB3 PHE A1992 8.030 -0.770 -2.210 1.00 0.40 H new ATOM 0 HD1 PHE A1992 4.835 -2.087 -0.966 1.00 0.58 H new ATOM 0 HD2 PHE A1992 6.956 1.365 -2.232 1.00 0.56 H new ATOM 0 HE1 PHE A1992 3.015 -0.666 -0.125 1.00 0.71 H new ATOM 0 HE2 PHE A1992 5.152 2.782 -1.401 1.00 0.68 H new ATOM 0 HZ PHE A1992 3.307 1.834 -0.182 1.00 0.74 H new ATOM 1652 N VAL A1993 8.596 -1.828 -5.178 1.00 0.44 N ATOM 1653 CA VAL A1993 9.741 -2.329 -5.875 1.00 0.51 C ATOM 1654 C VAL A1993 10.738 -1.186 -6.085 1.00 0.53 C ATOM 1655 O VAL A1993 10.337 -0.023 -6.097 1.00 0.58 O ATOM 1656 CB VAL A1993 9.290 -3.003 -7.215 1.00 0.59 C ATOM 1657 CG1 VAL A1993 8.490 -2.052 -8.078 1.00 0.76 C ATOM 1658 CG2 VAL A1993 10.453 -3.590 -7.986 1.00 0.91 C ATOM 0 H VAL A1993 8.237 -0.944 -5.540 1.00 0.44 H new ATOM 0 HA VAL A1993 10.246 -3.099 -5.291 1.00 0.51 H new ATOM 0 HB VAL A1993 8.639 -3.832 -6.938 1.00 0.59 H new ATOM 0 HG11 VAL A1993 8.195 -2.556 -8.998 1.00 0.76 H new ATOM 0 HG12 VAL A1993 7.599 -1.733 -7.538 1.00 0.76 H new ATOM 0 HG13 VAL A1993 9.099 -1.181 -8.320 1.00 0.76 H new ATOM 0 HG21 VAL A1993 10.087 -4.045 -8.906 1.00 0.91 H new ATOM 0 HG22 VAL A1993 11.164 -2.800 -8.229 1.00 0.91 H new ATOM 0 HG23 VAL A1993 10.947 -4.348 -7.378 1.00 0.91 H new ATOM 1668 N CYS A1994 12.014 -1.524 -6.196 1.00 0.59 N ATOM 1669 CA CYS A1994 13.101 -0.554 -6.330 1.00 0.67 C ATOM 1670 C CYS A1994 12.910 0.415 -7.507 1.00 0.65 C ATOM 1671 O CYS A1994 12.400 0.046 -8.571 1.00 0.84 O ATOM 1672 CB CYS A1994 14.459 -1.281 -6.470 1.00 0.88 C ATOM 1673 SG CYS A1994 15.921 -0.170 -6.651 1.00 1.47 S ATOM 0 H CYS A1994 12.333 -2.493 -6.196 1.00 0.59 H new ATOM 0 HA CYS A1994 13.088 0.044 -5.419 1.00 0.67 H new ATOM 0 HB2 CYS A1994 14.608 -1.913 -5.595 1.00 0.88 H new ATOM 0 HB3 CYS A1994 14.413 -1.941 -7.336 1.00 0.88 H new ATOM 1678 N LYS A1995 13.233 1.666 -7.251 1.00 0.77 N ATOM 1679 CA LYS A1995 13.305 2.713 -8.242 1.00 0.93 C ATOM 1680 C LYS A1995 14.518 3.564 -7.851 1.00 1.05 C ATOM 1681 O LYS A1995 15.028 3.412 -6.740 1.00 1.39 O ATOM 1682 CB LYS A1995 12.021 3.564 -8.195 1.00 1.37 C ATOM 1683 CG LYS A1995 11.806 4.568 -9.337 1.00 1.79 C ATOM 1684 CD LYS A1995 11.483 3.895 -10.667 1.00 2.03 C ATOM 1685 CE LYS A1995 11.339 4.908 -11.813 1.00 2.56 C ATOM 1686 NZ LYS A1995 10.238 5.890 -11.621 1.00 3.14 N ATOM 0 H LYS A1995 13.461 1.991 -6.311 1.00 0.77 H new ATOM 0 HA LYS A1995 13.400 2.316 -9.253 1.00 0.93 H new ATOM 0 HB2 LYS A1995 11.167 2.887 -8.174 1.00 1.37 H new ATOM 0 HB3 LYS A1995 12.014 4.115 -7.254 1.00 1.37 H new ATOM 0 HG2 LYS A1995 10.993 5.244 -9.071 1.00 1.79 H new ATOM 0 HG3 LYS A1995 12.703 5.177 -9.452 1.00 1.79 H new ATOM 0 HD2 LYS A1995 12.271 3.182 -10.912 1.00 2.03 H new ATOM 0 HD3 LYS A1995 10.558 3.327 -10.569 1.00 2.03 H new ATOM 0 HE2 LYS A1995 12.278 5.449 -11.925 1.00 2.56 H new ATOM 0 HE3 LYS A1995 11.170 4.366 -12.744 1.00 2.56 H new ATOM 0 HZ1 LYS A1995 10.071 6.403 -12.510 1.00 3.14 H new ATOM 0 HZ2 LYS A1995 9.370 5.389 -11.342 1.00 3.14 H new ATOM 0 HZ3 LYS A1995 10.502 6.566 -10.876 1.00 3.14 H new ATOM 1700 N SER A1996 14.987 4.396 -8.731 1.00 1.31 N ATOM 1701 CA SER A1996 16.015 5.383 -8.413 1.00 1.68 C ATOM 1702 C SER A1996 15.362 6.766 -8.522 1.00 1.67 C ATOM 1703 O SER A1996 16.014 7.786 -8.780 1.00 2.05 O ATOM 1704 CB SER A1996 17.158 5.264 -9.426 1.00 2.15 C ATOM 1705 OG SER A1996 17.699 3.941 -9.443 1.00 2.57 O ATOM 0 H SER A1996 14.675 4.422 -9.702 1.00 1.31 H new ATOM 0 HA SER A1996 16.419 5.227 -7.413 1.00 1.68 H new ATOM 0 HB2 SER A1996 16.795 5.524 -10.420 1.00 2.15 H new ATOM 0 HB3 SER A1996 17.943 5.978 -9.177 1.00 2.15 H new ATOM 0 HG SER A1996 18.425 3.893 -10.099 1.00 2.57 H new ATOM 1711 N ASP A1997 14.074 6.785 -8.248 1.00 1.56 N ATOM 1712 CA ASP A1997 13.244 7.939 -8.492 1.00 1.73 C ATOM 1713 C ASP A1997 12.181 8.156 -7.397 1.00 1.59 C ATOM 1714 O ASP A1997 12.432 8.903 -6.469 1.00 2.04 O ATOM 1715 CB ASP A1997 12.648 7.836 -9.909 1.00 1.99 C ATOM 1716 CG ASP A1997 11.496 8.747 -10.181 1.00 2.32 C ATOM 1717 OD1 ASP A1997 11.696 9.939 -10.415 1.00 2.65 O ATOM 1718 OD2 ASP A1997 10.352 8.240 -10.186 1.00 2.80 O ATOM 0 H ASP A1997 13.573 5.992 -7.847 1.00 1.56 H new ATOM 0 HA ASP A1997 13.862 8.835 -8.442 1.00 1.73 H new ATOM 0 HB2 ASP A1997 13.435 8.045 -10.633 1.00 1.99 H new ATOM 0 HB3 ASP A1997 12.326 6.808 -10.077 1.00 1.99 H new ATOM 1723 N ALA A1998 11.007 7.477 -7.503 1.00 1.32 N ATOM 1724 CA ALA A1998 9.887 7.594 -6.559 1.00 1.24 C ATOM 1725 C ALA A1998 9.227 8.981 -6.620 1.00 1.57 C ATOM 1726 O ALA A1998 8.417 9.346 -5.750 1.00 1.87 O ATOM 1727 CB ALA A1998 10.317 7.231 -5.150 1.00 1.44 C ATOM 0 H ALA A1998 10.820 6.824 -8.264 1.00 1.32 H new ATOM 0 HA ALA A1998 9.127 6.874 -6.863 1.00 1.24 H new ATOM 0 HB1 ALA A1998 9.467 7.327 -4.474 1.00 1.44 H new ATOM 0 HB2 ALA A1998 10.679 6.203 -5.134 1.00 1.44 H new ATOM 0 HB3 ALA A1998 11.114 7.902 -4.829 1.00 1.44 H new ATOM 1733 N GLY A1999 9.505 9.703 -7.697 1.00 2.05 N ATOM 1734 CA GLY A1999 9.002 11.040 -7.859 1.00 2.88 C ATOM 1735 C GLY A1999 9.533 11.959 -6.782 1.00 2.81 C ATOM 1736 O GLY A1999 10.730 11.946 -6.477 1.00 3.07 O ATOM 0 H GLY A1999 10.081 9.373 -8.471 1.00 2.05 H new ATOM 0 HA2 GLY A1999 9.287 11.422 -8.839 1.00 2.88 H new ATOM 0 HA3 GLY A1999 7.913 11.028 -7.826 1.00 2.88 H new ATOM 1740 N ASP A2000 8.670 12.746 -6.217 1.00 2.90 N ATOM 1741 CA ASP A2000 9.045 13.636 -5.128 1.00 3.13 C ATOM 1742 C ASP A2000 8.131 13.417 -3.935 1.00 2.60 C ATOM 1743 O ASP A2000 8.555 13.475 -2.781 1.00 2.99 O ATOM 1744 CB ASP A2000 8.957 15.098 -5.590 1.00 3.84 C ATOM 1745 CG ASP A2000 9.311 16.093 -4.505 1.00 3.99 C ATOM 1746 OD1 ASP A2000 10.521 16.294 -4.219 1.00 4.30 O ATOM 1747 OD2 ASP A2000 8.393 16.672 -3.896 1.00 4.11 O ATOM 0 H ASP A2000 7.688 12.800 -6.486 1.00 2.90 H new ATOM 0 HA ASP A2000 10.071 13.416 -4.833 1.00 3.13 H new ATOM 0 HB2 ASP A2000 9.625 15.244 -6.439 1.00 3.84 H new ATOM 0 HB3 ASP A2000 7.945 15.300 -5.942 1.00 3.84 H new ATOM 1752 N ASP A2001 6.884 13.123 -4.235 1.00 2.08 N ATOM 1753 CA ASP A2001 5.838 12.986 -3.225 1.00 1.96 C ATOM 1754 C ASP A2001 5.577 11.545 -2.870 1.00 1.77 C ATOM 1755 O ASP A2001 4.743 11.276 -2.002 1.00 2.29 O ATOM 1756 CB ASP A2001 4.518 13.568 -3.753 1.00 2.29 C ATOM 1757 CG ASP A2001 4.597 15.025 -4.113 1.00 2.96 C ATOM 1758 OD1 ASP A2001 4.488 15.875 -3.210 1.00 3.70 O ATOM 1759 OD2 ASP A2001 4.763 15.349 -5.315 1.00 3.24 O ATOM 0 H ASP A2001 6.558 12.970 -5.189 1.00 2.08 H new ATOM 0 HA ASP A2001 6.187 13.520 -2.342 1.00 1.96 H new ATOM 0 HB2 ASP A2001 4.209 13.003 -4.632 1.00 2.29 H new ATOM 0 HB3 ASP A2001 3.744 13.432 -2.998 1.00 2.29 H new ATOM 1764 N SER A2002 6.285 10.626 -3.530 1.00 1.56 N ATOM 1765 CA SER A2002 6.028 9.195 -3.409 1.00 1.44 C ATOM 1766 C SER A2002 4.579 8.887 -3.808 1.00 1.26 C ATOM 1767 O SER A2002 3.683 8.744 -2.972 1.00 1.36 O ATOM 1768 CB SER A2002 6.385 8.654 -2.018 1.00 1.64 C ATOM 1769 OG SER A2002 7.768 8.833 -1.754 1.00 1.88 O ATOM 0 H SER A2002 7.052 10.856 -4.162 1.00 1.56 H new ATOM 0 HA SER A2002 6.686 8.670 -4.101 1.00 1.44 H new ATOM 0 HB2 SER A2002 5.795 9.168 -1.259 1.00 1.64 H new ATOM 0 HB3 SER A2002 6.131 7.596 -1.957 1.00 1.64 H new ATOM 0 HG SER A2002 7.979 8.484 -0.863 1.00 1.88 H new ATOM 1775 N GLN A2003 4.371 8.834 -5.100 1.00 1.23 N ATOM 1776 CA GLN A2003 3.056 8.714 -5.680 1.00 1.09 C ATOM 1777 C GLN A2003 2.757 7.300 -6.229 1.00 0.88 C ATOM 1778 O GLN A2003 3.233 6.919 -7.298 1.00 1.00 O ATOM 1779 CB GLN A2003 2.882 9.787 -6.749 1.00 1.33 C ATOM 1780 CG GLN A2003 4.031 9.829 -7.768 1.00 1.53 C ATOM 1781 CD GLN A2003 3.858 10.912 -8.790 1.00 1.86 C ATOM 1782 OE1 GLN A2003 4.322 12.041 -8.609 1.00 2.51 O ATOM 1783 NE2 GLN A2003 3.167 10.608 -9.846 1.00 1.74 N ATOM 0 H GLN A2003 5.122 8.874 -5.789 1.00 1.23 H new ATOM 0 HA GLN A2003 2.324 8.869 -4.887 1.00 1.09 H new ATOM 0 HB2 GLN A2003 1.945 9.614 -7.277 1.00 1.33 H new ATOM 0 HB3 GLN A2003 2.800 10.760 -6.265 1.00 1.33 H new ATOM 0 HG2 GLN A2003 4.973 9.979 -7.241 1.00 1.53 H new ATOM 0 HG3 GLN A2003 4.099 8.866 -8.273 1.00 1.53 H new ATOM 0 HE21 GLN A2003 2.800 9.663 -9.961 1.00 1.74 H new ATOM 0 HE22 GLN A2003 2.992 11.314 -10.561 1.00 1.74 H new ATOM 1792 N PRO A2004 1.950 6.528 -5.497 1.00 0.72 N ATOM 1793 CA PRO A2004 1.600 5.134 -5.843 1.00 0.61 C ATOM 1794 C PRO A2004 0.954 4.976 -7.220 1.00 0.60 C ATOM 1795 O PRO A2004 0.155 5.820 -7.655 1.00 0.74 O ATOM 1796 CB PRO A2004 0.577 4.764 -4.770 1.00 0.66 C ATOM 1797 CG PRO A2004 0.895 5.660 -3.640 1.00 0.77 C ATOM 1798 CD PRO A2004 1.291 6.952 -4.257 1.00 0.83 C ATOM 0 HA PRO A2004 2.493 4.510 -5.880 1.00 0.61 H new ATOM 0 HB2 PRO A2004 -0.443 4.916 -5.123 1.00 0.66 H new ATOM 0 HB3 PRO A2004 0.662 3.716 -4.483 1.00 0.66 H new ATOM 0 HG2 PRO A2004 0.033 5.786 -2.985 1.00 0.77 H new ATOM 0 HG3 PRO A2004 1.702 5.252 -3.031 1.00 0.77 H new ATOM 0 HD2 PRO A2004 0.428 7.588 -4.454 1.00 0.83 H new ATOM 0 HD3 PRO A2004 1.964 7.519 -3.614 1.00 0.83 H new ATOM 1806 N VAL A2005 1.295 3.898 -7.892 1.00 0.57 N ATOM 1807 CA VAL A2005 0.715 3.580 -9.169 1.00 0.59 C ATOM 1808 C VAL A2005 -0.351 2.520 -8.956 1.00 0.59 C ATOM 1809 O VAL A2005 -0.074 1.432 -8.415 1.00 0.62 O ATOM 1810 CB VAL A2005 1.786 3.067 -10.177 1.00 0.66 C ATOM 1811 CG1 VAL A2005 1.162 2.672 -11.511 1.00 0.73 C ATOM 1812 CG2 VAL A2005 2.862 4.119 -10.385 1.00 0.69 C ATOM 0 H VAL A2005 1.983 3.220 -7.564 1.00 0.57 H new ATOM 0 HA VAL A2005 0.279 4.483 -9.596 1.00 0.59 H new ATOM 0 HB VAL A2005 2.241 2.173 -9.750 1.00 0.66 H new ATOM 0 HG11 VAL A2005 1.941 2.320 -12.187 1.00 0.73 H new ATOM 0 HG12 VAL A2005 0.434 1.877 -11.351 1.00 0.73 H new ATOM 0 HG13 VAL A2005 0.665 3.537 -11.950 1.00 0.73 H new ATOM 0 HG21 VAL A2005 3.603 3.746 -11.092 1.00 0.69 H new ATOM 0 HG22 VAL A2005 2.410 5.029 -10.780 1.00 0.69 H new ATOM 0 HG23 VAL A2005 3.346 4.338 -9.433 1.00 0.69 H new ATOM 1822 N PHE A2006 -1.561 2.847 -9.309 1.00 0.62 N ATOM 1823 CA PHE A2006 -2.645 1.925 -9.161 1.00 0.65 C ATOM 1824 C PHE A2006 -2.816 1.149 -10.443 1.00 0.63 C ATOM 1825 O PHE A2006 -2.729 1.719 -11.539 1.00 0.71 O ATOM 1826 CB PHE A2006 -3.960 2.646 -8.760 1.00 0.76 C ATOM 1827 CG PHE A2006 -4.530 3.605 -9.781 1.00 0.86 C ATOM 1828 CD1 PHE A2006 -4.028 4.890 -9.910 1.00 0.91 C ATOM 1829 CD2 PHE A2006 -5.575 3.213 -10.611 1.00 1.01 C ATOM 1830 CE1 PHE A2006 -4.553 5.761 -10.841 1.00 1.08 C ATOM 1831 CE2 PHE A2006 -6.103 4.080 -11.542 1.00 1.17 C ATOM 1832 CZ PHE A2006 -5.590 5.355 -11.658 1.00 1.21 C ATOM 0 H PHE A2006 -1.820 3.751 -9.703 1.00 0.62 H new ATOM 0 HA PHE A2006 -2.409 1.233 -8.352 1.00 0.65 H new ATOM 0 HB2 PHE A2006 -4.714 1.889 -8.542 1.00 0.76 H new ATOM 0 HB3 PHE A2006 -3.782 3.195 -7.835 1.00 0.76 H new ATOM 0 HD1 PHE A2006 -3.217 5.213 -9.274 1.00 0.91 H new ATOM 0 HD2 PHE A2006 -5.978 2.215 -10.524 1.00 1.01 H new ATOM 0 HE1 PHE A2006 -4.154 6.760 -10.931 1.00 1.08 H new ATOM 0 HE2 PHE A2006 -6.916 3.763 -12.179 1.00 1.17 H new ATOM 0 HZ PHE A2006 -6.000 6.037 -12.389 1.00 1.21 H new ATOM 1842 N LEU A2007 -2.997 -0.132 -10.326 1.00 0.62 N ATOM 1843 CA LEU A2007 -3.245 -0.944 -11.483 1.00 0.71 C ATOM 1844 C LEU A2007 -4.733 -1.040 -11.681 1.00 0.81 C ATOM 1845 O LEU A2007 -5.271 -0.517 -12.658 1.00 0.97 O ATOM 1846 CB LEU A2007 -2.609 -2.355 -11.373 1.00 0.81 C ATOM 1847 CG LEU A2007 -1.065 -2.460 -11.499 1.00 0.85 C ATOM 1848 CD1 LEU A2007 -0.341 -1.751 -10.366 1.00 1.29 C ATOM 1849 CD2 LEU A2007 -0.638 -3.916 -11.572 1.00 1.10 C ATOM 0 H LEU A2007 -2.978 -0.639 -9.441 1.00 0.62 H new ATOM 0 HA LEU A2007 -2.774 -0.473 -12.346 1.00 0.71 H new ATOM 0 HB2 LEU A2007 -2.897 -2.779 -10.411 1.00 0.81 H new ATOM 0 HB3 LEU A2007 -3.053 -2.984 -12.145 1.00 0.81 H new ATOM 0 HG LEU A2007 -0.784 -1.956 -12.424 1.00 0.85 H new ATOM 0 HD11 LEU A2007 0.736 -1.854 -10.501 1.00 1.29 H new ATOM 0 HD12 LEU A2007 -0.607 -0.694 -10.369 1.00 1.29 H new ATOM 0 HD13 LEU A2007 -0.631 -2.196 -9.414 1.00 1.29 H new ATOM 0 HD21 LEU A2007 0.447 -3.973 -11.660 1.00 1.10 H new ATOM 0 HD22 LEU A2007 -0.956 -4.434 -10.668 1.00 1.10 H new ATOM 0 HD23 LEU A2007 -1.098 -4.387 -12.441 1.00 1.10 H new ATOM 1861 N SER A2008 -5.396 -1.650 -10.725 1.00 0.80 N ATOM 1862 CA SER A2008 -6.822 -1.822 -10.750 1.00 0.99 C ATOM 1863 C SER A2008 -7.311 -2.354 -9.407 1.00 0.80 C ATOM 1864 O SER A2008 -6.548 -2.982 -8.661 1.00 0.64 O ATOM 1865 CB SER A2008 -7.215 -2.776 -11.897 1.00 1.31 C ATOM 1866 OG SER A2008 -6.354 -3.915 -11.931 1.00 1.75 O ATOM 0 H SER A2008 -4.949 -2.045 -9.898 1.00 0.80 H new ATOM 0 HA SER A2008 -7.297 -0.857 -10.926 1.00 0.99 H new ATOM 0 HB2 SER A2008 -8.248 -3.100 -11.768 1.00 1.31 H new ATOM 0 HB3 SER A2008 -7.163 -2.247 -12.849 1.00 1.31 H new ATOM 0 HG SER A2008 -6.623 -4.507 -12.665 1.00 1.75 H new ATOM 1872 N PHE A2009 -8.518 -2.020 -9.067 1.00 0.90 N ATOM 1873 CA PHE A2009 -9.174 -2.559 -7.909 1.00 0.77 C ATOM 1874 C PHE A2009 -10.229 -3.535 -8.375 1.00 0.80 C ATOM 1875 O PHE A2009 -11.162 -3.155 -9.098 1.00 0.93 O ATOM 1876 CB PHE A2009 -9.807 -1.434 -7.067 1.00 0.85 C ATOM 1877 CG PHE A2009 -10.747 -1.918 -5.987 1.00 0.77 C ATOM 1878 CD1 PHE A2009 -10.259 -2.613 -4.891 1.00 0.72 C ATOM 1879 CD2 PHE A2009 -12.099 -1.662 -6.056 1.00 1.14 C ATOM 1880 CE1 PHE A2009 -11.106 -3.043 -3.892 1.00 0.81 C ATOM 1881 CE2 PHE A2009 -12.955 -2.090 -5.062 1.00 1.16 C ATOM 1882 CZ PHE A2009 -12.491 -2.833 -4.028 1.00 0.87 C ATOM 0 H PHE A2009 -9.086 -1.355 -9.592 1.00 0.90 H new ATOM 0 HA PHE A2009 -8.448 -3.070 -7.276 1.00 0.77 H new ATOM 0 HB2 PHE A2009 -9.011 -0.851 -6.604 1.00 0.85 H new ATOM 0 HB3 PHE A2009 -10.351 -0.762 -7.731 1.00 0.85 H new ATOM 0 HD1 PHE A2009 -9.202 -2.820 -4.819 1.00 0.72 H new ATOM 0 HD2 PHE A2009 -12.495 -1.118 -6.901 1.00 1.14 H new ATOM 0 HE1 PHE A2009 -10.711 -3.535 -3.015 1.00 0.81 H new ATOM 0 HE2 PHE A2009 -14.002 -1.831 -5.108 1.00 1.16 H new ATOM 0 HZ PHE A2009 -13.179 -3.261 -3.314 1.00 0.87 H new ATOM 1892 N ASP A2010 -10.076 -4.767 -8.002 1.00 0.74 N ATOM 1893 CA ASP A2010 -11.029 -5.785 -8.364 1.00 0.83 C ATOM 1894 C ASP A2010 -12.121 -5.877 -7.314 1.00 0.88 C ATOM 1895 O ASP A2010 -11.832 -5.971 -6.135 1.00 0.97 O ATOM 1896 CB ASP A2010 -10.347 -7.141 -8.538 1.00 0.97 C ATOM 1897 CG ASP A2010 -11.355 -8.233 -8.748 1.00 1.63 C ATOM 1898 OD1 ASP A2010 -11.804 -8.410 -9.881 1.00 2.01 O ATOM 1899 OD2 ASP A2010 -11.658 -8.975 -7.790 1.00 2.43 O ATOM 0 H ASP A2010 -9.293 -5.101 -7.440 1.00 0.74 H new ATOM 0 HA ASP A2010 -11.476 -5.507 -9.318 1.00 0.83 H new ATOM 0 HB2 ASP A2010 -9.667 -7.102 -9.389 1.00 0.97 H new ATOM 0 HB3 ASP A2010 -9.744 -7.363 -7.658 1.00 0.97 H new ATOM 1904 N GLU A2011 -13.366 -5.818 -7.747 1.00 1.03 N ATOM 1905 CA GLU A2011 -14.509 -5.893 -6.835 1.00 1.24 C ATOM 1906 C GLU A2011 -15.027 -7.332 -6.689 1.00 1.30 C ATOM 1907 O GLU A2011 -15.962 -7.587 -5.925 1.00 1.46 O ATOM 1908 CB GLU A2011 -15.660 -4.995 -7.310 1.00 1.52 C ATOM 1909 CG GLU A2011 -16.250 -5.408 -8.652 1.00 1.76 C ATOM 1910 CD GLU A2011 -17.497 -4.643 -9.005 1.00 2.09 C ATOM 1911 OE1 GLU A2011 -18.616 -5.084 -8.623 1.00 2.75 O ATOM 1912 OE2 GLU A2011 -17.399 -3.613 -9.691 1.00 2.23 O ATOM 0 H GLU A2011 -13.620 -5.718 -8.730 1.00 1.03 H new ATOM 0 HA GLU A2011 -14.154 -5.545 -5.865 1.00 1.24 H new ATOM 0 HB2 GLU A2011 -16.449 -5.005 -6.558 1.00 1.52 H new ATOM 0 HB3 GLU A2011 -15.301 -3.968 -7.382 1.00 1.52 H new ATOM 0 HG2 GLU A2011 -15.504 -5.257 -9.433 1.00 1.76 H new ATOM 0 HG3 GLU A2011 -16.478 -6.474 -8.630 1.00 1.76 H new ATOM 1919 N GLN A2012 -14.434 -8.256 -7.413 1.00 1.32 N ATOM 1920 CA GLN A2012 -14.923 -9.622 -7.454 1.00 1.52 C ATOM 1921 C GLN A2012 -14.366 -10.430 -6.286 1.00 1.49 C ATOM 1922 O GLN A2012 -15.048 -11.289 -5.731 1.00 1.71 O ATOM 1923 CB GLN A2012 -14.586 -10.257 -8.805 1.00 1.75 C ATOM 1924 CG GLN A2012 -15.118 -11.664 -9.001 1.00 2.10 C ATOM 1925 CD GLN A2012 -14.819 -12.213 -10.383 1.00 2.62 C ATOM 1926 OE1 GLN A2012 -14.640 -13.420 -10.556 1.00 3.40 O ATOM 1927 NE2 GLN A2012 -14.783 -11.356 -11.375 1.00 2.81 N ATOM 0 H GLN A2012 -13.607 -8.087 -7.986 1.00 1.32 H new ATOM 0 HA GLN A2012 -16.008 -9.618 -7.349 1.00 1.52 H new ATOM 0 HB2 GLN A2012 -14.981 -9.621 -9.597 1.00 1.75 H new ATOM 0 HB3 GLN A2012 -13.502 -10.275 -8.921 1.00 1.75 H new ATOM 0 HG2 GLN A2012 -14.680 -12.322 -8.250 1.00 2.10 H new ATOM 0 HG3 GLN A2012 -16.196 -11.667 -8.838 1.00 2.10 H new ATOM 0 HE21 GLN A2012 -14.935 -10.363 -11.197 1.00 2.81 H new ATOM 0 HE22 GLN A2012 -14.603 -11.682 -12.324 1.00 2.81 H new ATOM 1936 N THR A2013 -13.142 -10.171 -5.938 1.00 1.37 N ATOM 1937 CA THR A2013 -12.558 -10.777 -4.781 1.00 1.47 C ATOM 1938 C THR A2013 -11.900 -9.675 -3.915 1.00 1.37 C ATOM 1939 O THR A2013 -11.098 -9.939 -3.018 1.00 1.57 O ATOM 1940 CB THR A2013 -11.575 -11.933 -5.186 1.00 1.72 C ATOM 1941 OG1 THR A2013 -11.168 -12.712 -4.041 1.00 1.95 O ATOM 1942 CG2 THR A2013 -10.349 -11.413 -5.929 1.00 1.76 C ATOM 0 H THR A2013 -12.523 -9.538 -6.445 1.00 1.37 H new ATOM 0 HA THR A2013 -13.327 -11.255 -4.174 1.00 1.47 H new ATOM 0 HB THR A2013 -12.129 -12.580 -5.865 1.00 1.72 H new ATOM 0 HG1 THR A2013 -11.891 -12.724 -3.380 1.00 1.95 H new ATOM 0 HG21 THR A2013 -9.699 -12.249 -6.188 1.00 1.76 H new ATOM 0 HG22 THR A2013 -10.664 -10.903 -6.839 1.00 1.76 H new ATOM 0 HG23 THR A2013 -9.806 -10.715 -5.292 1.00 1.76 H new ATOM 1950 N CYS A2014 -12.300 -8.423 -4.213 1.00 1.20 N ATOM 1951 CA CYS A2014 -11.880 -7.209 -3.483 1.00 1.22 C ATOM 1952 C CYS A2014 -10.375 -7.075 -3.335 1.00 1.19 C ATOM 1953 O CYS A2014 -9.847 -6.755 -2.265 1.00 1.49 O ATOM 1954 CB CYS A2014 -12.617 -7.073 -2.159 1.00 1.49 C ATOM 1955 SG CYS A2014 -14.400 -6.739 -2.375 1.00 1.65 S ATOM 0 H CYS A2014 -12.937 -8.223 -4.984 1.00 1.20 H new ATOM 0 HA CYS A2014 -12.172 -6.363 -4.105 1.00 1.22 H new ATOM 0 HB2 CYS A2014 -12.491 -7.989 -1.582 1.00 1.49 H new ATOM 0 HB3 CYS A2014 -12.168 -6.266 -1.579 1.00 1.49 H new ATOM 1960 N THR A2015 -9.697 -7.271 -4.418 1.00 1.02 N ATOM 1961 CA THR A2015 -8.282 -7.192 -4.425 1.00 1.04 C ATOM 1962 C THR A2015 -7.812 -5.918 -5.106 1.00 0.96 C ATOM 1963 O THR A2015 -8.057 -5.695 -6.296 1.00 1.08 O ATOM 1964 CB THR A2015 -7.702 -8.420 -5.106 1.00 1.15 C ATOM 1965 OG1 THR A2015 -8.201 -9.572 -4.418 1.00 1.56 O ATOM 1966 CG2 THR A2015 -6.177 -8.415 -5.052 1.00 1.39 C ATOM 0 H THR A2015 -10.114 -7.491 -5.323 1.00 1.02 H new ATOM 0 HA THR A2015 -7.927 -7.163 -3.395 1.00 1.04 H new ATOM 0 HB THR A2015 -7.995 -8.427 -6.156 1.00 1.15 H new ATOM 0 HG1 THR A2015 -8.227 -9.392 -3.455 1.00 1.56 H new ATOM 0 HG21 THR A2015 -5.792 -9.306 -5.548 1.00 1.39 H new ATOM 0 HG22 THR A2015 -5.798 -7.527 -5.557 1.00 1.39 H new ATOM 0 HG23 THR A2015 -5.850 -8.408 -4.012 1.00 1.39 H new ATOM 1974 N SER A2016 -7.195 -5.076 -4.343 1.00 0.87 N ATOM 1975 CA SER A2016 -6.641 -3.865 -4.847 1.00 0.83 C ATOM 1976 C SER A2016 -5.201 -4.151 -5.307 1.00 0.71 C ATOM 1977 O SER A2016 -4.397 -4.702 -4.536 1.00 0.74 O ATOM 1978 CB SER A2016 -6.633 -2.845 -3.726 1.00 0.87 C ATOM 1979 OG SER A2016 -7.854 -2.858 -3.006 1.00 1.36 O ATOM 0 H SER A2016 -7.061 -5.212 -3.341 1.00 0.87 H new ATOM 0 HA SER A2016 -7.223 -3.482 -5.685 1.00 0.83 H new ATOM 0 HB2 SER A2016 -5.806 -3.055 -3.047 1.00 0.87 H new ATOM 0 HB3 SER A2016 -6.463 -1.850 -4.138 1.00 0.87 H new ATOM 0 HG SER A2016 -8.033 -1.963 -2.650 1.00 1.36 H new ATOM 1985 N TYR A2017 -4.899 -3.835 -6.548 1.00 0.64 N ATOM 1986 CA TYR A2017 -3.572 -4.052 -7.105 1.00 0.57 C ATOM 1987 C TYR A2017 -2.832 -2.735 -7.220 1.00 0.49 C ATOM 1988 O TYR A2017 -3.235 -1.847 -7.999 1.00 0.56 O ATOM 1989 CB TYR A2017 -3.661 -4.687 -8.496 1.00 0.71 C ATOM 1990 CG TYR A2017 -4.349 -6.025 -8.536 1.00 0.86 C ATOM 1991 CD1 TYR A2017 -3.639 -7.190 -8.319 1.00 0.92 C ATOM 1992 CD2 TYR A2017 -5.708 -6.122 -8.802 1.00 1.01 C ATOM 1993 CE1 TYR A2017 -4.260 -8.413 -8.363 1.00 1.09 C ATOM 1994 CE2 TYR A2017 -6.337 -7.344 -8.852 1.00 1.18 C ATOM 1995 CZ TYR A2017 -5.608 -8.486 -8.631 1.00 1.20 C ATOM 1996 OH TYR A2017 -6.225 -9.712 -8.686 1.00 1.38 O ATOM 0 H TYR A2017 -5.563 -3.421 -7.202 1.00 0.64 H new ATOM 0 HA TYR A2017 -3.036 -4.724 -6.435 1.00 0.57 H new ATOM 0 HB2 TYR A2017 -4.190 -4.002 -9.159 1.00 0.71 H new ATOM 0 HB3 TYR A2017 -2.652 -4.801 -8.893 1.00 0.71 H new ATOM 0 HD1 TYR A2017 -2.580 -7.138 -8.112 1.00 0.92 H new ATOM 0 HD2 TYR A2017 -6.281 -5.223 -8.973 1.00 1.01 H new ATOM 0 HE1 TYR A2017 -3.693 -9.315 -8.188 1.00 1.09 H new ATOM 0 HE2 TYR A2017 -7.394 -7.405 -9.063 1.00 1.18 H new ATOM 0 HH TYR A2017 -7.177 -9.590 -8.884 1.00 1.38 H new ATOM 2006 N PHE A2018 -1.783 -2.583 -6.452 1.00 0.39 N ATOM 2007 CA PHE A2018 -0.986 -1.378 -6.500 1.00 0.39 C ATOM 2008 C PHE A2018 0.462 -1.730 -6.629 1.00 0.36 C ATOM 2009 O PHE A2018 0.898 -2.795 -6.182 1.00 0.40 O ATOM 2010 CB PHE A2018 -1.182 -0.526 -5.252 1.00 0.47 C ATOM 2011 CG PHE A2018 -2.586 -0.121 -5.026 1.00 0.57 C ATOM 2012 CD1 PHE A2018 -3.150 0.879 -5.779 1.00 0.74 C ATOM 2013 CD2 PHE A2018 -3.341 -0.728 -4.050 1.00 0.74 C ATOM 2014 CE1 PHE A2018 -4.441 1.264 -5.562 1.00 0.89 C ATOM 2015 CE2 PHE A2018 -4.635 -0.343 -3.826 1.00 0.87 C ATOM 2016 CZ PHE A2018 -5.207 0.608 -4.629 1.00 0.87 C ATOM 0 H PHE A2018 -1.458 -3.280 -5.782 1.00 0.39 H new ATOM 0 HA PHE A2018 -1.312 -0.802 -7.366 1.00 0.39 H new ATOM 0 HB2 PHE A2018 -0.829 -1.082 -4.384 1.00 0.47 H new ATOM 0 HB3 PHE A2018 -0.563 0.368 -5.332 1.00 0.47 H new ATOM 0 HD1 PHE A2018 -2.568 1.364 -6.548 1.00 0.74 H new ATOM 0 HD2 PHE A2018 -2.908 -1.517 -3.454 1.00 0.74 H new ATOM 0 HE1 PHE A2018 -4.861 2.085 -6.124 1.00 0.89 H new ATOM 0 HE2 PHE A2018 -5.202 -0.786 -3.021 1.00 0.87 H new ATOM 0 HZ PHE A2018 -6.257 0.841 -4.529 1.00 0.87 H new ATOM 2026 N SER A2019 1.197 -0.878 -7.251 1.00 0.45 N ATOM 2027 CA SER A2019 2.603 -1.057 -7.406 1.00 0.47 C ATOM 2028 C SER A2019 3.286 0.295 -7.350 1.00 0.45 C ATOM 2029 O SER A2019 2.842 1.260 -7.985 1.00 0.49 O ATOM 2030 CB SER A2019 2.906 -1.786 -8.723 1.00 0.51 C ATOM 2031 OG SER A2019 2.322 -3.081 -8.722 1.00 1.24 O ATOM 0 H SER A2019 0.836 -0.023 -7.674 1.00 0.45 H new ATOM 0 HA SER A2019 2.988 -1.675 -6.595 1.00 0.47 H new ATOM 0 HB2 SER A2019 2.520 -1.208 -9.562 1.00 0.51 H new ATOM 0 HB3 SER A2019 3.984 -1.867 -8.861 1.00 0.51 H new ATOM 0 HG SER A2019 2.523 -3.531 -9.569 1.00 1.24 H new ATOM 2037 N TRP A2020 4.314 0.395 -6.576 1.00 0.52 N ATOM 2038 CA TRP A2020 5.022 1.612 -6.488 1.00 0.57 C ATOM 2039 C TRP A2020 6.511 1.371 -6.552 1.00 0.49 C ATOM 2040 O TRP A2020 7.103 0.722 -5.682 1.00 0.43 O ATOM 2041 CB TRP A2020 4.620 2.422 -5.240 1.00 0.69 C ATOM 2042 CG TRP A2020 5.199 3.822 -5.192 1.00 0.88 C ATOM 2043 CD1 TRP A2020 5.506 4.533 -4.072 1.00 0.81 C ATOM 2044 CD2 TRP A2020 5.548 4.677 -6.312 1.00 1.75 C ATOM 2045 NE1 TRP A2020 6.003 5.768 -4.417 1.00 1.00 N ATOM 2046 CE2 TRP A2020 6.049 5.869 -5.780 1.00 1.65 C ATOM 2047 CE3 TRP A2020 5.484 4.544 -7.710 1.00 2.75 C ATOM 2048 CZ2 TRP A2020 6.486 6.916 -6.583 1.00 2.41 C ATOM 2049 CZ3 TRP A2020 5.920 5.584 -8.499 1.00 3.55 C ATOM 2050 CH2 TRP A2020 6.415 6.755 -7.935 1.00 3.35 C ATOM 0 H TRP A2020 4.678 -0.360 -5.995 1.00 0.52 H new ATOM 0 HA TRP A2020 4.749 2.220 -7.351 1.00 0.57 H new ATOM 0 HB2 TRP A2020 3.533 2.489 -5.200 1.00 0.69 H new ATOM 0 HB3 TRP A2020 4.939 1.879 -4.350 1.00 0.69 H new ATOM 0 HD1 TRP A2020 5.378 4.179 -3.060 1.00 0.81 H new ATOM 0 HE1 TRP A2020 6.291 6.493 -3.761 1.00 1.00 H new ATOM 0 HE3 TRP A2020 5.099 3.640 -8.158 1.00 2.75 H new ATOM 0 HZ2 TRP A2020 6.870 7.828 -6.150 1.00 2.41 H new ATOM 0 HZ3 TRP A2020 5.877 5.489 -9.574 1.00 3.55 H new ATOM 0 HH2 TRP A2020 6.750 7.553 -8.581 1.00 3.35 H new ATOM 2061 N HIS A2021 7.085 1.833 -7.629 1.00 0.61 N ATOM 2062 CA HIS A2021 8.502 1.840 -7.802 1.00 0.66 C ATOM 2063 C HIS A2021 9.054 2.972 -6.970 1.00 0.64 C ATOM 2064 O HIS A2021 8.915 4.143 -7.324 1.00 0.81 O ATOM 2065 CB HIS A2021 8.887 2.056 -9.279 1.00 0.86 C ATOM 2066 CG HIS A2021 8.688 0.883 -10.198 1.00 0.93 C ATOM 2067 ND1 HIS A2021 7.474 0.518 -10.716 1.00 1.53 N ATOM 2068 CD2 HIS A2021 9.583 0.007 -10.714 1.00 1.33 C ATOM 2069 CE1 HIS A2021 7.629 -0.524 -11.509 1.00 1.61 C ATOM 2070 NE2 HIS A2021 8.894 -0.849 -11.521 1.00 1.43 N ATOM 0 H HIS A2021 6.569 2.220 -8.419 1.00 0.61 H new ATOM 0 HA HIS A2021 8.912 0.879 -7.492 1.00 0.66 H new ATOM 0 HB2 HIS A2021 8.307 2.895 -9.664 1.00 0.86 H new ATOM 0 HB3 HIS A2021 9.936 2.348 -9.320 1.00 0.86 H new ATOM 0 HD1 HIS A2021 6.587 0.981 -10.519 1.00 1.53 H new ATOM 0 HD2 HIS A2021 10.646 -0.010 -10.522 1.00 1.33 H new ATOM 0 HE1 HIS A2021 6.843 -1.024 -12.056 1.00 1.61 H new ATOM 2079 N THR A2022 9.653 2.637 -5.879 1.00 0.51 N ATOM 2080 CA THR A2022 10.185 3.606 -4.991 1.00 0.50 C ATOM 2081 C THR A2022 11.581 3.191 -4.538 1.00 0.48 C ATOM 2082 O THR A2022 11.890 2.001 -4.411 1.00 0.50 O ATOM 2083 CB THR A2022 9.232 3.873 -3.780 1.00 0.53 C ATOM 2084 OG1 THR A2022 9.811 4.827 -2.879 1.00 0.63 O ATOM 2085 CG2 THR A2022 8.905 2.599 -3.029 1.00 0.56 C ATOM 0 H THR A2022 9.787 1.672 -5.578 1.00 0.51 H new ATOM 0 HA THR A2022 10.268 4.551 -5.527 1.00 0.50 H new ATOM 0 HB THR A2022 8.305 4.276 -4.187 1.00 0.53 H new ATOM 0 HG1 THR A2022 9.169 5.547 -2.708 1.00 0.63 H new ATOM 0 HG21 THR A2022 8.241 2.828 -2.196 1.00 0.56 H new ATOM 0 HG22 THR A2022 8.414 1.896 -3.702 1.00 0.56 H new ATOM 0 HG23 THR A2022 9.825 2.155 -2.648 1.00 0.56 H new ATOM 2093 N SER A2023 12.421 4.165 -4.341 1.00 0.55 N ATOM 2094 CA SER A2023 13.797 3.973 -3.949 1.00 0.60 C ATOM 2095 C SER A2023 13.897 3.366 -2.538 1.00 0.59 C ATOM 2096 O SER A2023 14.865 2.686 -2.209 1.00 0.75 O ATOM 2097 CB SER A2023 14.451 5.330 -3.981 1.00 0.85 C ATOM 2098 OG SER A2023 14.130 6.005 -5.201 1.00 1.21 O ATOM 0 H SER A2023 12.165 5.146 -4.451 1.00 0.55 H new ATOM 0 HA SER A2023 14.291 3.278 -4.628 1.00 0.60 H new ATOM 0 HB2 SER A2023 14.116 5.923 -3.130 1.00 0.85 H new ATOM 0 HB3 SER A2023 15.532 5.223 -3.890 1.00 0.85 H new ATOM 0 HG SER A2023 14.403 5.452 -5.963 1.00 1.21 H new ATOM 2104 N LEU A2024 12.859 3.580 -1.743 1.00 0.61 N ATOM 2105 CA LEU A2024 12.801 3.104 -0.358 1.00 0.74 C ATOM 2106 C LEU A2024 12.536 1.601 -0.306 1.00 0.76 C ATOM 2107 O LEU A2024 12.638 0.966 0.741 1.00 0.93 O ATOM 2108 CB LEU A2024 11.693 3.842 0.426 1.00 0.91 C ATOM 2109 CG LEU A2024 11.888 5.341 0.748 1.00 0.78 C ATOM 2110 CD1 LEU A2024 13.154 5.569 1.529 1.00 1.53 C ATOM 2111 CD2 LEU A2024 11.843 6.225 -0.498 1.00 1.11 C ATOM 0 H LEU A2024 12.026 4.091 -2.037 1.00 0.61 H new ATOM 0 HA LEU A2024 13.768 3.311 0.100 1.00 0.74 H new ATOM 0 HB2 LEU A2024 10.766 3.743 -0.138 1.00 0.91 H new ATOM 0 HB3 LEU A2024 11.549 3.317 1.370 1.00 0.91 H new ATOM 0 HG LEU A2024 11.043 5.637 1.370 1.00 0.78 H new ATOM 0 HD11 LEU A2024 13.264 6.633 1.741 1.00 1.53 H new ATOM 0 HD12 LEU A2024 13.108 5.015 2.467 1.00 1.53 H new ATOM 0 HD13 LEU A2024 14.008 5.225 0.946 1.00 1.53 H new ATOM 0 HD21 LEU A2024 11.986 7.267 -0.210 1.00 1.11 H new ATOM 0 HD22 LEU A2024 12.635 5.926 -1.185 1.00 1.11 H new ATOM 0 HD23 LEU A2024 10.876 6.113 -0.989 1.00 1.11 H new ATOM 2123 N ALA A2025 12.206 1.054 -1.440 1.00 0.66 N ATOM 2124 CA ALA A2025 11.869 -0.337 -1.574 1.00 0.72 C ATOM 2125 C ALA A2025 12.897 -1.019 -2.439 1.00 0.85 C ATOM 2126 O ALA A2025 12.583 -1.966 -3.167 1.00 1.20 O ATOM 2127 CB ALA A2025 10.534 -0.423 -2.249 1.00 0.64 C ATOM 0 H ALA A2025 12.162 1.572 -2.317 1.00 0.66 H new ATOM 0 HA ALA A2025 11.842 -0.818 -0.596 1.00 0.72 H new ATOM 0 HB1 ALA A2025 10.251 -1.469 -2.365 1.00 0.64 H new ATOM 0 HB2 ALA A2025 9.787 0.090 -1.644 1.00 0.64 H new ATOM 0 HB3 ALA A2025 10.592 0.048 -3.230 1.00 0.64 H new ATOM 2133 N CYS A2026 14.114 -0.576 -2.363 1.00 0.90 N ATOM 2134 CA CYS A2026 15.095 -1.114 -3.234 1.00 1.05 C ATOM 2135 C CYS A2026 15.706 -2.366 -2.657 1.00 1.23 C ATOM 2136 O CYS A2026 16.144 -2.397 -1.502 1.00 1.55 O ATOM 2137 CB CYS A2026 16.159 -0.095 -3.606 1.00 1.61 C ATOM 2138 SG CYS A2026 17.141 -0.593 -5.066 1.00 2.15 S ATOM 0 H CYS A2026 14.441 0.143 -1.718 1.00 0.90 H new ATOM 0 HA CYS A2026 14.586 -1.384 -4.159 1.00 1.05 H new ATOM 0 HB2 CYS A2026 15.682 0.865 -3.805 1.00 1.61 H new ATOM 0 HB3 CYS A2026 16.827 0.051 -2.757 1.00 1.61 H new ATOM 2143 N GLU A2027 15.723 -3.396 -3.453 1.00 1.51 N ATOM 2144 CA GLU A2027 16.260 -4.646 -3.062 1.00 2.04 C ATOM 2145 C GLU A2027 17.657 -4.802 -3.600 1.00 2.41 C ATOM 2146 O GLU A2027 18.498 -5.401 -2.967 1.00 2.90 O ATOM 2147 CB GLU A2027 15.314 -5.806 -3.435 1.00 2.28 C ATOM 2148 CG GLU A2027 14.441 -5.577 -4.681 1.00 2.97 C ATOM 2149 CD GLU A2027 15.217 -5.409 -5.939 1.00 3.42 C ATOM 2150 OE1 GLU A2027 15.631 -4.261 -6.235 1.00 3.85 O ATOM 2151 OE2 GLU A2027 15.447 -6.410 -6.630 1.00 3.72 O ATOM 0 H GLU A2027 15.356 -3.380 -4.405 1.00 1.51 H new ATOM 0 HA GLU A2027 16.340 -4.680 -1.975 1.00 2.04 H new ATOM 0 HB2 GLU A2027 15.913 -6.703 -3.593 1.00 2.28 H new ATOM 0 HB3 GLU A2027 14.660 -6.005 -2.586 1.00 2.28 H new ATOM 0 HG2 GLU A2027 13.760 -6.421 -4.796 1.00 2.97 H new ATOM 0 HG3 GLU A2027 13.826 -4.691 -4.524 1.00 2.97 H new ATOM 2158 N GLU A2028 17.895 -4.244 -4.764 1.00 2.55 N ATOM 2159 CA GLU A2028 19.206 -4.203 -5.347 1.00 3.01 C ATOM 2160 C GLU A2028 19.177 -3.323 -6.584 1.00 3.22 C ATOM 2161 O GLU A2028 19.886 -2.313 -6.669 1.00 3.86 O ATOM 2162 CB GLU A2028 19.691 -5.612 -5.716 1.00 3.98 C ATOM 2163 CG GLU A2028 21.116 -5.646 -6.198 1.00 4.60 C ATOM 2164 CD GLU A2028 22.090 -5.137 -5.158 1.00 5.42 C ATOM 2165 OE1 GLU A2028 22.507 -5.909 -4.272 1.00 5.87 O ATOM 2166 OE2 GLU A2028 22.452 -3.941 -5.190 1.00 5.90 O ATOM 0 H GLU A2028 17.174 -3.803 -5.334 1.00 2.55 H new ATOM 0 HA GLU A2028 19.901 -3.790 -4.616 1.00 3.01 H new ATOM 0 HB2 GLU A2028 19.594 -6.261 -4.846 1.00 3.98 H new ATOM 0 HB3 GLU A2028 19.043 -6.020 -6.492 1.00 3.98 H new ATOM 0 HG2 GLU A2028 21.380 -6.668 -6.470 1.00 4.60 H new ATOM 0 HG3 GLU A2028 21.205 -5.043 -7.101 1.00 4.60 H new ATOM 2173 N GLU A2029 18.333 -3.679 -7.499 1.00 3.21 N ATOM 2174 CA GLU A2029 18.217 -3.019 -8.766 1.00 3.93 C ATOM 2175 C GLU A2029 16.886 -3.391 -9.355 1.00 4.11 C ATOM 2176 O GLU A2029 16.499 -4.543 -9.268 1.00 3.96 O ATOM 2177 CB GLU A2029 19.383 -3.418 -9.698 1.00 4.45 C ATOM 2178 CG GLU A2029 19.601 -4.919 -9.822 1.00 5.45 C ATOM 2179 CD GLU A2029 20.708 -5.269 -10.766 1.00 6.38 C ATOM 2180 OE1 GLU A2029 21.877 -5.285 -10.342 1.00 6.91 O ATOM 2181 OE2 GLU A2029 20.448 -5.519 -11.957 1.00 6.80 O ATOM 0 H GLU A2029 17.686 -4.459 -7.385 1.00 3.21 H new ATOM 0 HA GLU A2029 18.273 -1.938 -8.641 1.00 3.93 H new ATOM 0 HB2 GLU A2029 19.197 -3.007 -10.690 1.00 4.45 H new ATOM 0 HB3 GLU A2029 20.300 -2.959 -9.330 1.00 4.45 H new ATOM 0 HG2 GLU A2029 19.825 -5.331 -8.838 1.00 5.45 H new ATOM 0 HG3 GLU A2029 18.678 -5.389 -10.162 1.00 5.45 H new ATOM 2188 N VAL A2030 16.209 -2.412 -9.940 1.00 4.83 N ATOM 2189 CA VAL A2030 14.828 -2.556 -10.466 1.00 5.43 C ATOM 2190 C VAL A2030 14.637 -3.844 -11.295 1.00 6.11 C ATOM 2191 O VAL A2030 15.139 -3.943 -12.417 1.00 6.82 O ATOM 2192 CB VAL A2030 14.426 -1.342 -11.357 1.00 6.26 C ATOM 2193 CG1 VAL A2030 12.958 -1.416 -11.764 1.00 7.15 C ATOM 2194 CG2 VAL A2030 14.724 -0.020 -10.670 1.00 6.37 C ATOM 0 H VAL A2030 16.595 -1.477 -10.072 1.00 4.83 H new ATOM 0 HA VAL A2030 14.188 -2.604 -9.585 1.00 5.43 H new ATOM 0 HB VAL A2030 15.033 -1.393 -12.261 1.00 6.26 H new ATOM 0 HG11 VAL A2030 12.709 -0.555 -12.385 1.00 7.15 H new ATOM 0 HG12 VAL A2030 12.782 -2.333 -12.327 1.00 7.15 H new ATOM 0 HG13 VAL A2030 12.332 -1.413 -10.871 1.00 7.15 H new ATOM 0 HG21 VAL A2030 14.430 0.803 -11.322 1.00 6.37 H new ATOM 0 HG22 VAL A2030 14.165 0.039 -9.736 1.00 6.37 H new ATOM 0 HG23 VAL A2030 15.791 0.048 -10.458 1.00 6.37 H new ATOM 2204 N PRO A2031 13.947 -4.854 -10.736 1.00 6.17 N ATOM 2205 CA PRO A2031 13.663 -6.076 -11.452 1.00 7.02 C ATOM 2206 C PRO A2031 12.450 -5.905 -12.369 1.00 7.96 C ATOM 2207 O PRO A2031 12.532 -6.105 -13.585 1.00 8.70 O ATOM 2208 CB PRO A2031 13.376 -7.105 -10.348 1.00 6.96 C ATOM 2209 CG PRO A2031 13.070 -6.325 -9.103 1.00 6.35 C ATOM 2210 CD PRO A2031 13.448 -4.881 -9.347 1.00 5.74 C ATOM 0 HA PRO A2031 14.486 -6.379 -12.099 1.00 7.02 H new ATOM 0 HB2 PRO A2031 12.536 -7.743 -10.622 1.00 6.96 H new ATOM 0 HB3 PRO A2031 14.235 -7.758 -10.195 1.00 6.96 H new ATOM 0 HG2 PRO A2031 12.012 -6.404 -8.855 1.00 6.35 H new ATOM 0 HG3 PRO A2031 13.627 -6.726 -8.256 1.00 6.35 H new ATOM 0 HD2 PRO A2031 12.590 -4.220 -9.222 1.00 5.74 H new ATOM 0 HD3 PRO A2031 14.212 -4.548 -8.645 1.00 5.74 H new ATOM 2218 N ARG A2032 11.371 -5.454 -11.795 1.00 8.09 N ATOM 2219 CA ARG A2032 10.133 -5.273 -12.479 1.00 9.10 C ATOM 2220 C ARG A2032 9.679 -3.844 -12.275 1.00 9.66 C ATOM 2221 O ARG A2032 9.766 -3.059 -13.214 1.00 10.08 O ATOM 2222 CB ARG A2032 9.090 -6.322 -12.011 1.00 9.37 C ATOM 2223 CG ARG A2032 8.875 -6.378 -10.502 1.00 9.14 C ATOM 2224 CD ARG A2032 8.010 -7.556 -10.082 1.00 9.28 C ATOM 2225 NE ARG A2032 6.643 -7.499 -10.598 1.00 9.46 N ATOM 2226 CZ ARG A2032 5.623 -8.229 -10.125 1.00 9.76 C ATOM 2227 NH1 ARG A2032 5.811 -9.115 -9.126 1.00 9.89 N ATOM 2228 NH2 ARG A2032 4.417 -8.090 -10.665 1.00 10.17 N ATOM 0 H ARG A2032 11.333 -5.196 -10.809 1.00 8.09 H new ATOM 0 HA ARG A2032 10.255 -5.438 -13.550 1.00 9.10 H new ATOM 0 HB2 ARG A2032 8.136 -6.106 -12.492 1.00 9.37 H new ATOM 0 HB3 ARG A2032 9.405 -7.307 -12.356 1.00 9.37 H new ATOM 0 HG2 ARG A2032 9.842 -6.444 -10.002 1.00 9.14 H new ATOM 0 HG3 ARG A2032 8.408 -5.451 -10.170 1.00 9.14 H new ATOM 0 HD2 ARG A2032 8.479 -8.479 -10.423 1.00 9.28 H new ATOM 0 HD3 ARG A2032 7.976 -7.600 -8.993 1.00 9.28 H new ATOM 0 HE ARG A2032 6.453 -6.860 -11.370 1.00 9.46 H new ATOM 0 HH11 ARG A2032 6.739 -9.237 -8.720 1.00 9.89 H new ATOM 0 HH12 ARG A2032 5.025 -9.664 -8.776 1.00 9.89 H new ATOM 0 HH21 ARG A2032 4.274 -7.433 -11.432 1.00 10.17 H new ATOM 0 HH22 ARG A2032 3.634 -8.641 -10.313 1.00 10.17 H new TER 2242 ARG A2032