USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=47 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: A2002 SER OG : rot 7:sc= 0.832 USER MOD Set 1.2: A2022 THR OG1 : rot 62:sc= 1.09 USER MOD Set 2.1: A1988 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A2016 SER OG : rot -130:sc= 0.88 USER MOD Set 3.1: A1985 LYS NZ :NH3+ -135:sc= 0.731 (180deg=-0.221) USER MOD Set 3.2: A2013 THR OG1 : rot 36:sc= 1.64 USER MOD Set 4.1: A1921 HIS : no HE2:sc= -0.191 K(o=-2.4,f=-8.5!) USER MOD Set 4.2: A1922 ASN : amide:sc= -2.18! X(o=-2.4!,f=-2.2) USER MOD Set 5.1: A1897 ASN : amide:sc= -0.124 K(o=-0.12,f=-12!) USER MOD Set 5.2: A1900 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A1887 SER OG : rot 180:sc= 0.441 USER MOD Set 6.2: A1888 ASN : amide:sc= -0.307 X(o=-0.0029,f=0.18) USER MOD Set 6.3: A1890 GLN : amide:sc= -0.137 X(o=-0.0029,f=-0.2) USER MOD Single : A1885 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1886 LYS NZ :NH3+ -159:sc= 1.08 (180deg=0.785) USER MOD Single : A1891 ASN : amide:sc= -0.709 K(o=-0.71,f=0) USER MOD Single : A1896 THR OG1 : rot 180:sc= 0 USER MOD Single : A1902 HIS : no HE2:sc= 0.673 K(o=0.67,f=-6.5!) USER MOD Single : A1907 THR OG1 : rot -106:sc= 1.4 USER MOD Single : A1908 SER OG : rot 180:sc= -0.758 USER MOD Single : A1910 LYS NZ :NH3+ -177:sc= 0.581! (180deg=0.562) USER MOD Single : A1913 SER OG : rot 180:sc= 0 USER MOD Single : A1915 TYR OH : rot 86:sc= -0.562 USER MOD Single : A1916 THR OG1 : rot 85:sc= -0.556 USER MOD Single : A1918 THR OG1 : rot 180:sc= 0 USER MOD Single : A1920 SER OG : rot 180:sc= 0 USER MOD Single : A1924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1928 ASN : amide:sc= -0.294 K(o=-0.29,f=-8.5!) USER MOD Single : A1934 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00884) USER MOD Single : A1935 SER OG : rot 170:sc= -0.183 USER MOD Single : A1936 SER OG : rot 180:sc= 0 USER MOD Single : A1939 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1946 THR OG1 : rot 180:sc= 0 USER MOD Single : A1950 LYS NZ :NH3+ -142:sc= -0.86! (180deg=-3.68!) USER MOD Single : A1951 THR OG1 : rot 180:sc= 0 USER MOD Single : A1953 ASN : amide:sc= -0.452 X(o=-0.45,f=0) USER MOD Single : A1956 LYS NZ :NH3+ -141:sc= -2.09! (180deg=-4.77!) USER MOD Single : A1958 SER OG : rot 180:sc= 0 USER MOD Single : A1959 LYS NZ :NH3+ 150:sc= 1.25 (180deg=0.493) USER MOD Single : A1960 THR OG1 : rot 180:sc= 0 USER MOD Single : A1962 THR OG1 : rot 180:sc= -0.0683 USER MOD Single : A1963 TYR OH : rot 180:sc= 0 USER MOD Single : A1966 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A1969 LYS NZ :NH3+ -159:sc= 1.92 (180deg=1.5) USER MOD Single : A1972 TYR OH : rot 30:sc= 0.968 USER MOD Single : A1980 THR OG1 : rot 141:sc= 1.39 USER MOD Single : A1983 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0683) USER MOD Single : A1984 MET CE :methyl -141:sc= -0.0212 (180deg=-1.6) USER MOD Single : A1986 HIS : no HE2:sc= -1.11 X(o=-1.1,f=-1.6) USER MOD Single : A1987 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1989 TYR OH : rot 180:sc= 0 USER MOD Single : A1991 SER OG : rot 180:sc=-0.00602 USER MOD Single : A1995 LYS NZ :NH3+ -171:sc= 0.43 (180deg=0.386) USER MOD Single : A1996 SER OG : rot -110:sc= -0.206 USER MOD Single : A2003 GLN : amide:sc= -0.908 K(o=-0.91,f=-0.0057) USER MOD Single : A2008 SER OG : rot 180:sc= 0 USER MOD Single : A2012 GLN : amide:sc= -0.804 K(o=-0.8,f=-5.5!) USER MOD Single : A2015 THR OG1 : rot -120:sc= -0.437 USER MOD Single : A2017 TYR OH : rot 180:sc= 0 USER MOD Single : A2019 SER OG : rot 180:sc= -0.459 USER MOD Single : A2021 HIS : no HD1:sc= -0.143 K(o=-0.14,f=-0.74) USER MOD Single : A2023 SER OG : rot 107:sc= -0.343! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A1885 16.623 12.213 5.258 1.00 5.18 N ATOM 2 CA MET A1885 15.829 11.243 4.506 1.00 4.46 C ATOM 3 C MET A1885 15.072 10.356 5.453 1.00 3.65 C ATOM 4 O MET A1885 15.426 10.260 6.636 1.00 3.88 O ATOM 5 CB MET A1885 16.708 10.367 3.598 1.00 4.63 C ATOM 6 CG MET A1885 17.252 11.061 2.367 1.00 4.63 C ATOM 7 SD MET A1885 15.945 11.533 1.215 1.00 5.35 S ATOM 8 CE MET A1885 16.915 12.230 -0.119 1.00 5.61 C ATOM 0 HA MET A1885 15.137 11.805 3.878 1.00 4.46 H new ATOM 0 HB2 MET A1885 17.546 9.990 4.184 1.00 4.63 H new ATOM 0 HB3 MET A1885 16.126 9.501 3.281 1.00 4.63 H new ATOM 0 HG2 MET A1885 17.806 11.950 2.668 1.00 4.63 H new ATOM 0 HG3 MET A1885 17.958 10.401 1.862 1.00 4.63 H new ATOM 0 HE1 MET A1885 16.250 12.570 -0.913 1.00 5.61 H new ATOM 0 HE2 MET A1885 17.495 13.074 0.255 1.00 5.61 H new ATOM 0 HE3 MET A1885 17.592 11.471 -0.512 1.00 5.61 H new ATOM 20 N LYS A1886 14.027 9.719 4.929 1.00 3.10 N ATOM 21 CA LYS A1886 13.198 8.750 5.641 1.00 2.49 C ATOM 22 C LYS A1886 12.328 9.382 6.724 1.00 1.74 C ATOM 23 O LYS A1886 12.819 9.943 7.707 1.00 2.11 O ATOM 24 CB LYS A1886 14.006 7.553 6.167 1.00 3.19 C ATOM 25 CG LYS A1886 14.689 6.751 5.065 1.00 3.90 C ATOM 26 CD LYS A1886 15.338 5.498 5.610 1.00 4.56 C ATOM 27 CE LYS A1886 16.006 4.690 4.509 1.00 5.38 C ATOM 28 NZ LYS A1886 16.512 3.398 5.010 1.00 5.95 N ATOM 0 H LYS A1886 13.725 9.868 3.966 1.00 3.10 H new ATOM 0 HA LYS A1886 12.507 8.356 4.896 1.00 2.49 H new ATOM 0 HB2 LYS A1886 14.762 7.913 6.865 1.00 3.19 H new ATOM 0 HB3 LYS A1886 13.342 6.894 6.727 1.00 3.19 H new ATOM 0 HG2 LYS A1886 13.957 6.481 4.304 1.00 3.90 H new ATOM 0 HG3 LYS A1886 15.443 7.370 4.578 1.00 3.90 H new ATOM 0 HD2 LYS A1886 16.078 5.769 6.363 1.00 4.56 H new ATOM 0 HD3 LYS A1886 14.586 4.885 6.107 1.00 4.56 H new ATOM 0 HE2 LYS A1886 15.293 4.514 3.703 1.00 5.38 H new ATOM 0 HE3 LYS A1886 16.830 5.264 4.085 1.00 5.38 H new ATOM 0 HZ1 LYS A1886 17.247 3.040 4.367 1.00 5.95 H new ATOM 0 HZ2 LYS A1886 16.916 3.528 5.960 1.00 5.95 H new ATOM 0 HZ3 LYS A1886 15.730 2.714 5.057 1.00 5.95 H new ATOM 42 N SER A1887 11.038 9.310 6.506 1.00 1.11 N ATOM 43 CA SER A1887 10.040 9.835 7.432 1.00 1.23 C ATOM 44 C SER A1887 9.907 8.915 8.686 1.00 1.05 C ATOM 45 O SER A1887 10.734 8.003 8.911 1.00 1.33 O ATOM 46 CB SER A1887 8.688 10.000 6.675 1.00 1.99 C ATOM 47 OG SER A1887 7.655 10.605 7.454 1.00 2.83 O ATOM 0 H SER A1887 10.637 8.881 5.672 1.00 1.11 H new ATOM 0 HA SER A1887 10.352 10.813 7.800 1.00 1.23 H new ATOM 0 HB2 SER A1887 8.855 10.602 5.782 1.00 1.99 H new ATOM 0 HB3 SER A1887 8.349 9.020 6.340 1.00 1.99 H new ATOM 0 HG SER A1887 6.839 10.678 6.916 1.00 2.83 H new ATOM 53 N ASN A1888 8.873 9.150 9.470 1.00 0.86 N ATOM 54 CA ASN A1888 8.649 8.467 10.737 1.00 0.91 C ATOM 55 C ASN A1888 8.321 6.988 10.571 1.00 0.87 C ATOM 56 O ASN A1888 7.936 6.506 9.480 1.00 1.23 O ATOM 57 CB ASN A1888 7.549 9.174 11.564 1.00 1.19 C ATOM 58 CG ASN A1888 6.164 9.101 10.956 1.00 1.37 C ATOM 59 OD1 ASN A1888 5.809 9.904 10.077 1.00 1.91 O ATOM 60 ND2 ASN A1888 5.347 8.204 11.457 1.00 1.53 N ATOM 0 H ASN A1888 8.150 9.833 9.244 1.00 0.86 H new ATOM 0 HA ASN A1888 9.593 8.522 11.280 1.00 0.91 H new ATOM 0 HB2 ASN A1888 7.519 8.731 12.560 1.00 1.19 H new ATOM 0 HB3 ASN A1888 7.823 10.222 11.689 1.00 1.19 H new ATOM 0 HD21 ASN A1888 4.384 8.150 11.125 1.00 1.53 H new ATOM 0 HD22 ASN A1888 5.675 7.561 12.178 1.00 1.53 H new ATOM 67 N VAL A1889 8.481 6.277 11.644 1.00 0.91 N ATOM 68 CA VAL A1889 8.232 4.867 11.723 1.00 1.02 C ATOM 69 C VAL A1889 7.066 4.635 12.666 1.00 1.13 C ATOM 70 O VAL A1889 6.907 5.364 13.641 1.00 1.41 O ATOM 71 CB VAL A1889 9.491 4.137 12.254 1.00 1.34 C ATOM 72 CG1 VAL A1889 9.269 2.644 12.414 1.00 1.98 C ATOM 73 CG2 VAL A1889 10.701 4.404 11.370 1.00 2.12 C ATOM 0 H VAL A1889 8.802 6.678 12.526 1.00 0.91 H new ATOM 0 HA VAL A1889 7.995 4.476 10.734 1.00 1.02 H new ATOM 0 HB VAL A1889 9.690 4.545 13.245 1.00 1.34 H new ATOM 0 HG11 VAL A1889 10.181 2.179 12.789 1.00 1.98 H new ATOM 0 HG12 VAL A1889 8.457 2.471 13.120 1.00 1.98 H new ATOM 0 HG13 VAL A1889 9.010 2.209 11.449 1.00 1.98 H new ATOM 0 HG21 VAL A1889 11.567 3.877 11.770 1.00 2.12 H new ATOM 0 HG22 VAL A1889 10.498 4.052 10.359 1.00 2.12 H new ATOM 0 HG23 VAL A1889 10.906 5.474 11.347 1.00 2.12 H new ATOM 83 N GLN A1890 6.223 3.683 12.346 1.00 1.17 N ATOM 84 CA GLN A1890 5.136 3.345 13.230 1.00 1.48 C ATOM 85 C GLN A1890 5.565 2.246 14.174 1.00 1.69 C ATOM 86 O GLN A1890 6.084 2.526 15.251 1.00 2.49 O ATOM 87 CB GLN A1890 3.866 2.972 12.467 1.00 1.71 C ATOM 88 CG GLN A1890 3.233 4.123 11.744 1.00 1.52 C ATOM 89 CD GLN A1890 2.819 5.251 12.675 1.00 2.03 C ATOM 90 OE1 GLN A1890 3.603 6.159 12.944 1.00 2.63 O ATOM 91 NE2 GLN A1890 1.592 5.210 13.159 1.00 2.40 N ATOM 0 H GLN A1890 6.268 3.133 11.488 1.00 1.17 H new ATOM 0 HA GLN A1890 4.888 4.230 13.816 1.00 1.48 H new ATOM 0 HB2 GLN A1890 4.103 2.189 11.747 1.00 1.71 H new ATOM 0 HB3 GLN A1890 3.143 2.553 13.167 1.00 1.71 H new ATOM 0 HG2 GLN A1890 3.933 4.509 11.003 1.00 1.52 H new ATOM 0 HG3 GLN A1890 2.357 3.767 11.201 1.00 1.52 H new ATOM 0 HE21 GLN A1890 0.972 4.439 12.912 1.00 2.40 H new ATOM 0 HE22 GLN A1890 1.264 5.949 13.780 1.00 2.40 H new ATOM 100 N ASN A1891 5.430 1.012 13.752 1.00 1.59 N ATOM 101 CA ASN A1891 5.827 -0.103 14.593 1.00 1.88 C ATOM 102 C ASN A1891 7.101 -0.692 14.052 1.00 1.48 C ATOM 103 O ASN A1891 8.098 -0.772 14.751 1.00 1.86 O ATOM 104 CB ASN A1891 4.719 -1.156 14.668 1.00 2.50 C ATOM 105 CG ASN A1891 4.999 -2.310 15.639 1.00 3.17 C ATOM 106 OD1 ASN A1891 4.543 -3.437 15.419 1.00 3.82 O ATOM 107 ND2 ASN A1891 5.709 -2.049 16.714 1.00 3.53 N ATOM 0 H ASN A1891 5.053 0.751 12.841 1.00 1.59 H new ATOM 0 HA ASN A1891 5.999 0.253 15.609 1.00 1.88 H new ATOM 0 HB2 ASN A1891 3.791 -0.667 14.964 1.00 2.50 H new ATOM 0 HB3 ASN A1891 4.559 -1.568 13.672 1.00 2.50 H new ATOM 0 HD21 ASN A1891 5.896 -2.787 17.393 1.00 3.53 H new ATOM 0 HD22 ASN A1891 6.073 -1.109 16.869 1.00 3.53 H new ATOM 114 N ASP A1892 7.077 -1.070 12.788 1.00 1.00 N ATOM 115 CA ASP A1892 8.276 -1.584 12.129 1.00 1.01 C ATOM 116 C ASP A1892 8.495 -0.840 10.862 1.00 1.00 C ATOM 117 O ASP A1892 9.393 -0.013 10.770 1.00 1.59 O ATOM 118 CB ASP A1892 8.217 -3.093 11.803 1.00 1.40 C ATOM 119 CG ASP A1892 8.181 -3.984 13.002 1.00 2.05 C ATOM 120 OD1 ASP A1892 9.237 -4.196 13.625 1.00 2.61 O ATOM 121 OD2 ASP A1892 7.092 -4.483 13.363 1.00 2.66 O ATOM 0 H ASP A1892 6.248 -1.034 12.195 1.00 1.00 H new ATOM 0 HA ASP A1892 9.094 -1.441 12.835 1.00 1.01 H new ATOM 0 HB2 ASP A1892 7.333 -3.286 11.195 1.00 1.40 H new ATOM 0 HB3 ASP A1892 9.084 -3.355 11.197 1.00 1.40 H new ATOM 126 N CYS A1893 7.634 -1.120 9.866 1.00 0.74 N ATOM 127 CA CYS A1893 7.723 -0.506 8.528 1.00 0.87 C ATOM 128 C CYS A1893 9.079 -0.805 7.880 1.00 0.75 C ATOM 129 O CYS A1893 9.476 -0.139 6.934 1.00 0.80 O ATOM 130 CB CYS A1893 7.539 1.015 8.641 1.00 1.17 C ATOM 131 SG CYS A1893 6.048 1.519 9.572 1.00 1.58 S ATOM 0 H CYS A1893 6.859 -1.776 9.965 1.00 0.74 H new ATOM 0 HA CYS A1893 6.935 -0.929 7.905 1.00 0.87 H new ATOM 0 HB2 CYS A1893 8.418 1.442 9.125 1.00 1.17 H new ATOM 0 HB3 CYS A1893 7.489 1.440 7.638 1.00 1.17 H new ATOM 136 N ARG A1894 9.724 -1.850 8.353 1.00 0.73 N ATOM 137 CA ARG A1894 11.077 -2.177 8.000 1.00 0.73 C ATOM 138 C ARG A1894 11.134 -3.671 7.744 1.00 0.72 C ATOM 139 O ARG A1894 10.446 -4.426 8.432 1.00 0.92 O ATOM 140 CB ARG A1894 11.955 -1.875 9.223 1.00 0.85 C ATOM 141 CG ARG A1894 13.450 -1.865 8.977 1.00 1.21 C ATOM 142 CD ARG A1894 13.944 -0.472 8.614 1.00 1.35 C ATOM 143 NE ARG A1894 13.805 0.468 9.747 1.00 1.45 N ATOM 144 CZ ARG A1894 14.240 1.751 9.766 1.00 1.80 C ATOM 145 NH1 ARG A1894 14.719 2.332 8.663 1.00 2.09 N ATOM 146 NH2 ARG A1894 14.146 2.466 10.885 1.00 2.57 N ATOM 0 H ARG A1894 9.306 -2.509 9.010 1.00 0.73 H new ATOM 0 HA ARG A1894 11.410 -1.616 7.126 1.00 0.73 H new ATOM 0 HB2 ARG A1894 11.665 -0.903 9.623 1.00 0.85 H new ATOM 0 HB3 ARG A1894 11.738 -2.615 9.994 1.00 0.85 H new ATOM 0 HG2 ARG A1894 13.969 -2.216 9.869 1.00 1.21 H new ATOM 0 HG3 ARG A1894 13.693 -2.560 8.173 1.00 1.21 H new ATOM 0 HD2 ARG A1894 14.989 -0.524 8.310 1.00 1.35 H new ATOM 0 HD3 ARG A1894 13.382 -0.097 7.759 1.00 1.35 H new ATOM 0 HE ARG A1894 13.342 0.121 10.587 1.00 1.45 H new ATOM 0 HH11 ARG A1894 14.762 1.809 7.788 1.00 2.09 H new ATOM 0 HH12 ARG A1894 15.042 3.299 8.695 1.00 2.09 H new ATOM 0 HH21 ARG A1894 13.747 2.048 11.725 1.00 2.57 H new ATOM 0 HH22 ARG A1894 14.473 3.432 10.902 1.00 2.57 H new ATOM 160 N VAL A1895 11.895 -4.091 6.764 1.00 0.58 N ATOM 161 CA VAL A1895 12.099 -5.503 6.502 1.00 0.60 C ATOM 162 C VAL A1895 13.392 -5.706 5.701 1.00 0.52 C ATOM 163 O VAL A1895 13.686 -4.962 4.768 1.00 0.47 O ATOM 164 CB VAL A1895 10.876 -6.172 5.785 1.00 0.63 C ATOM 165 CG1 VAL A1895 10.616 -5.564 4.424 1.00 0.57 C ATOM 166 CG2 VAL A1895 11.053 -7.684 5.686 1.00 0.72 C ATOM 0 H VAL A1895 12.391 -3.470 6.125 1.00 0.58 H new ATOM 0 HA VAL A1895 12.193 -6.003 7.466 1.00 0.60 H new ATOM 0 HB VAL A1895 9.998 -5.975 6.400 1.00 0.63 H new ATOM 0 HG11 VAL A1895 9.760 -6.057 3.963 1.00 0.57 H new ATOM 0 HG12 VAL A1895 10.405 -4.500 4.535 1.00 0.57 H new ATOM 0 HG13 VAL A1895 11.495 -5.696 3.793 1.00 0.57 H new ATOM 0 HG21 VAL A1895 10.189 -8.119 5.184 1.00 0.72 H new ATOM 0 HG22 VAL A1895 11.955 -7.908 5.116 1.00 0.72 H new ATOM 0 HG23 VAL A1895 11.142 -8.106 6.687 1.00 0.72 H new ATOM 176 N THR A1896 14.170 -6.656 6.099 1.00 0.63 N ATOM 177 CA THR A1896 15.423 -6.936 5.452 1.00 0.69 C ATOM 178 C THR A1896 15.241 -8.115 4.488 1.00 0.69 C ATOM 179 O THR A1896 14.546 -9.084 4.821 1.00 0.76 O ATOM 180 CB THR A1896 16.459 -7.326 6.522 1.00 0.89 C ATOM 181 OG1 THR A1896 16.277 -6.481 7.677 1.00 0.98 O ATOM 182 CG2 THR A1896 17.876 -7.143 5.992 1.00 1.02 C ATOM 0 H THR A1896 13.960 -7.268 6.887 1.00 0.63 H new ATOM 0 HA THR A1896 15.760 -6.057 4.903 1.00 0.69 H new ATOM 0 HB THR A1896 16.316 -8.374 6.787 1.00 0.89 H new ATOM 0 HG1 THR A1896 16.931 -6.723 8.365 1.00 0.98 H new ATOM 0 HG21 THR A1896 18.592 -7.424 6.764 1.00 1.02 H new ATOM 0 HG22 THR A1896 18.021 -7.774 5.115 1.00 1.02 H new ATOM 0 HG23 THR A1896 18.030 -6.099 5.717 1.00 1.02 H new ATOM 190 N ASN A1897 15.810 -8.038 3.300 1.00 0.75 N ATOM 191 CA ASN A1897 15.744 -9.180 2.405 1.00 0.88 C ATOM 192 C ASN A1897 16.967 -10.068 2.619 1.00 1.04 C ATOM 193 O ASN A1897 18.063 -9.569 2.839 1.00 1.06 O ATOM 194 CB ASN A1897 15.553 -8.812 0.882 1.00 0.95 C ATOM 195 CG ASN A1897 16.696 -8.038 0.192 1.00 1.17 C ATOM 196 OD1 ASN A1897 17.841 -8.087 0.587 1.00 1.65 O ATOM 197 ND2 ASN A1897 16.391 -7.397 -0.896 1.00 1.21 N ATOM 0 H ASN A1897 16.309 -7.225 2.939 1.00 0.75 H new ATOM 0 HA ASN A1897 14.838 -9.727 2.665 1.00 0.88 H new ATOM 0 HB2 ASN A1897 15.391 -9.737 0.329 1.00 0.95 H new ATOM 0 HB3 ASN A1897 14.642 -8.221 0.789 1.00 0.95 H new ATOM 0 HD21 ASN A1897 17.120 -6.925 -1.431 1.00 1.21 H new ATOM 0 HD22 ASN A1897 15.423 -7.365 -1.215 1.00 1.21 H new ATOM 204 N PRO A1898 16.798 -11.393 2.609 1.00 1.26 N ATOM 205 CA PRO A1898 17.918 -12.324 2.772 1.00 1.47 C ATOM 206 C PRO A1898 18.589 -12.643 1.431 1.00 1.54 C ATOM 207 O PRO A1898 19.466 -13.514 1.335 1.00 1.71 O ATOM 208 CB PRO A1898 17.241 -13.564 3.344 1.00 1.73 C ATOM 209 CG PRO A1898 15.859 -13.550 2.774 1.00 1.69 C ATOM 210 CD PRO A1898 15.508 -12.105 2.495 1.00 1.40 C ATOM 0 HA PRO A1898 18.713 -11.925 3.402 1.00 1.47 H new ATOM 0 HB2 PRO A1898 17.775 -14.471 3.061 1.00 1.73 H new ATOM 0 HB3 PRO A1898 17.219 -13.534 4.433 1.00 1.73 H new ATOM 0 HG2 PRO A1898 15.814 -14.141 1.859 1.00 1.69 H new ATOM 0 HG3 PRO A1898 15.149 -13.991 3.474 1.00 1.69 H new ATOM 0 HD2 PRO A1898 15.073 -11.985 1.503 1.00 1.40 H new ATOM 0 HD3 PRO A1898 14.779 -11.726 3.211 1.00 1.40 H new ATOM 218 N ALA A1899 18.149 -11.957 0.406 1.00 1.48 N ATOM 219 CA ALA A1899 18.678 -12.123 -0.918 1.00 1.62 C ATOM 220 C ALA A1899 19.843 -11.174 -1.131 1.00 1.54 C ATOM 221 O ALA A1899 20.973 -11.602 -1.361 1.00 1.69 O ATOM 222 CB ALA A1899 17.586 -11.876 -1.955 1.00 1.72 C ATOM 0 H ALA A1899 17.406 -11.261 0.471 1.00 1.48 H new ATOM 0 HA ALA A1899 19.037 -13.146 -1.034 1.00 1.62 H new ATOM 0 HB1 ALA A1899 17.999 -12.005 -2.956 1.00 1.72 H new ATOM 0 HB2 ALA A1899 16.773 -12.586 -1.804 1.00 1.72 H new ATOM 0 HB3 ALA A1899 17.205 -10.860 -1.847 1.00 1.72 H new ATOM 228 N THR A1900 19.563 -9.895 -1.019 1.00 1.37 N ATOM 229 CA THR A1900 20.545 -8.871 -1.240 1.00 1.38 C ATOM 230 C THR A1900 21.237 -8.497 0.082 1.00 1.36 C ATOM 231 O THR A1900 22.417 -8.114 0.106 1.00 1.53 O ATOM 232 CB THR A1900 19.833 -7.627 -1.812 1.00 1.31 C ATOM 233 OG1 THR A1900 18.880 -8.056 -2.784 1.00 1.45 O ATOM 234 CG2 THR A1900 20.821 -6.703 -2.484 1.00 1.46 C ATOM 0 H THR A1900 18.640 -9.539 -0.770 1.00 1.37 H new ATOM 0 HA THR A1900 21.299 -9.236 -1.937 1.00 1.38 H new ATOM 0 HB THR A1900 19.349 -7.092 -0.995 1.00 1.31 H new ATOM 0 HG1 THR A1900 18.418 -7.276 -3.156 1.00 1.45 H new ATOM 0 HG21 THR A1900 20.295 -5.834 -2.879 1.00 1.46 H new ATOM 0 HG22 THR A1900 21.566 -6.378 -1.758 1.00 1.46 H new ATOM 0 HG23 THR A1900 21.315 -7.230 -3.300 1.00 1.46 H new ATOM 242 N GLY A1901 20.505 -8.625 1.176 1.00 1.23 N ATOM 243 CA GLY A1901 21.004 -8.204 2.453 1.00 1.29 C ATOM 244 C GLY A1901 20.724 -6.749 2.626 1.00 1.27 C ATOM 245 O GLY A1901 21.448 -6.024 3.308 1.00 1.46 O ATOM 0 H GLY A1901 19.564 -9.018 1.195 1.00 1.23 H new ATOM 0 HA2 GLY A1901 20.530 -8.776 3.250 1.00 1.29 H new ATOM 0 HA3 GLY A1901 22.076 -8.392 2.520 1.00 1.29 H new ATOM 249 N HIS A1902 19.679 -6.307 1.974 1.00 1.12 N ATOM 250 CA HIS A1902 19.313 -4.923 1.989 1.00 1.15 C ATOM 251 C HIS A1902 18.112 -4.679 2.857 1.00 0.91 C ATOM 252 O HIS A1902 17.184 -5.504 2.916 1.00 0.84 O ATOM 253 CB HIS A1902 19.175 -4.329 0.565 1.00 1.34 C ATOM 254 CG HIS A1902 20.516 -4.014 -0.072 1.00 2.00 C ATOM 255 ND1 HIS A1902 20.666 -3.367 -1.280 1.00 2.46 N ATOM 256 CD2 HIS A1902 21.777 -4.258 0.361 1.00 2.87 C ATOM 257 CE1 HIS A1902 21.946 -3.236 -1.555 1.00 3.18 C ATOM 258 NE2 HIS A1902 22.636 -3.768 -0.576 1.00 3.41 N ATOM 0 H HIS A1902 19.061 -6.900 1.420 1.00 1.12 H new ATOM 0 HA HIS A1902 20.137 -4.375 2.447 1.00 1.15 H new ATOM 0 HB2 HIS A1902 18.634 -5.033 -0.067 1.00 1.34 H new ATOM 0 HB3 HIS A1902 18.577 -3.419 0.612 1.00 1.34 H new ATOM 0 HD1 HIS A1902 19.901 -3.040 -1.871 1.00 2.46 H new ATOM 0 HD2 HIS A1902 22.051 -4.751 1.282 1.00 2.87 H new ATOM 0 HE1 HIS A1902 22.358 -2.769 -2.438 1.00 3.18 H new ATOM 267 N LEU A1903 18.153 -3.565 3.531 1.00 0.87 N ATOM 268 CA LEU A1903 17.166 -3.178 4.510 1.00 0.75 C ATOM 269 C LEU A1903 16.133 -2.263 3.878 1.00 0.70 C ATOM 270 O LEU A1903 16.427 -1.109 3.548 1.00 0.88 O ATOM 271 CB LEU A1903 17.860 -2.458 5.675 1.00 0.94 C ATOM 272 CG LEU A1903 16.967 -2.013 6.832 1.00 0.99 C ATOM 273 CD1 LEU A1903 16.352 -3.212 7.523 1.00 1.34 C ATOM 274 CD2 LEU A1903 17.754 -1.166 7.822 1.00 1.48 C ATOM 0 H LEU A1903 18.896 -2.876 3.414 1.00 0.87 H new ATOM 0 HA LEU A1903 16.661 -4.069 4.883 1.00 0.75 H new ATOM 0 HB2 LEU A1903 18.630 -3.118 6.073 1.00 0.94 H new ATOM 0 HB3 LEU A1903 18.368 -1.579 5.278 1.00 0.94 H new ATOM 0 HG LEU A1903 16.160 -1.402 6.427 1.00 0.99 H new ATOM 0 HD11 LEU A1903 15.720 -2.874 8.344 1.00 1.34 H new ATOM 0 HD12 LEU A1903 15.750 -3.774 6.809 1.00 1.34 H new ATOM 0 HD13 LEU A1903 17.143 -3.852 7.914 1.00 1.34 H new ATOM 0 HD21 LEU A1903 17.100 -0.859 8.638 1.00 1.48 H new ATOM 0 HD22 LEU A1903 18.584 -1.750 8.221 1.00 1.48 H new ATOM 0 HD23 LEU A1903 18.142 -0.282 7.316 1.00 1.48 H new ATOM 286 N PHE A1904 14.951 -2.772 3.703 1.00 0.53 N ATOM 287 CA PHE A1904 13.881 -2.024 3.096 1.00 0.51 C ATOM 288 C PHE A1904 13.026 -1.416 4.170 1.00 0.48 C ATOM 289 O PHE A1904 12.798 -2.036 5.218 1.00 0.49 O ATOM 290 CB PHE A1904 12.994 -2.928 2.229 1.00 0.51 C ATOM 291 CG PHE A1904 13.665 -3.595 1.055 1.00 0.58 C ATOM 292 CD1 PHE A1904 14.964 -3.262 0.730 1.00 1.01 C ATOM 293 CD2 PHE A1904 13.019 -4.559 0.296 1.00 0.71 C ATOM 294 CE1 PHE A1904 15.603 -3.867 -0.315 1.00 1.17 C ATOM 295 CE2 PHE A1904 13.656 -5.165 -0.752 1.00 0.79 C ATOM 296 CZ PHE A1904 14.834 -4.811 -1.126 1.00 0.86 C ATOM 0 H PHE A1904 14.696 -3.721 3.977 1.00 0.53 H new ATOM 0 HA PHE A1904 14.325 -1.252 2.468 1.00 0.51 H new ATOM 0 HB2 PHE A1904 12.570 -3.704 2.866 1.00 0.51 H new ATOM 0 HB3 PHE A1904 12.162 -2.333 1.854 1.00 0.51 H new ATOM 0 HD1 PHE A1904 15.483 -2.513 1.310 1.00 1.01 H new ATOM 0 HD2 PHE A1904 12.002 -4.834 0.535 1.00 0.71 H new ATOM 0 HE1 PHE A1904 16.639 -3.656 -0.535 1.00 1.17 H new ATOM 0 HE2 PHE A1904 13.155 -5.963 -1.280 1.00 0.79 H new ATOM 0 HZ PHE A1904 15.255 -5.210 -2.037 1.00 0.86 H new ATOM 306 N ASP A1905 12.590 -0.214 3.950 1.00 0.57 N ATOM 307 CA ASP A1905 11.676 0.425 4.856 1.00 0.61 C ATOM 308 C ASP A1905 10.804 1.395 4.143 1.00 0.55 C ATOM 309 O ASP A1905 11.227 2.088 3.222 1.00 0.71 O ATOM 310 CB ASP A1905 12.347 1.103 6.073 1.00 0.88 C ATOM 311 CG ASP A1905 13.357 2.172 5.742 1.00 1.37 C ATOM 312 OD1 ASP A1905 12.948 3.238 5.229 1.00 1.97 O ATOM 313 OD2 ASP A1905 14.574 1.959 5.930 1.00 1.95 O ATOM 0 H ASP A1905 12.854 0.352 3.143 1.00 0.57 H new ATOM 0 HA ASP A1905 11.070 -0.385 5.261 1.00 0.61 H new ATOM 0 HB2 ASP A1905 11.569 1.543 6.697 1.00 0.88 H new ATOM 0 HB3 ASP A1905 12.839 0.335 6.670 1.00 0.88 H new ATOM 318 N LEU A1906 9.583 1.435 4.542 1.00 0.48 N ATOM 319 CA LEU A1906 8.676 2.378 4.011 1.00 0.48 C ATOM 320 C LEU A1906 8.400 3.402 5.060 1.00 0.52 C ATOM 321 O LEU A1906 7.392 3.363 5.782 1.00 0.71 O ATOM 322 CB LEU A1906 7.409 1.732 3.460 1.00 0.50 C ATOM 323 CG LEU A1906 7.625 0.819 2.253 1.00 0.47 C ATOM 324 CD1 LEU A1906 6.327 0.173 1.836 1.00 0.53 C ATOM 325 CD2 LEU A1906 8.228 1.600 1.087 1.00 0.54 C ATOM 0 H LEU A1906 9.188 0.813 5.247 1.00 0.48 H new ATOM 0 HA LEU A1906 9.126 2.866 3.146 1.00 0.48 H new ATOM 0 HB2 LEU A1906 6.938 1.154 4.255 1.00 0.50 H new ATOM 0 HB3 LEU A1906 6.709 2.519 3.181 1.00 0.50 H new ATOM 0 HG LEU A1906 8.325 0.035 2.542 1.00 0.47 H new ATOM 0 HD11 LEU A1906 6.502 -0.473 0.976 1.00 0.53 H new ATOM 0 HD12 LEU A1906 5.934 -0.421 2.661 1.00 0.53 H new ATOM 0 HD13 LEU A1906 5.605 0.945 1.569 1.00 0.53 H new ATOM 0 HD21 LEU A1906 8.374 0.932 0.238 1.00 0.54 H new ATOM 0 HD22 LEU A1906 7.553 2.407 0.802 1.00 0.54 H new ATOM 0 HD23 LEU A1906 9.188 2.019 1.388 1.00 0.54 H new ATOM 337 N THR A1907 9.364 4.241 5.231 1.00 0.66 N ATOM 338 CA THR A1907 9.329 5.290 6.176 1.00 0.74 C ATOM 339 C THR A1907 8.576 6.488 5.615 1.00 0.69 C ATOM 340 O THR A1907 7.474 6.796 6.083 1.00 0.70 O ATOM 341 CB THR A1907 10.760 5.648 6.552 1.00 1.11 C ATOM 342 OG1 THR A1907 11.568 5.505 5.367 1.00 1.59 O ATOM 343 CG2 THR A1907 11.276 4.731 7.652 1.00 1.13 C ATOM 0 H THR A1907 10.229 4.208 4.692 1.00 0.66 H new ATOM 0 HA THR A1907 8.796 4.973 7.072 1.00 0.74 H new ATOM 0 HB THR A1907 10.804 6.669 6.930 1.00 1.11 H new ATOM 0 HG1 THR A1907 12.114 4.695 5.439 1.00 1.59 H new ATOM 0 HG21 THR A1907 12.300 5.006 7.904 1.00 1.13 H new ATOM 0 HG22 THR A1907 10.645 4.832 8.535 1.00 1.13 H new ATOM 0 HG23 THR A1907 11.252 3.698 7.305 1.00 1.13 H new ATOM 351 N SER A1908 9.114 7.073 4.554 1.00 0.83 N ATOM 352 CA SER A1908 8.555 8.272 3.911 1.00 1.00 C ATOM 353 C SER A1908 7.257 7.998 3.155 1.00 0.94 C ATOM 354 O SER A1908 6.636 8.912 2.628 1.00 1.16 O ATOM 355 CB SER A1908 9.591 8.896 3.000 1.00 1.28 C ATOM 356 OG SER A1908 10.803 9.059 3.711 1.00 1.36 O ATOM 0 H SER A1908 9.962 6.730 4.104 1.00 0.83 H new ATOM 0 HA SER A1908 8.297 8.973 4.705 1.00 1.00 H new ATOM 0 HB2 SER A1908 9.751 8.264 2.126 1.00 1.28 H new ATOM 0 HB3 SER A1908 9.238 9.861 2.636 1.00 1.28 H new ATOM 0 HG SER A1908 11.476 9.461 3.123 1.00 1.36 H new ATOM 362 N LEU A1909 6.872 6.743 3.088 1.00 0.76 N ATOM 363 CA LEU A1909 5.652 6.373 2.425 1.00 0.87 C ATOM 364 C LEU A1909 4.437 6.759 3.285 1.00 0.82 C ATOM 365 O LEU A1909 3.349 6.985 2.768 1.00 1.00 O ATOM 366 CB LEU A1909 5.649 4.883 2.119 1.00 0.89 C ATOM 367 CG LEU A1909 5.414 4.497 0.652 1.00 1.28 C ATOM 368 CD1 LEU A1909 4.129 5.106 0.125 1.00 2.03 C ATOM 369 CD2 LEU A1909 6.596 4.914 -0.211 1.00 1.67 C ATOM 0 H LEU A1909 7.392 5.962 3.488 1.00 0.76 H new ATOM 0 HA LEU A1909 5.586 6.915 1.482 1.00 0.87 H new ATOM 0 HB2 LEU A1909 6.605 4.466 2.435 1.00 0.89 H new ATOM 0 HB3 LEU A1909 4.878 4.409 2.727 1.00 0.89 H new ATOM 0 HG LEU A1909 5.317 3.412 0.604 1.00 1.28 H new ATOM 0 HD11 LEU A1909 3.989 4.815 -0.916 1.00 2.03 H new ATOM 0 HD12 LEU A1909 3.287 4.749 0.718 1.00 2.03 H new ATOM 0 HD13 LEU A1909 4.186 6.192 0.194 1.00 2.03 H new ATOM 0 HD21 LEU A1909 6.408 4.631 -1.247 1.00 1.67 H new ATOM 0 HD22 LEU A1909 6.729 5.994 -0.149 1.00 1.67 H new ATOM 0 HD23 LEU A1909 7.499 4.416 0.143 1.00 1.67 H new ATOM 381 N LYS A1910 4.633 6.835 4.593 1.00 0.69 N ATOM 382 CA LYS A1910 3.567 7.284 5.459 1.00 0.78 C ATOM 383 C LYS A1910 3.754 8.785 5.618 1.00 0.81 C ATOM 384 O LYS A1910 4.826 9.266 6.056 1.00 0.92 O ATOM 385 CB LYS A1910 3.537 6.522 6.823 1.00 0.85 C ATOM 386 CG LYS A1910 4.596 6.917 7.843 1.00 1.10 C ATOM 387 CD LYS A1910 4.661 5.920 8.986 1.00 1.40 C ATOM 388 CE LYS A1910 5.186 4.609 8.484 1.00 2.20 C ATOM 389 NZ LYS A1910 6.528 4.795 7.906 1.00 2.72 N ATOM 0 H LYS A1910 5.505 6.596 5.066 1.00 0.69 H new ATOM 0 HA LYS A1910 2.593 7.066 5.021 1.00 0.78 H new ATOM 0 HB2 LYS A1910 2.556 6.669 7.275 1.00 0.85 H new ATOM 0 HB3 LYS A1910 3.638 5.456 6.621 1.00 0.85 H new ATOM 0 HG2 LYS A1910 5.569 6.978 7.355 1.00 1.10 H new ATOM 0 HG3 LYS A1910 4.374 7.909 8.235 1.00 1.10 H new ATOM 0 HD2 LYS A1910 5.306 6.302 9.778 1.00 1.40 H new ATOM 0 HD3 LYS A1910 3.670 5.784 9.419 1.00 1.40 H new ATOM 0 HE2 LYS A1910 5.229 3.888 9.300 1.00 2.20 H new ATOM 0 HE3 LYS A1910 4.510 4.200 7.733 1.00 2.20 H new ATOM 0 HZ1 LYS A1910 6.865 3.893 7.514 1.00 2.72 H new ATOM 0 HZ2 LYS A1910 6.484 5.507 7.149 1.00 2.72 H new ATOM 0 HZ3 LYS A1910 7.183 5.117 8.646 1.00 2.72 H new ATOM 403 N ARG A1911 2.772 9.518 5.192 1.00 0.82 N ATOM 404 CA ARG A1911 2.850 10.953 5.141 1.00 0.91 C ATOM 405 C ARG A1911 1.446 11.540 5.047 1.00 0.98 C ATOM 406 O ARG A1911 0.479 10.837 5.349 1.00 1.03 O ATOM 407 CB ARG A1911 3.770 11.385 3.966 1.00 0.99 C ATOM 408 CG ARG A1911 3.396 10.823 2.599 1.00 1.05 C ATOM 409 CD ARG A1911 4.484 11.119 1.573 1.00 1.26 C ATOM 410 NE ARG A1911 4.139 10.663 0.208 1.00 1.50 N ATOM 411 CZ ARG A1911 5.014 10.499 -0.809 1.00 1.86 C ATOM 412 NH1 ARG A1911 6.331 10.607 -0.599 1.00 1.90 N ATOM 413 NH2 ARG A1911 4.558 10.196 -2.023 1.00 2.60 N ATOM 0 H ARG A1911 1.884 9.137 4.866 1.00 0.82 H new ATOM 0 HA ARG A1911 3.297 11.344 6.055 1.00 0.91 H new ATOM 0 HB2 ARG A1911 3.766 12.473 3.906 1.00 0.99 H new ATOM 0 HB3 ARG A1911 4.791 11.082 4.197 1.00 0.99 H new ATOM 0 HG2 ARG A1911 3.244 9.746 2.673 1.00 1.05 H new ATOM 0 HG3 ARG A1911 2.452 11.256 2.269 1.00 1.05 H new ATOM 0 HD2 ARG A1911 4.673 12.192 1.553 1.00 1.26 H new ATOM 0 HD3 ARG A1911 5.410 10.638 1.886 1.00 1.26 H new ATOM 0 HE ARG A1911 3.159 10.455 0.019 1.00 1.50 H new ATOM 0 HH11 ARG A1911 6.683 10.815 0.335 1.00 1.90 H new ATOM 0 HH12 ARG A1911 6.983 10.481 -1.373 1.00 1.90 H new ATOM 0 HH21 ARG A1911 3.556 10.090 -2.179 1.00 2.60 H new ATOM 0 HH22 ARG A1911 5.211 10.070 -2.796 1.00 2.60 H new ATOM 427 N GLU A1912 1.351 12.814 4.643 1.00 1.18 N ATOM 428 CA GLU A1912 0.094 13.591 4.569 1.00 1.43 C ATOM 429 C GLU A1912 -1.081 12.787 3.975 1.00 1.27 C ATOM 430 O GLU A1912 -2.197 12.789 4.524 1.00 1.48 O ATOM 431 CB GLU A1912 0.331 14.868 3.753 1.00 1.83 C ATOM 432 CG GLU A1912 -0.756 15.915 3.902 1.00 2.47 C ATOM 433 CD GLU A1912 -0.883 16.379 5.333 1.00 2.80 C ATOM 434 OE1 GLU A1912 -0.161 17.303 5.741 1.00 3.16 O ATOM 435 OE2 GLU A1912 -1.680 15.799 6.094 1.00 3.25 O ATOM 0 H GLU A1912 2.166 13.353 4.349 1.00 1.18 H new ATOM 0 HA GLU A1912 -0.192 13.843 5.590 1.00 1.43 H new ATOM 0 HB2 GLU A1912 1.284 15.305 4.053 1.00 1.83 H new ATOM 0 HB3 GLU A1912 0.420 14.601 2.700 1.00 1.83 H new ATOM 0 HG2 GLU A1912 -0.532 16.767 3.260 1.00 2.47 H new ATOM 0 HG3 GLU A1912 -1.708 15.504 3.566 1.00 2.47 H new ATOM 442 N SER A1913 -0.848 12.125 2.879 1.00 1.09 N ATOM 443 CA SER A1913 -1.866 11.303 2.295 1.00 1.05 C ATOM 444 C SER A1913 -1.445 9.837 2.336 1.00 0.93 C ATOM 445 O SER A1913 -2.257 8.957 2.596 1.00 1.08 O ATOM 446 CB SER A1913 -2.163 11.755 0.877 1.00 1.25 C ATOM 447 OG SER A1913 -2.505 13.142 0.855 1.00 1.86 O ATOM 0 H SER A1913 0.037 12.139 2.372 1.00 1.09 H new ATOM 0 HA SER A1913 -2.783 11.407 2.875 1.00 1.05 H new ATOM 0 HB2 SER A1913 -1.294 11.579 0.243 1.00 1.25 H new ATOM 0 HB3 SER A1913 -2.982 11.166 0.465 1.00 1.25 H new ATOM 0 HG SER A1913 -2.692 13.418 -0.066 1.00 1.86 H new ATOM 453 N GLY A1914 -0.178 9.589 2.099 1.00 0.88 N ATOM 454 CA GLY A1914 0.330 8.244 2.139 1.00 0.88 C ATOM 455 C GLY A1914 0.219 7.587 0.791 1.00 0.86 C ATOM 456 O GLY A1914 0.892 7.986 -0.159 1.00 1.14 O ATOM 0 H GLY A1914 0.517 10.302 1.877 1.00 0.88 H new ATOM 0 HA2 GLY A1914 1.372 8.254 2.458 1.00 0.88 H new ATOM 0 HA3 GLY A1914 -0.224 7.664 2.877 1.00 0.88 H new ATOM 460 N TYR A1915 -0.658 6.637 0.677 1.00 0.70 N ATOM 461 CA TYR A1915 -0.840 5.932 -0.561 1.00 0.82 C ATOM 462 C TYR A1915 -2.063 6.549 -1.220 1.00 0.65 C ATOM 463 O TYR A1915 -3.180 6.382 -0.743 1.00 0.66 O ATOM 464 CB TYR A1915 -1.068 4.434 -0.272 1.00 1.06 C ATOM 465 CG TYR A1915 -0.851 3.468 -1.438 1.00 1.50 C ATOM 466 CD1 TYR A1915 -1.577 3.559 -2.624 1.00 1.97 C ATOM 467 CD2 TYR A1915 0.101 2.461 -1.336 1.00 2.32 C ATOM 468 CE1 TYR A1915 -1.355 2.672 -3.667 1.00 2.95 C ATOM 469 CE2 TYR A1915 0.328 1.576 -2.369 1.00 3.26 C ATOM 470 CZ TYR A1915 -0.397 1.682 -3.531 1.00 3.50 C ATOM 471 OH TYR A1915 -0.159 0.803 -4.563 1.00 4.60 O ATOM 0 H TYR A1915 -1.267 6.327 1.434 1.00 0.70 H new ATOM 0 HA TYR A1915 0.031 6.010 -1.211 1.00 0.82 H new ATOM 0 HB2 TYR A1915 -0.405 4.140 0.541 1.00 1.06 H new ATOM 0 HB3 TYR A1915 -2.089 4.309 0.088 1.00 1.06 H new ATOM 0 HD1 TYR A1915 -2.324 4.332 -2.733 1.00 1.97 H new ATOM 0 HD2 TYR A1915 0.676 2.369 -0.427 1.00 2.32 H new ATOM 0 HE1 TYR A1915 -1.926 2.753 -4.580 1.00 2.95 H new ATOM 0 HE2 TYR A1915 1.074 0.802 -2.265 1.00 3.26 H new ATOM 0 HH TYR A1915 0.491 1.195 -5.183 1.00 4.60 H new ATOM 481 N THR A1916 -1.861 7.318 -2.247 1.00 0.65 N ATOM 482 CA THR A1916 -2.965 7.986 -2.892 1.00 0.60 C ATOM 483 C THR A1916 -2.792 8.028 -4.374 1.00 0.60 C ATOM 484 O THR A1916 -1.704 8.290 -4.901 1.00 0.76 O ATOM 485 CB THR A1916 -3.194 9.413 -2.310 1.00 0.79 C ATOM 486 OG1 THR A1916 -3.398 9.325 -0.892 1.00 1.21 O ATOM 487 CG2 THR A1916 -4.408 10.093 -2.944 1.00 1.26 C ATOM 0 H THR A1916 -0.947 7.502 -2.660 1.00 0.65 H new ATOM 0 HA THR A1916 -3.860 7.400 -2.682 1.00 0.60 H new ATOM 0 HB THR A1916 -2.310 10.010 -2.534 1.00 0.79 H new ATOM 0 HG1 THR A1916 -2.530 9.313 -0.437 1.00 1.21 H new ATOM 0 HG21 THR A1916 -4.535 11.086 -2.513 1.00 1.26 H new ATOM 0 HG22 THR A1916 -4.255 10.182 -4.020 1.00 1.26 H new ATOM 0 HG23 THR A1916 -5.300 9.497 -2.752 1.00 1.26 H new ATOM 495 N ILE A1917 -3.864 7.713 -5.016 1.00 0.52 N ATOM 496 CA ILE A1917 -4.011 7.736 -6.419 1.00 0.56 C ATOM 497 C ILE A1917 -5.450 8.043 -6.721 1.00 0.57 C ATOM 498 O ILE A1917 -6.292 8.061 -5.808 1.00 0.59 O ATOM 499 CB ILE A1917 -3.612 6.415 -7.108 1.00 0.59 C ATOM 500 CG1 ILE A1917 -3.616 5.203 -6.142 1.00 0.69 C ATOM 501 CG2 ILE A1917 -2.305 6.550 -7.894 1.00 0.74 C ATOM 502 CD1 ILE A1917 -3.311 3.873 -6.810 1.00 0.74 C ATOM 0 H ILE A1917 -4.713 7.414 -4.537 1.00 0.52 H new ATOM 0 HA ILE A1917 -3.335 8.495 -6.813 1.00 0.56 H new ATOM 0 HB ILE A1917 -4.391 6.201 -7.840 1.00 0.59 H new ATOM 0 HG12 ILE A1917 -2.883 5.378 -5.355 1.00 0.69 H new ATOM 0 HG13 ILE A1917 -4.592 5.140 -5.661 1.00 0.69 H new ATOM 0 HG21 ILE A1917 -2.062 5.596 -8.363 1.00 0.74 H new ATOM 0 HG22 ILE A1917 -2.420 7.313 -8.663 1.00 0.74 H new ATOM 0 HG23 ILE A1917 -1.501 6.836 -7.216 1.00 0.74 H new ATOM 0 HD11 ILE A1917 -3.334 3.078 -6.065 1.00 0.74 H new ATOM 0 HD12 ILE A1917 -4.058 3.672 -7.578 1.00 0.74 H new ATOM 0 HD13 ILE A1917 -2.322 3.914 -7.267 1.00 0.74 H new ATOM 514 N THR A1918 -5.737 8.292 -7.950 1.00 0.65 N ATOM 515 CA THR A1918 -7.067 8.606 -8.337 1.00 0.72 C ATOM 516 C THR A1918 -7.780 7.348 -8.823 1.00 0.68 C ATOM 517 O THR A1918 -7.213 6.552 -9.588 1.00 0.76 O ATOM 518 CB THR A1918 -7.058 9.670 -9.444 1.00 0.94 C ATOM 519 OG1 THR A1918 -6.207 10.772 -9.030 1.00 1.07 O ATOM 520 CG2 THR A1918 -8.473 10.183 -9.685 1.00 1.06 C ATOM 0 H THR A1918 -5.060 8.284 -8.713 1.00 0.65 H new ATOM 0 HA THR A1918 -7.601 9.003 -7.474 1.00 0.72 H new ATOM 0 HB THR A1918 -6.679 9.232 -10.367 1.00 0.94 H new ATOM 0 HG1 THR A1918 -6.193 11.456 -9.731 1.00 1.07 H new ATOM 0 HG21 THR A1918 -8.457 10.937 -10.472 1.00 1.06 H new ATOM 0 HG22 THR A1918 -9.113 9.355 -9.989 1.00 1.06 H new ATOM 0 HG23 THR A1918 -8.861 10.624 -8.767 1.00 1.06 H new ATOM 528 N ASP A1919 -8.985 7.169 -8.367 1.00 0.69 N ATOM 529 CA ASP A1919 -9.810 6.052 -8.763 1.00 0.74 C ATOM 530 C ASP A1919 -10.739 6.551 -9.863 1.00 0.99 C ATOM 531 O ASP A1919 -11.123 7.715 -9.855 1.00 1.30 O ATOM 532 CB ASP A1919 -10.634 5.558 -7.559 1.00 0.76 C ATOM 533 CG ASP A1919 -11.371 4.279 -7.846 1.00 0.99 C ATOM 534 OD1 ASP A1919 -12.483 4.315 -8.378 1.00 1.62 O ATOM 535 OD2 ASP A1919 -10.851 3.227 -7.538 1.00 1.28 O ATOM 0 H ASP A1919 -9.433 7.799 -7.701 1.00 0.69 H new ATOM 0 HA ASP A1919 -9.200 5.222 -9.118 1.00 0.74 H new ATOM 0 HB2 ASP A1919 -9.971 5.407 -6.707 1.00 0.76 H new ATOM 0 HB3 ASP A1919 -11.350 6.329 -7.273 1.00 0.76 H new ATOM 540 N SER A1920 -11.087 5.727 -10.804 1.00 1.06 N ATOM 541 CA SER A1920 -11.942 6.185 -11.884 1.00 1.32 C ATOM 542 C SER A1920 -13.421 5.964 -11.553 1.00 1.30 C ATOM 543 O SER A1920 -14.303 6.630 -12.098 1.00 1.75 O ATOM 544 CB SER A1920 -11.585 5.453 -13.156 1.00 1.64 C ATOM 545 OG SER A1920 -10.173 5.479 -13.373 1.00 2.13 O ATOM 0 H SER A1920 -10.804 4.748 -10.857 1.00 1.06 H new ATOM 0 HA SER A1920 -11.783 7.255 -12.018 1.00 1.32 H new ATOM 0 HB2 SER A1920 -11.930 4.421 -13.097 1.00 1.64 H new ATOM 0 HB3 SER A1920 -12.097 5.912 -14.002 1.00 1.64 H new ATOM 0 HG SER A1920 -9.960 4.999 -14.200 1.00 2.13 H new ATOM 551 N HIS A1921 -13.673 5.080 -10.625 1.00 1.22 N ATOM 552 CA HIS A1921 -15.012 4.687 -10.275 1.00 1.77 C ATOM 553 C HIS A1921 -15.512 5.543 -9.130 1.00 1.73 C ATOM 554 O HIS A1921 -16.549 6.188 -9.217 1.00 2.31 O ATOM 555 CB HIS A1921 -14.993 3.212 -9.848 1.00 2.44 C ATOM 556 CG HIS A1921 -16.335 2.604 -9.589 1.00 3.25 C ATOM 557 ND1 HIS A1921 -17.058 2.802 -8.430 1.00 4.13 N ATOM 558 CD2 HIS A1921 -17.073 1.777 -10.343 1.00 3.75 C ATOM 559 CE1 HIS A1921 -18.167 2.124 -8.496 1.00 4.85 C ATOM 560 NE2 HIS A1921 -18.205 1.488 -9.645 1.00 4.66 N ATOM 0 H HIS A1921 -12.948 4.608 -10.085 1.00 1.22 H new ATOM 0 HA HIS A1921 -15.675 4.819 -11.130 1.00 1.77 H new ATOM 0 HB2 HIS A1921 -14.494 2.632 -10.624 1.00 2.44 H new ATOM 0 HB3 HIS A1921 -14.390 3.120 -8.944 1.00 2.44 H new ATOM 0 HD1 HIS A1921 -16.769 3.387 -7.646 1.00 4.13 H new ATOM 0 HD2 HIS A1921 -16.816 1.408 -11.325 1.00 3.75 H new ATOM 0 HE1 HIS A1921 -18.930 2.090 -7.732 1.00 4.85 H new ATOM 569 N ASN A1922 -14.755 5.536 -8.076 1.00 1.59 N ATOM 570 CA ASN A1922 -15.109 6.203 -6.842 1.00 1.80 C ATOM 571 C ASN A1922 -14.312 7.439 -6.632 1.00 1.38 C ATOM 572 O ASN A1922 -14.536 8.159 -5.654 1.00 1.72 O ATOM 573 CB ASN A1922 -14.869 5.291 -5.700 1.00 2.28 C ATOM 574 CG ASN A1922 -15.825 4.111 -5.676 1.00 3.05 C ATOM 575 OD1 ASN A1922 -17.021 4.247 -5.984 1.00 3.29 O ATOM 576 ND2 ASN A1922 -15.298 2.938 -5.487 1.00 3.89 N ATOM 0 H ASN A1922 -13.854 5.059 -8.040 1.00 1.59 H new ATOM 0 HA ASN A1922 -16.162 6.476 -6.908 1.00 1.80 H new ATOM 0 HB2 ASN A1922 -13.845 4.921 -5.746 1.00 2.28 H new ATOM 0 HB3 ASN A1922 -14.965 5.849 -4.769 1.00 2.28 H new ATOM 0 HD21 ASN A1922 -15.869 2.099 -5.591 1.00 3.89 H new ATOM 0 HD22 ASN A1922 -14.313 2.856 -5.235 1.00 3.89 H new ATOM 583 N ARG A1923 -13.345 7.657 -7.516 1.00 0.98 N ATOM 584 CA ARG A1923 -12.524 8.872 -7.558 1.00 0.97 C ATOM 585 C ARG A1923 -11.375 8.921 -6.532 1.00 0.83 C ATOM 586 O ARG A1923 -10.228 9.178 -6.900 1.00 0.99 O ATOM 587 CB ARG A1923 -13.395 10.109 -7.458 1.00 1.46 C ATOM 588 CG ARG A1923 -14.357 10.297 -8.627 1.00 1.89 C ATOM 589 CD ARG A1923 -15.244 11.505 -8.391 1.00 2.66 C ATOM 590 NE ARG A1923 -15.988 11.379 -7.127 1.00 2.93 N ATOM 591 CZ ARG A1923 -16.201 12.374 -6.255 1.00 3.73 C ATOM 592 NH1 ARG A1923 -15.930 13.627 -6.574 1.00 4.35 N ATOM 593 NH2 ARG A1923 -16.745 12.105 -5.084 1.00 4.26 N ATOM 0 H ARG A1923 -13.101 6.982 -8.241 1.00 0.98 H new ATOM 0 HA ARG A1923 -12.028 8.847 -8.528 1.00 0.97 H new ATOM 0 HB2 ARG A1923 -13.971 10.060 -6.534 1.00 1.46 H new ATOM 0 HB3 ARG A1923 -12.752 10.987 -7.387 1.00 1.46 H new ATOM 0 HG2 ARG A1923 -13.795 10.425 -9.552 1.00 1.89 H new ATOM 0 HG3 ARG A1923 -14.971 9.405 -8.748 1.00 1.89 H new ATOM 0 HD2 ARG A1923 -14.635 12.408 -8.369 1.00 2.66 H new ATOM 0 HD3 ARG A1923 -15.944 11.613 -9.219 1.00 2.66 H new ATOM 0 HE ARG A1923 -16.372 10.462 -6.897 1.00 2.93 H new ATOM 0 HH11 ARG A1923 -15.553 13.849 -7.495 1.00 4.35 H new ATOM 0 HH12 ARG A1923 -16.098 14.373 -5.899 1.00 4.35 H new ATOM 0 HH21 ARG A1923 -17.000 11.146 -4.848 1.00 4.26 H new ATOM 0 HH22 ARG A1923 -16.911 12.856 -4.414 1.00 4.26 H new ATOM 607 N LYS A1924 -11.649 8.648 -5.286 1.00 0.68 N ATOM 608 CA LYS A1924 -10.649 8.844 -4.249 1.00 0.67 C ATOM 609 C LYS A1924 -10.063 7.510 -3.732 1.00 0.53 C ATOM 610 O LYS A1924 -10.775 6.699 -3.148 1.00 0.55 O ATOM 611 CB LYS A1924 -11.303 9.612 -3.100 1.00 0.87 C ATOM 612 CG LYS A1924 -10.364 10.138 -2.037 1.00 1.32 C ATOM 613 CD LYS A1924 -9.535 11.302 -2.544 1.00 1.59 C ATOM 614 CE LYS A1924 -8.710 11.885 -1.420 1.00 2.07 C ATOM 615 NZ LYS A1924 -7.962 13.084 -1.820 1.00 2.72 N ATOM 0 H LYS A1924 -12.546 8.292 -4.956 1.00 0.68 H new ATOM 0 HA LYS A1924 -9.815 9.405 -4.671 1.00 0.67 H new ATOM 0 HB2 LYS A1924 -11.854 10.454 -3.519 1.00 0.87 H new ATOM 0 HB3 LYS A1924 -12.033 8.959 -2.622 1.00 0.87 H new ATOM 0 HG2 LYS A1924 -10.940 10.454 -1.167 1.00 1.32 H new ATOM 0 HG3 LYS A1924 -9.702 9.337 -1.708 1.00 1.32 H new ATOM 0 HD2 LYS A1924 -8.881 10.968 -3.349 1.00 1.59 H new ATOM 0 HD3 LYS A1924 -10.188 12.069 -2.961 1.00 1.59 H new ATOM 0 HE2 LYS A1924 -9.366 12.134 -0.586 1.00 2.07 H new ATOM 0 HE3 LYS A1924 -8.011 11.130 -1.061 1.00 2.07 H new ATOM 0 HZ1 LYS A1924 -7.416 13.439 -1.009 1.00 2.72 H new ATOM 0 HZ2 LYS A1924 -7.313 12.845 -2.597 1.00 2.72 H new ATOM 0 HZ3 LYS A1924 -8.627 13.818 -2.137 1.00 2.72 H new ATOM 629 N ILE A1925 -8.774 7.286 -3.962 1.00 0.49 N ATOM 630 CA ILE A1925 -8.079 6.114 -3.418 1.00 0.44 C ATOM 631 C ILE A1925 -7.096 6.577 -2.351 1.00 0.44 C ATOM 632 O ILE A1925 -6.089 7.225 -2.679 1.00 0.51 O ATOM 633 CB ILE A1925 -7.272 5.317 -4.502 1.00 0.51 C ATOM 634 CG1 ILE A1925 -8.183 4.765 -5.577 1.00 0.53 C ATOM 635 CG2 ILE A1925 -6.479 4.178 -3.866 1.00 0.56 C ATOM 636 CD1 ILE A1925 -7.451 3.994 -6.683 1.00 0.64 C ATOM 0 H ILE A1925 -8.183 7.900 -4.523 1.00 0.49 H new ATOM 0 HA ILE A1925 -8.844 5.451 -3.015 1.00 0.44 H new ATOM 0 HB ILE A1925 -6.577 6.018 -4.964 1.00 0.51 H new ATOM 0 HG12 ILE A1925 -8.916 4.105 -5.113 1.00 0.53 H new ATOM 0 HG13 ILE A1925 -8.736 5.589 -6.028 1.00 0.53 H new ATOM 0 HG21 ILE A1925 -5.929 3.642 -4.639 1.00 0.56 H new ATOM 0 HG22 ILE A1925 -5.778 4.585 -3.138 1.00 0.56 H new ATOM 0 HG23 ILE A1925 -7.164 3.493 -3.366 1.00 0.56 H new ATOM 0 HD11 ILE A1925 -8.174 3.631 -7.414 1.00 0.64 H new ATOM 0 HD12 ILE A1925 -6.737 4.654 -7.176 1.00 0.64 H new ATOM 0 HD13 ILE A1925 -6.921 3.148 -6.247 1.00 0.64 H new ATOM 648 N GLU A1926 -7.379 6.280 -1.099 1.00 0.43 N ATOM 649 CA GLU A1926 -6.469 6.640 -0.024 1.00 0.48 C ATOM 650 C GLU A1926 -6.186 5.482 0.900 1.00 0.46 C ATOM 651 O GLU A1926 -7.099 4.805 1.399 1.00 0.56 O ATOM 652 CB GLU A1926 -6.907 7.855 0.787 1.00 0.67 C ATOM 653 CG GLU A1926 -6.846 9.171 0.054 1.00 1.40 C ATOM 654 CD GLU A1926 -6.950 10.340 0.999 1.00 1.65 C ATOM 655 OE1 GLU A1926 -8.033 10.607 1.516 1.00 1.95 O ATOM 656 OE2 GLU A1926 -5.927 11.015 1.250 1.00 2.28 O ATOM 0 H GLU A1926 -8.224 5.794 -0.799 1.00 0.43 H new ATOM 0 HA GLU A1926 -5.549 6.917 -0.538 1.00 0.48 H new ATOM 0 HB2 GLU A1926 -7.930 7.695 1.129 1.00 0.67 H new ATOM 0 HB3 GLU A1926 -6.281 7.923 1.677 1.00 0.67 H new ATOM 0 HG2 GLU A1926 -5.911 9.235 -0.502 1.00 1.40 H new ATOM 0 HG3 GLU A1926 -7.655 9.219 -0.675 1.00 1.40 H new ATOM 663 N LEU A1927 -4.923 5.249 1.088 1.00 0.44 N ATOM 664 CA LEU A1927 -4.419 4.232 1.961 1.00 0.51 C ATOM 665 C LEU A1927 -3.305 4.846 2.750 1.00 0.46 C ATOM 666 O LEU A1927 -2.802 5.916 2.379 1.00 0.61 O ATOM 667 CB LEU A1927 -3.771 3.053 1.191 1.00 0.68 C ATOM 668 CG LEU A1927 -4.575 2.207 0.205 1.00 0.87 C ATOM 669 CD1 LEU A1927 -5.016 2.989 -1.011 1.00 1.54 C ATOM 670 CD2 LEU A1927 -3.719 1.061 -0.228 1.00 1.48 C ATOM 0 H LEU A1927 -4.188 5.781 0.621 1.00 0.44 H new ATOM 0 HA LEU A1927 -5.253 3.862 2.557 1.00 0.51 H new ATOM 0 HB2 LEU A1927 -2.923 3.461 0.641 1.00 0.68 H new ATOM 0 HB3 LEU A1927 -3.367 2.370 1.938 1.00 0.68 H new ATOM 0 HG LEU A1927 -5.480 1.866 0.708 1.00 0.87 H new ATOM 0 HD11 LEU A1927 -5.583 2.338 -1.676 1.00 1.54 H new ATOM 0 HD12 LEU A1927 -5.644 3.824 -0.699 1.00 1.54 H new ATOM 0 HD13 LEU A1927 -4.140 3.370 -1.536 1.00 1.54 H new ATOM 0 HD21 LEU A1927 -4.271 0.441 -0.934 1.00 1.48 H new ATOM 0 HD22 LEU A1927 -2.817 1.441 -0.708 1.00 1.48 H new ATOM 0 HD23 LEU A1927 -3.443 0.464 0.641 1.00 1.48 H new ATOM 682 N ASN A1928 -2.883 4.202 3.786 1.00 0.51 N ATOM 683 CA ASN A1928 -1.684 4.653 4.456 1.00 0.51 C ATOM 684 C ASN A1928 -0.750 3.466 4.530 1.00 0.64 C ATOM 685 O ASN A1928 -1.207 2.325 4.618 1.00 0.81 O ATOM 686 CB ASN A1928 -1.946 5.229 5.850 1.00 0.55 C ATOM 687 CG ASN A1928 -0.814 6.153 6.320 1.00 0.54 C ATOM 688 OD1 ASN A1928 0.307 6.100 5.819 1.00 0.88 O ATOM 689 ND2 ASN A1928 -1.071 6.938 7.332 1.00 0.80 N ATOM 0 H ASN A1928 -3.330 3.379 4.189 1.00 0.51 H new ATOM 0 HA ASN A1928 -1.247 5.476 3.890 1.00 0.51 H new ATOM 0 HB2 ASN A1928 -2.885 5.783 5.841 1.00 0.55 H new ATOM 0 HB3 ASN A1928 -2.065 4.412 6.562 1.00 0.55 H new ATOM 0 HD21 ASN A1928 -0.333 7.524 7.723 1.00 0.80 H new ATOM 0 HD22 ASN A1928 -2.009 6.965 7.731 1.00 0.80 H new ATOM 696 N VAL A1929 0.527 3.710 4.480 1.00 0.65 N ATOM 697 CA VAL A1929 1.494 2.650 4.407 1.00 0.82 C ATOM 698 C VAL A1929 2.171 2.392 5.745 1.00 0.87 C ATOM 699 O VAL A1929 3.001 3.193 6.211 1.00 1.69 O ATOM 700 CB VAL A1929 2.538 2.915 3.295 1.00 0.99 C ATOM 701 CG1 VAL A1929 3.633 1.866 3.306 1.00 1.51 C ATOM 702 CG2 VAL A1929 1.848 2.934 1.941 1.00 1.73 C ATOM 0 H VAL A1929 0.929 4.648 4.489 1.00 0.65 H new ATOM 0 HA VAL A1929 0.947 1.744 4.147 1.00 0.82 H new ATOM 0 HB VAL A1929 3.001 3.884 3.483 1.00 0.99 H new ATOM 0 HG11 VAL A1929 4.350 2.080 2.514 1.00 1.51 H new ATOM 0 HG12 VAL A1929 4.142 1.881 4.270 1.00 1.51 H new ATOM 0 HG13 VAL A1929 3.195 0.881 3.143 1.00 1.51 H new ATOM 0 HG21 VAL A1929 2.585 3.121 1.160 1.00 1.73 H new ATOM 0 HG22 VAL A1929 1.367 1.972 1.764 1.00 1.73 H new ATOM 0 HG23 VAL A1929 1.096 3.723 1.927 1.00 1.73 H new ATOM 712 N CYS A1930 1.772 1.280 6.373 1.00 0.74 N ATOM 713 CA CYS A1930 2.326 0.801 7.651 1.00 0.83 C ATOM 714 C CYS A1930 1.833 1.667 8.805 1.00 0.74 C ATOM 715 O CYS A1930 2.223 1.496 9.961 1.00 0.97 O ATOM 716 CB CYS A1930 3.877 0.722 7.598 1.00 1.01 C ATOM 717 SG CYS A1930 4.694 0.081 9.105 1.00 1.20 S ATOM 0 H CYS A1930 1.040 0.674 6.002 1.00 0.74 H new ATOM 0 HA CYS A1930 1.966 -0.213 7.825 1.00 0.83 H new ATOM 0 HB2 CYS A1930 4.161 0.090 6.757 1.00 1.01 H new ATOM 0 HB3 CYS A1930 4.266 1.719 7.393 1.00 1.01 H new ATOM 722 N ALA A1931 0.935 2.545 8.494 1.00 0.63 N ATOM 723 CA ALA A1931 0.390 3.440 9.442 1.00 0.65 C ATOM 724 C ALA A1931 -1.080 3.439 9.281 1.00 0.75 C ATOM 725 O ALA A1931 -1.584 3.114 8.203 1.00 1.31 O ATOM 726 CB ALA A1931 0.941 4.836 9.233 1.00 0.62 C ATOM 0 H ALA A1931 0.557 2.656 7.553 1.00 0.63 H new ATOM 0 HA ALA A1931 0.659 3.124 10.450 1.00 0.65 H new ATOM 0 HB1 ALA A1931 0.510 5.512 9.972 1.00 0.62 H new ATOM 0 HB2 ALA A1931 2.025 4.820 9.345 1.00 0.62 H new ATOM 0 HB3 ALA A1931 0.685 5.182 8.232 1.00 0.62 H new ATOM 732 N GLU A1932 -1.750 3.745 10.342 1.00 0.53 N ATOM 733 CA GLU A1932 -3.184 3.827 10.382 1.00 0.58 C ATOM 734 C GLU A1932 -3.644 4.843 9.346 1.00 0.48 C ATOM 735 O GLU A1932 -3.018 5.916 9.214 1.00 0.49 O ATOM 736 CB GLU A1932 -3.668 4.240 11.790 1.00 0.84 C ATOM 737 CG GLU A1932 -3.179 3.343 12.947 1.00 0.82 C ATOM 738 CD GLU A1932 -1.738 3.622 13.413 1.00 1.32 C ATOM 739 OE1 GLU A1932 -0.800 3.170 12.747 1.00 2.07 O ATOM 740 OE2 GLU A1932 -1.526 4.332 14.441 1.00 1.72 O ATOM 0 H GLU A1932 -1.306 3.953 11.237 1.00 0.53 H new ATOM 0 HA GLU A1932 -3.610 2.849 10.156 1.00 0.58 H new ATOM 0 HB2 GLU A1932 -3.342 5.262 11.982 1.00 0.84 H new ATOM 0 HB3 GLU A1932 -4.758 4.247 11.794 1.00 0.84 H new ATOM 0 HG2 GLU A1932 -3.852 3.469 13.795 1.00 0.82 H new ATOM 0 HG3 GLU A1932 -3.250 2.301 12.636 1.00 0.82 H new ATOM 747 N ALA A1933 -4.689 4.508 8.592 1.00 0.51 N ATOM 748 CA ALA A1933 -5.158 5.373 7.523 1.00 0.57 C ATOM 749 C ALA A1933 -5.457 6.769 8.021 1.00 0.59 C ATOM 750 O ALA A1933 -6.328 6.977 8.870 1.00 0.77 O ATOM 751 CB ALA A1933 -6.356 4.788 6.789 1.00 0.74 C ATOM 0 H ALA A1933 -5.222 3.646 8.704 1.00 0.51 H new ATOM 0 HA ALA A1933 -4.341 5.443 6.804 1.00 0.57 H new ATOM 0 HB1 ALA A1933 -6.669 5.472 6.000 1.00 0.74 H new ATOM 0 HB2 ALA A1933 -6.081 3.829 6.350 1.00 0.74 H new ATOM 0 HB3 ALA A1933 -7.178 4.644 7.491 1.00 0.74 H new ATOM 757 N LYS A1934 -4.703 7.719 7.490 1.00 0.62 N ATOM 758 CA LYS A1934 -4.846 9.131 7.824 1.00 0.76 C ATOM 759 C LYS A1934 -5.990 9.677 6.981 1.00 0.88 C ATOM 760 O LYS A1934 -6.448 10.802 7.136 1.00 1.28 O ATOM 761 CB LYS A1934 -3.525 9.860 7.506 1.00 0.98 C ATOM 762 CG LYS A1934 -3.417 11.283 8.054 1.00 1.65 C ATOM 763 CD LYS A1934 -2.055 11.899 7.735 1.00 2.13 C ATOM 764 CE LYS A1934 -0.899 11.139 8.397 1.00 2.78 C ATOM 765 NZ LYS A1934 -0.902 11.264 9.877 1.00 3.10 N ATOM 0 H LYS A1934 -3.967 7.532 6.809 1.00 0.62 H new ATOM 0 HA LYS A1934 -5.063 9.278 8.882 1.00 0.76 H new ATOM 0 HB2 LYS A1934 -2.699 9.271 7.904 1.00 0.98 H new ATOM 0 HB3 LYS A1934 -3.399 9.894 6.424 1.00 0.98 H new ATOM 0 HG2 LYS A1934 -4.207 11.901 7.627 1.00 1.65 H new ATOM 0 HG3 LYS A1934 -3.570 11.272 9.133 1.00 1.65 H new ATOM 0 HD2 LYS A1934 -1.908 11.909 6.655 1.00 2.13 H new ATOM 0 HD3 LYS A1934 -2.042 12.937 8.068 1.00 2.13 H new ATOM 0 HE2 LYS A1934 -0.960 10.085 8.126 1.00 2.78 H new ATOM 0 HE3 LYS A1934 0.047 11.514 8.007 1.00 2.78 H new ATOM 0 HZ1 LYS A1934 -0.072 10.774 10.268 1.00 3.10 H new ATOM 0 HZ2 LYS A1934 -0.867 12.269 10.141 1.00 3.10 H new ATOM 0 HZ3 LYS A1934 -1.769 10.836 10.260 1.00 3.10 H new ATOM 779 N SER A1935 -6.428 8.827 6.093 1.00 0.93 N ATOM 780 CA SER A1935 -7.504 9.040 5.205 1.00 1.23 C ATOM 781 C SER A1935 -8.830 9.090 6.001 1.00 1.17 C ATOM 782 O SER A1935 -8.844 8.923 7.233 1.00 2.00 O ATOM 783 CB SER A1935 -7.490 7.846 4.292 1.00 1.67 C ATOM 784 OG SER A1935 -6.139 7.480 4.020 1.00 2.17 O ATOM 0 H SER A1935 -6.003 7.908 5.974 1.00 0.93 H new ATOM 0 HA SER A1935 -7.417 9.977 4.655 1.00 1.23 H new ATOM 0 HB2 SER A1935 -8.019 7.013 4.755 1.00 1.67 H new ATOM 0 HB3 SER A1935 -8.011 8.077 3.363 1.00 1.67 H new ATOM 0 HG SER A1935 -6.121 6.614 3.562 1.00 2.17 H new ATOM 790 N SER A1936 -9.930 9.227 5.313 1.00 0.99 N ATOM 791 CA SER A1936 -11.230 9.363 5.945 1.00 1.20 C ATOM 792 C SER A1936 -11.825 8.000 6.368 1.00 0.95 C ATOM 793 O SER A1936 -13.036 7.869 6.526 1.00 1.08 O ATOM 794 CB SER A1936 -12.152 10.094 4.979 1.00 1.80 C ATOM 795 OG SER A1936 -11.569 11.344 4.616 1.00 2.28 O ATOM 0 H SER A1936 -9.959 9.249 4.294 1.00 0.99 H new ATOM 0 HA SER A1936 -11.120 9.936 6.866 1.00 1.20 H new ATOM 0 HB2 SER A1936 -12.319 9.487 4.089 1.00 1.80 H new ATOM 0 HB3 SER A1936 -13.126 10.256 5.441 1.00 1.80 H new ATOM 0 HG SER A1936 -12.162 11.813 3.993 1.00 2.28 H new ATOM 801 N CYS A1937 -10.963 7.008 6.592 1.00 0.87 N ATOM 802 CA CYS A1937 -11.402 5.689 7.006 1.00 0.93 C ATOM 803 C CYS A1937 -11.912 5.747 8.448 1.00 1.22 C ATOM 804 O CYS A1937 -13.118 5.791 8.670 1.00 1.98 O ATOM 805 CB CYS A1937 -10.264 4.681 6.907 1.00 1.06 C ATOM 806 SG CYS A1937 -9.485 4.585 5.290 1.00 1.44 S ATOM 0 H CYS A1937 -9.952 7.101 6.491 1.00 0.87 H new ATOM 0 HA CYS A1937 -12.205 5.369 6.343 1.00 0.93 H new ATOM 0 HB2 CYS A1937 -9.505 4.937 7.646 1.00 1.06 H new ATOM 0 HB3 CYS A1937 -10.646 3.695 7.170 1.00 1.06 H new ATOM 811 N ALA A1938 -10.965 5.758 9.405 1.00 0.97 N ATOM 812 CA ALA A1938 -11.201 5.935 10.836 1.00 1.24 C ATOM 813 C ALA A1938 -9.901 5.676 11.598 1.00 1.13 C ATOM 814 O ALA A1938 -9.067 6.572 11.713 1.00 1.32 O ATOM 815 CB ALA A1938 -12.320 5.033 11.394 1.00 1.48 C ATOM 0 H ALA A1938 -9.976 5.638 9.185 1.00 0.97 H new ATOM 0 HA ALA A1938 -11.537 6.963 10.976 1.00 1.24 H new ATOM 0 HB1 ALA A1938 -12.439 5.219 12.461 1.00 1.48 H new ATOM 0 HB2 ALA A1938 -13.256 5.254 10.881 1.00 1.48 H new ATOM 0 HB3 ALA A1938 -12.058 3.987 11.235 1.00 1.48 H new ATOM 821 N ASN A1939 -9.690 4.456 12.056 1.00 0.94 N ATOM 822 CA ASN A1939 -8.485 4.113 12.755 1.00 0.94 C ATOM 823 C ASN A1939 -7.742 2.943 12.140 1.00 0.69 C ATOM 824 O ASN A1939 -6.781 3.107 11.406 1.00 0.89 O ATOM 825 CB ASN A1939 -8.708 3.894 14.257 1.00 1.19 C ATOM 826 CG ASN A1939 -9.176 5.137 14.981 1.00 1.51 C ATOM 827 OD1 ASN A1939 -10.372 5.380 15.112 1.00 2.13 O ATOM 828 ND2 ASN A1939 -8.255 5.935 15.435 1.00 2.10 N ATOM 0 H ASN A1939 -10.350 3.686 11.950 1.00 0.94 H new ATOM 0 HA ASN A1939 -7.844 4.987 12.643 1.00 0.94 H new ATOM 0 HB2 ASN A1939 -9.444 3.102 14.396 1.00 1.19 H new ATOM 0 HB3 ASN A1939 -7.778 3.548 14.708 1.00 1.19 H new ATOM 0 HD21 ASN A1939 -8.517 6.794 15.918 1.00 2.10 H new ATOM 0 HD22 ASN A1939 -7.270 5.702 15.308 1.00 2.10 H new ATOM 835 N GLY A1940 -8.284 1.762 12.393 1.00 0.57 N ATOM 836 CA GLY A1940 -7.638 0.501 12.083 1.00 0.70 C ATOM 837 C GLY A1940 -7.788 0.033 10.654 1.00 0.61 C ATOM 838 O GLY A1940 -7.482 -1.122 10.352 1.00 0.79 O ATOM 0 H GLY A1940 -9.201 1.654 12.827 1.00 0.57 H new ATOM 0 HA2 GLY A1940 -6.575 0.591 12.309 1.00 0.70 H new ATOM 0 HA3 GLY A1940 -8.041 -0.267 12.744 1.00 0.70 H new ATOM 842 N ALA A1941 -8.280 0.878 9.795 1.00 0.47 N ATOM 843 CA ALA A1941 -8.376 0.556 8.391 1.00 0.46 C ATOM 844 C ALA A1941 -7.147 1.108 7.699 1.00 0.42 C ATOM 845 O ALA A1941 -6.517 2.034 8.218 1.00 0.62 O ATOM 846 CB ALA A1941 -9.641 1.140 7.787 1.00 0.52 C ATOM 0 H ALA A1941 -8.626 1.806 10.041 1.00 0.47 H new ATOM 0 HA ALA A1941 -8.426 -0.525 8.260 1.00 0.46 H new ATOM 0 HB1 ALA A1941 -9.691 0.884 6.729 1.00 0.52 H new ATOM 0 HB2 ALA A1941 -10.511 0.732 8.300 1.00 0.52 H new ATOM 0 HB3 ALA A1941 -9.630 2.224 7.898 1.00 0.52 H new ATOM 852 N ALA A1942 -6.779 0.544 6.571 1.00 0.36 N ATOM 853 CA ALA A1942 -5.602 1.024 5.864 1.00 0.38 C ATOM 854 C ALA A1942 -5.906 1.374 4.442 1.00 0.40 C ATOM 855 O ALA A1942 -5.337 2.315 3.911 1.00 0.49 O ATOM 856 CB ALA A1942 -4.482 0.010 5.913 1.00 0.44 C ATOM 0 H ALA A1942 -7.264 -0.235 6.125 1.00 0.36 H new ATOM 0 HA ALA A1942 -5.281 1.931 6.375 1.00 0.38 H new ATOM 0 HB1 ALA A1942 -3.616 0.398 5.376 1.00 0.44 H new ATOM 0 HB2 ALA A1942 -4.209 -0.181 6.951 1.00 0.44 H new ATOM 0 HB3 ALA A1942 -4.812 -0.919 5.447 1.00 0.44 H new ATOM 862 N VAL A1943 -6.791 0.609 3.823 1.00 0.41 N ATOM 863 CA VAL A1943 -7.126 0.809 2.427 1.00 0.42 C ATOM 864 C VAL A1943 -8.573 1.213 2.305 1.00 0.39 C ATOM 865 O VAL A1943 -9.478 0.421 2.655 1.00 0.43 O ATOM 866 CB VAL A1943 -6.949 -0.506 1.624 1.00 0.52 C ATOM 867 CG1 VAL A1943 -7.133 -0.283 0.128 1.00 0.73 C ATOM 868 CG2 VAL A1943 -5.620 -1.156 1.920 1.00 0.75 C ATOM 0 H VAL A1943 -7.291 -0.159 4.270 1.00 0.41 H new ATOM 0 HA VAL A1943 -6.464 1.581 2.035 1.00 0.42 H new ATOM 0 HB VAL A1943 -7.733 -1.190 1.949 1.00 0.52 H new ATOM 0 HG11 VAL A1943 -7.001 -1.228 -0.400 1.00 0.73 H new ATOM 0 HG12 VAL A1943 -8.135 0.102 -0.062 1.00 0.73 H new ATOM 0 HG13 VAL A1943 -6.395 0.436 -0.226 1.00 0.73 H new ATOM 0 HG21 VAL A1943 -5.528 -2.075 1.341 1.00 0.75 H new ATOM 0 HG22 VAL A1943 -4.813 -0.474 1.650 1.00 0.75 H new ATOM 0 HG23 VAL A1943 -5.558 -1.389 2.983 1.00 0.75 H new ATOM 878 N CYS A1944 -8.814 2.396 1.810 1.00 0.41 N ATOM 879 CA CYS A1944 -10.163 2.841 1.593 1.00 0.49 C ATOM 880 C CYS A1944 -10.317 3.517 0.263 1.00 0.47 C ATOM 881 O CYS A1944 -9.498 4.357 -0.136 1.00 0.54 O ATOM 882 CB CYS A1944 -10.614 3.803 2.668 1.00 0.70 C ATOM 883 SG CYS A1944 -10.543 3.155 4.352 1.00 1.15 S ATOM 0 H CYS A1944 -8.094 3.069 1.549 1.00 0.41 H new ATOM 0 HA CYS A1944 -10.783 1.945 1.621 1.00 0.49 H new ATOM 0 HB2 CYS A1944 -9.997 4.700 2.614 1.00 0.70 H new ATOM 0 HB3 CYS A1944 -11.639 4.108 2.455 1.00 0.70 H new ATOM 888 N ILE A1945 -11.335 3.136 -0.434 1.00 0.46 N ATOM 889 CA ILE A1945 -11.701 3.818 -1.629 1.00 0.49 C ATOM 890 C ILE A1945 -12.840 4.737 -1.220 1.00 0.49 C ATOM 891 O ILE A1945 -13.946 4.275 -0.921 1.00 0.54 O ATOM 892 CB ILE A1945 -12.167 2.846 -2.742 1.00 0.56 C ATOM 893 CG1 ILE A1945 -11.166 1.677 -2.924 1.00 0.54 C ATOM 894 CG2 ILE A1945 -12.320 3.609 -4.045 1.00 0.68 C ATOM 895 CD1 ILE A1945 -9.757 2.088 -3.325 1.00 0.56 C ATOM 0 H ILE A1945 -11.934 2.347 -0.192 1.00 0.46 H new ATOM 0 HA ILE A1945 -10.850 4.356 -2.047 1.00 0.49 H new ATOM 0 HB ILE A1945 -13.127 2.420 -2.450 1.00 0.56 H new ATOM 0 HG12 ILE A1945 -11.112 1.117 -1.990 1.00 0.54 H new ATOM 0 HG13 ILE A1945 -11.559 0.998 -3.681 1.00 0.54 H new ATOM 0 HG21 ILE A1945 -12.648 2.927 -4.830 1.00 0.68 H new ATOM 0 HG22 ILE A1945 -13.060 4.400 -3.919 1.00 0.68 H new ATOM 0 HG23 ILE A1945 -11.362 4.049 -4.324 1.00 0.68 H new ATOM 0 HD11 ILE A1945 -9.134 1.199 -3.427 1.00 0.56 H new ATOM 0 HD12 ILE A1945 -9.790 2.619 -4.276 1.00 0.56 H new ATOM 0 HD13 ILE A1945 -9.336 2.740 -2.560 1.00 0.56 H new ATOM 907 N THR A1946 -12.557 5.991 -1.121 1.00 0.48 N ATOM 908 CA THR A1946 -13.489 6.931 -0.575 1.00 0.51 C ATOM 909 C THR A1946 -14.458 7.434 -1.642 1.00 0.53 C ATOM 910 O THR A1946 -14.096 8.260 -2.485 1.00 0.61 O ATOM 911 CB THR A1946 -12.741 8.138 0.027 1.00 0.61 C ATOM 912 OG1 THR A1946 -11.534 7.688 0.678 1.00 0.91 O ATOM 913 CG2 THR A1946 -13.602 8.846 1.068 1.00 0.79 C ATOM 0 H THR A1946 -11.670 6.400 -1.416 1.00 0.48 H new ATOM 0 HA THR A1946 -14.054 6.417 0.203 1.00 0.51 H new ATOM 0 HB THR A1946 -12.508 8.827 -0.785 1.00 0.61 H new ATOM 0 HG1 THR A1946 -11.061 8.458 1.058 1.00 0.91 H new ATOM 0 HG21 THR A1946 -13.053 9.694 1.478 1.00 0.79 H new ATOM 0 HG22 THR A1946 -14.521 9.200 0.600 1.00 0.79 H new ATOM 0 HG23 THR A1946 -13.848 8.151 1.870 1.00 0.79 H new ATOM 921 N ASP A1947 -15.664 6.920 -1.646 1.00 0.58 N ATOM 922 CA ASP A1947 -16.639 7.444 -2.542 1.00 0.74 C ATOM 923 C ASP A1947 -17.473 8.484 -1.825 1.00 0.78 C ATOM 924 O ASP A1947 -18.426 8.177 -1.103 1.00 0.77 O ATOM 925 CB ASP A1947 -17.492 6.366 -3.276 1.00 0.91 C ATOM 926 CG ASP A1947 -18.468 5.530 -2.466 1.00 1.21 C ATOM 927 OD1 ASP A1947 -18.061 4.622 -1.725 1.00 1.94 O ATOM 928 OD2 ASP A1947 -19.697 5.692 -2.667 1.00 1.24 O ATOM 0 H ASP A1947 -15.980 6.156 -1.049 1.00 0.58 H new ATOM 0 HA ASP A1947 -16.104 7.926 -3.360 1.00 0.74 H new ATOM 0 HB2 ASP A1947 -18.059 6.870 -4.058 1.00 0.91 H new ATOM 0 HB3 ASP A1947 -16.804 5.682 -3.772 1.00 0.91 H new ATOM 933 N GLY A1948 -17.063 9.725 -1.989 1.00 0.91 N ATOM 934 CA GLY A1948 -17.716 10.837 -1.337 1.00 1.03 C ATOM 935 C GLY A1948 -17.510 10.775 0.166 1.00 1.03 C ATOM 936 O GLY A1948 -16.380 10.877 0.638 1.00 1.07 O ATOM 0 H GLY A1948 -16.271 9.989 -2.576 1.00 0.91 H new ATOM 0 HA2 GLY A1948 -17.320 11.776 -1.725 1.00 1.03 H new ATOM 0 HA3 GLY A1948 -18.782 10.823 -1.564 1.00 1.03 H new ATOM 940 N PRO A1949 -18.588 10.600 0.945 1.00 1.06 N ATOM 941 CA PRO A1949 -18.498 10.446 2.395 1.00 1.15 C ATOM 942 C PRO A1949 -18.284 8.978 2.805 1.00 1.00 C ATOM 943 O PRO A1949 -18.078 8.669 3.982 1.00 1.12 O ATOM 944 CB PRO A1949 -19.874 10.924 2.890 1.00 1.37 C ATOM 945 CG PRO A1949 -20.673 11.264 1.659 1.00 1.27 C ATOM 946 CD PRO A1949 -19.985 10.610 0.503 1.00 1.09 C ATOM 0 HA PRO A1949 -17.657 11.000 2.811 1.00 1.15 H new ATOM 0 HB2 PRO A1949 -20.369 10.147 3.472 1.00 1.37 H new ATOM 0 HB3 PRO A1949 -19.773 11.793 3.540 1.00 1.37 H new ATOM 0 HG2 PRO A1949 -21.698 10.905 1.752 1.00 1.27 H new ATOM 0 HG3 PRO A1949 -20.725 12.344 1.518 1.00 1.27 H new ATOM 0 HD2 PRO A1949 -20.362 9.604 0.320 1.00 1.09 H new ATOM 0 HD3 PRO A1949 -20.116 11.173 -0.421 1.00 1.09 H new ATOM 954 N LYS A1950 -18.325 8.092 1.830 1.00 0.86 N ATOM 955 CA LYS A1950 -18.192 6.669 2.068 1.00 0.83 C ATOM 956 C LYS A1950 -16.767 6.235 1.909 1.00 0.66 C ATOM 957 O LYS A1950 -16.045 6.781 1.109 1.00 0.71 O ATOM 958 CB LYS A1950 -19.038 5.881 1.083 1.00 0.95 C ATOM 959 CG LYS A1950 -20.530 5.963 1.301 1.00 1.31 C ATOM 960 CD LYS A1950 -21.314 5.200 0.223 1.00 1.91 C ATOM 961 CE LYS A1950 -21.120 3.661 0.238 1.00 2.18 C ATOM 962 NZ LYS A1950 -19.735 3.194 -0.068 1.00 2.52 N ATOM 0 H LYS A1950 -18.452 8.339 0.849 1.00 0.86 H new ATOM 0 HA LYS A1950 -18.527 6.476 3.087 1.00 0.83 H new ATOM 0 HB2 LYS A1950 -18.815 6.233 0.076 1.00 0.95 H new ATOM 0 HB3 LYS A1950 -18.738 4.834 1.129 1.00 0.95 H new ATOM 0 HG2 LYS A1950 -20.775 5.557 2.282 1.00 1.31 H new ATOM 0 HG3 LYS A1950 -20.839 7.008 1.302 1.00 1.31 H new ATOM 0 HD2 LYS A1950 -22.375 5.419 0.343 1.00 1.91 H new ATOM 0 HD3 LYS A1950 -21.020 5.579 -0.756 1.00 1.91 H new ATOM 0 HE2 LYS A1950 -21.405 3.284 1.220 1.00 2.18 H new ATOM 0 HE3 LYS A1950 -21.804 3.217 -0.485 1.00 2.18 H new ATOM 0 HZ1 LYS A1950 -19.780 2.329 -0.644 1.00 2.52 H new ATOM 0 HZ2 LYS A1950 -19.227 3.934 -0.593 1.00 2.52 H new ATOM 0 HZ3 LYS A1950 -19.232 2.993 0.820 1.00 2.52 H new ATOM 976 N THR A1951 -16.377 5.261 2.656 1.00 0.68 N ATOM 977 CA THR A1951 -15.069 4.702 2.554 1.00 0.60 C ATOM 978 C THR A1951 -15.153 3.196 2.360 1.00 0.57 C ATOM 979 O THR A1951 -15.500 2.460 3.294 1.00 0.72 O ATOM 980 CB THR A1951 -14.228 5.042 3.800 1.00 0.73 C ATOM 981 OG1 THR A1951 -15.053 4.983 4.993 1.00 1.05 O ATOM 982 CG2 THR A1951 -13.594 6.407 3.672 1.00 1.07 C ATOM 0 H THR A1951 -16.964 4.823 3.366 1.00 0.68 H new ATOM 0 HA THR A1951 -14.576 5.138 1.685 1.00 0.60 H new ATOM 0 HB THR A1951 -13.430 4.304 3.882 1.00 0.73 H new ATOM 0 HG1 THR A1951 -14.508 5.199 5.778 1.00 1.05 H new ATOM 0 HG21 THR A1951 -13.007 6.621 4.565 1.00 1.07 H new ATOM 0 HG22 THR A1951 -12.944 6.426 2.797 1.00 1.07 H new ATOM 0 HG23 THR A1951 -14.373 7.161 3.561 1.00 1.07 H new ATOM 990 N LEU A1952 -14.895 2.745 1.146 1.00 0.52 N ATOM 991 CA LEU A1952 -14.911 1.332 0.838 1.00 0.52 C ATOM 992 C LEU A1952 -13.706 0.688 1.480 1.00 0.47 C ATOM 993 O LEU A1952 -12.562 0.933 1.073 1.00 0.52 O ATOM 994 CB LEU A1952 -14.895 1.097 -0.677 1.00 0.57 C ATOM 995 CG LEU A1952 -14.939 -0.368 -1.135 1.00 0.63 C ATOM 996 CD1 LEU A1952 -16.227 -1.041 -0.681 1.00 1.14 C ATOM 997 CD2 LEU A1952 -14.787 -0.459 -2.646 1.00 1.15 C ATOM 0 H LEU A1952 -14.670 3.345 0.353 1.00 0.52 H new ATOM 0 HA LEU A1952 -15.827 0.888 1.229 1.00 0.52 H new ATOM 0 HB2 LEU A1952 -15.747 1.619 -1.114 1.00 0.57 H new ATOM 0 HB3 LEU A1952 -13.995 1.557 -1.086 1.00 0.57 H new ATOM 0 HG LEU A1952 -14.104 -0.894 -0.673 1.00 0.63 H new ATOM 0 HD11 LEU A1952 -16.234 -2.078 -1.018 1.00 1.14 H new ATOM 0 HD12 LEU A1952 -16.289 -1.012 0.407 1.00 1.14 H new ATOM 0 HD13 LEU A1952 -17.082 -0.515 -1.107 1.00 1.14 H new ATOM 0 HD21 LEU A1952 -14.820 -1.504 -2.953 1.00 1.15 H new ATOM 0 HD22 LEU A1952 -15.599 0.086 -3.127 1.00 1.15 H new ATOM 0 HD23 LEU A1952 -13.832 -0.024 -2.942 1.00 1.15 H new ATOM 1009 N ASN A1953 -13.952 -0.083 2.495 1.00 0.48 N ATOM 1010 CA ASN A1953 -12.890 -0.722 3.245 1.00 0.45 C ATOM 1011 C ASN A1953 -12.406 -1.957 2.522 1.00 0.46 C ATOM 1012 O ASN A1953 -13.095 -2.982 2.478 1.00 0.64 O ATOM 1013 CB ASN A1953 -13.354 -1.085 4.666 1.00 0.59 C ATOM 1014 CG ASN A1953 -13.730 0.119 5.529 1.00 1.20 C ATOM 1015 OD1 ASN A1953 -14.635 0.032 6.364 1.00 1.86 O ATOM 1016 ND2 ASN A1953 -13.029 1.228 5.378 1.00 1.93 N ATOM 0 H ASN A1953 -14.891 -0.293 2.834 1.00 0.48 H new ATOM 0 HA ASN A1953 -12.065 -0.015 3.329 1.00 0.45 H new ATOM 0 HB2 ASN A1953 -14.214 -1.751 4.596 1.00 0.59 H new ATOM 0 HB3 ASN A1953 -12.560 -1.641 5.164 1.00 0.59 H new ATOM 0 HD21 ASN A1953 -13.230 2.041 5.960 1.00 1.93 H new ATOM 0 HD22 ASN A1953 -12.287 1.271 4.680 1.00 1.93 H new ATOM 1023 N ALA A1954 -11.246 -1.861 1.927 1.00 0.43 N ATOM 1024 CA ALA A1954 -10.695 -2.986 1.208 1.00 0.58 C ATOM 1025 C ALA A1954 -9.798 -3.815 2.112 1.00 0.70 C ATOM 1026 O ALA A1954 -9.835 -5.047 2.079 1.00 1.17 O ATOM 1027 CB ALA A1954 -9.952 -2.526 -0.034 1.00 0.69 C ATOM 0 H ALA A1954 -10.665 -1.022 1.924 1.00 0.43 H new ATOM 0 HA ALA A1954 -11.520 -3.620 0.883 1.00 0.58 H new ATOM 0 HB1 ALA A1954 -9.547 -3.392 -0.557 1.00 0.69 H new ATOM 0 HB2 ALA A1954 -10.638 -1.993 -0.692 1.00 0.69 H new ATOM 0 HB3 ALA A1954 -9.137 -1.862 0.255 1.00 0.69 H new ATOM 1033 N GLY A1955 -9.040 -3.146 2.950 1.00 0.42 N ATOM 1034 CA GLY A1955 -8.144 -3.845 3.827 1.00 0.51 C ATOM 1035 C GLY A1955 -7.920 -3.096 5.105 1.00 0.43 C ATOM 1036 O GLY A1955 -7.916 -1.834 5.116 1.00 0.47 O ATOM 0 H GLY A1955 -9.029 -2.130 3.039 1.00 0.42 H new ATOM 0 HA2 GLY A1955 -8.550 -4.832 4.050 1.00 0.51 H new ATOM 0 HA3 GLY A1955 -7.189 -3.999 3.324 1.00 0.51 H new ATOM 1040 N LYS A1956 -7.744 -3.829 6.177 1.00 0.43 N ATOM 1041 CA LYS A1956 -7.498 -3.241 7.470 1.00 0.45 C ATOM 1042 C LYS A1956 -6.026 -2.944 7.631 1.00 0.38 C ATOM 1043 O LYS A1956 -5.203 -3.391 6.831 1.00 0.40 O ATOM 1044 CB LYS A1956 -7.979 -4.150 8.599 1.00 0.61 C ATOM 1045 CG LYS A1956 -7.340 -5.536 8.619 1.00 0.70 C ATOM 1046 CD LYS A1956 -7.835 -6.415 9.779 1.00 0.97 C ATOM 1047 CE LYS A1956 -9.324 -6.789 9.689 1.00 1.54 C ATOM 1048 NZ LYS A1956 -10.247 -5.635 9.876 1.00 2.43 N ATOM 0 H LYS A1956 -7.767 -4.849 6.177 1.00 0.43 H new ATOM 0 HA LYS A1956 -8.062 -2.310 7.529 1.00 0.45 H new ATOM 0 HB2 LYS A1956 -7.780 -3.659 9.552 1.00 0.61 H new ATOM 0 HB3 LYS A1956 -9.060 -4.264 8.519 1.00 0.61 H new ATOM 0 HG2 LYS A1956 -7.550 -6.039 7.675 1.00 0.70 H new ATOM 0 HG3 LYS A1956 -6.258 -5.429 8.689 1.00 0.70 H new ATOM 0 HD2 LYS A1956 -7.242 -7.329 9.807 1.00 0.97 H new ATOM 0 HD3 LYS A1956 -7.658 -5.892 10.719 1.00 0.97 H new ATOM 0 HE2 LYS A1956 -9.517 -7.242 8.717 1.00 1.54 H new ATOM 0 HE3 LYS A1956 -9.545 -7.545 10.443 1.00 1.54 H new ATOM 0 HZ1 LYS A1956 -11.070 -5.936 10.436 1.00 2.43 H new ATOM 0 HZ2 LYS A1956 -9.750 -4.870 10.375 1.00 2.43 H new ATOM 0 HZ3 LYS A1956 -10.567 -5.292 8.948 1.00 2.43 H new ATOM 1062 N LEU A1957 -5.698 -2.209 8.649 1.00 0.42 N ATOM 1063 CA LEU A1957 -4.351 -1.827 8.894 1.00 0.45 C ATOM 1064 C LEU A1957 -3.617 -2.897 9.676 1.00 0.45 C ATOM 1065 O LEU A1957 -3.718 -2.995 10.896 1.00 0.53 O ATOM 1066 CB LEU A1957 -4.288 -0.412 9.551 1.00 0.57 C ATOM 1067 CG LEU A1957 -2.901 0.232 9.815 1.00 0.77 C ATOM 1068 CD1 LEU A1957 -2.276 -0.270 11.097 1.00 1.24 C ATOM 1069 CD2 LEU A1957 -1.957 -0.016 8.646 1.00 1.30 C ATOM 0 H LEU A1957 -6.366 -1.857 9.335 1.00 0.42 H new ATOM 0 HA LEU A1957 -3.825 -1.741 7.943 1.00 0.45 H new ATOM 0 HB2 LEU A1957 -4.853 0.271 8.917 1.00 0.57 H new ATOM 0 HB3 LEU A1957 -4.812 -0.468 10.505 1.00 0.57 H new ATOM 0 HG LEU A1957 -3.065 1.304 9.921 1.00 0.77 H new ATOM 0 HD11 LEU A1957 -1.307 0.208 11.241 1.00 1.24 H new ATOM 0 HD12 LEU A1957 -2.927 -0.030 11.938 1.00 1.24 H new ATOM 0 HD13 LEU A1957 -2.143 -1.350 11.038 1.00 1.24 H new ATOM 0 HD21 LEU A1957 -0.991 0.445 8.854 1.00 1.30 H new ATOM 0 HD22 LEU A1957 -1.825 -1.089 8.507 1.00 1.30 H new ATOM 0 HD23 LEU A1957 -2.378 0.418 7.740 1.00 1.30 H new ATOM 1081 N SER A1958 -2.976 -3.748 8.951 1.00 0.56 N ATOM 1082 CA SER A1958 -2.095 -4.710 9.511 1.00 0.67 C ATOM 1083 C SER A1958 -0.702 -4.402 8.981 1.00 0.65 C ATOM 1084 O SER A1958 -0.379 -4.683 7.817 1.00 0.84 O ATOM 1085 CB SER A1958 -2.557 -6.119 9.152 1.00 0.96 C ATOM 1086 OG SER A1958 -3.895 -6.327 9.600 1.00 1.62 O ATOM 0 H SER A1958 -3.052 -3.794 7.935 1.00 0.56 H new ATOM 0 HA SER A1958 -2.086 -4.662 10.600 1.00 0.67 H new ATOM 0 HB2 SER A1958 -2.500 -6.265 8.073 1.00 0.96 H new ATOM 0 HB3 SER A1958 -1.894 -6.854 9.608 1.00 0.96 H new ATOM 0 HG SER A1958 -4.182 -7.234 9.363 1.00 1.62 H new ATOM 1092 N LYS A1959 0.100 -3.791 9.823 1.00 0.59 N ATOM 1093 CA LYS A1959 1.414 -3.274 9.458 1.00 0.71 C ATOM 1094 C LYS A1959 2.455 -4.374 9.329 1.00 0.76 C ATOM 1095 O LYS A1959 3.300 -4.587 10.200 1.00 1.04 O ATOM 1096 CB LYS A1959 1.859 -2.104 10.384 1.00 0.86 C ATOM 1097 CG LYS A1959 1.667 -2.371 11.877 1.00 0.96 C ATOM 1098 CD LYS A1959 1.836 -1.125 12.745 1.00 1.10 C ATOM 1099 CE LYS A1959 0.831 -0.045 12.366 1.00 0.98 C ATOM 1100 NZ LYS A1959 0.700 1.015 13.387 1.00 1.48 N ATOM 0 H LYS A1959 -0.141 -3.633 10.801 1.00 0.59 H new ATOM 0 HA LYS A1959 1.322 -2.845 8.460 1.00 0.71 H new ATOM 0 HB2 LYS A1959 2.912 -1.890 10.198 1.00 0.86 H new ATOM 0 HB3 LYS A1959 1.299 -1.209 10.113 1.00 0.86 H new ATOM 0 HG2 LYS A1959 0.672 -2.785 12.039 1.00 0.96 H new ATOM 0 HG3 LYS A1959 2.383 -3.128 12.198 1.00 0.96 H new ATOM 0 HD2 LYS A1959 1.709 -1.391 13.795 1.00 1.10 H new ATOM 0 HD3 LYS A1959 2.849 -0.737 12.635 1.00 1.10 H new ATOM 0 HE2 LYS A1959 1.132 0.406 11.420 1.00 0.98 H new ATOM 0 HE3 LYS A1959 -0.143 -0.506 12.204 1.00 0.98 H new ATOM 0 HZ1 LYS A1959 0.448 1.912 12.925 1.00 1.48 H new ATOM 0 HZ2 LYS A1959 -0.044 0.754 14.065 1.00 1.48 H new ATOM 0 HZ3 LYS A1959 1.603 1.126 13.890 1.00 1.48 H new ATOM 1114 N THR A1960 2.311 -5.110 8.275 1.00 0.74 N ATOM 1115 CA THR A1960 3.179 -6.180 7.927 1.00 0.81 C ATOM 1116 C THR A1960 3.745 -5.904 6.536 1.00 0.77 C ATOM 1117 O THR A1960 3.004 -5.835 5.548 1.00 1.05 O ATOM 1118 CB THR A1960 2.384 -7.493 7.943 1.00 0.92 C ATOM 1119 OG1 THR A1960 1.675 -7.553 9.197 1.00 1.63 O ATOM 1120 CG2 THR A1960 3.312 -8.698 7.832 1.00 1.27 C ATOM 0 H THR A1960 1.552 -4.973 7.607 1.00 0.74 H new ATOM 0 HA THR A1960 4.001 -6.265 8.638 1.00 0.81 H new ATOM 0 HB THR A1960 1.700 -7.518 7.095 1.00 0.92 H new ATOM 0 HG1 THR A1960 1.154 -8.382 9.239 1.00 1.63 H new ATOM 0 HG21 THR A1960 2.722 -9.614 7.846 1.00 1.27 H new ATOM 0 HG22 THR A1960 3.872 -8.641 6.899 1.00 1.27 H new ATOM 0 HG23 THR A1960 4.006 -8.701 8.672 1.00 1.27 H new ATOM 1128 N LEU A1961 5.021 -5.696 6.492 1.00 0.55 N ATOM 1129 CA LEU A1961 5.731 -5.376 5.291 1.00 0.51 C ATOM 1130 C LEU A1961 6.755 -6.459 5.087 1.00 0.51 C ATOM 1131 O LEU A1961 7.404 -6.878 6.053 1.00 0.58 O ATOM 1132 CB LEU A1961 6.425 -4.022 5.470 1.00 0.62 C ATOM 1133 CG LEU A1961 7.138 -3.462 4.251 1.00 0.71 C ATOM 1134 CD1 LEU A1961 6.138 -3.183 3.141 1.00 1.35 C ATOM 1135 CD2 LEU A1961 7.915 -2.207 4.611 1.00 1.32 C ATOM 0 H LEU A1961 5.619 -5.745 7.317 1.00 0.55 H new ATOM 0 HA LEU A1961 5.063 -5.314 4.432 1.00 0.51 H new ATOM 0 HB2 LEU A1961 5.679 -3.296 5.793 1.00 0.62 H new ATOM 0 HB3 LEU A1961 7.151 -4.114 6.278 1.00 0.62 H new ATOM 0 HG LEU A1961 7.851 -4.204 3.893 1.00 0.71 H new ATOM 0 HD11 LEU A1961 6.661 -2.782 2.273 1.00 1.35 H new ATOM 0 HD12 LEU A1961 5.633 -4.109 2.865 1.00 1.35 H new ATOM 0 HD13 LEU A1961 5.402 -2.458 3.488 1.00 1.35 H new ATOM 0 HD21 LEU A1961 8.418 -1.823 3.723 1.00 1.32 H new ATOM 0 HD22 LEU A1961 7.229 -1.452 4.995 1.00 1.32 H new ATOM 0 HD23 LEU A1961 8.657 -2.444 5.374 1.00 1.32 H new ATOM 1147 N THR A1962 6.897 -6.946 3.889 1.00 0.51 N ATOM 1148 CA THR A1962 7.796 -8.028 3.675 1.00 0.58 C ATOM 1149 C THR A1962 8.256 -8.101 2.218 1.00 0.51 C ATOM 1150 O THR A1962 7.785 -7.362 1.367 1.00 0.72 O ATOM 1151 CB THR A1962 7.132 -9.357 4.155 1.00 0.72 C ATOM 1152 OG1 THR A1962 8.007 -10.492 4.036 1.00 1.19 O ATOM 1153 CG2 THR A1962 5.805 -9.603 3.453 1.00 0.61 C ATOM 0 H THR A1962 6.407 -6.613 3.059 1.00 0.51 H new ATOM 0 HA THR A1962 8.698 -7.863 4.265 1.00 0.58 H new ATOM 0 HB THR A1962 6.930 -9.232 5.219 1.00 0.72 H new ATOM 0 HG1 THR A1962 7.544 -11.296 4.351 1.00 1.19 H new ATOM 0 HG21 THR A1962 5.371 -10.536 3.812 1.00 0.61 H new ATOM 0 HG22 THR A1962 5.123 -8.780 3.666 1.00 0.61 H new ATOM 0 HG23 THR A1962 5.969 -9.669 2.377 1.00 0.61 H new ATOM 1161 N TYR A1963 9.168 -8.980 1.963 1.00 0.47 N ATOM 1162 CA TYR A1963 9.744 -9.194 0.662 1.00 0.48 C ATOM 1163 C TYR A1963 9.000 -10.339 -0.005 1.00 0.55 C ATOM 1164 O TYR A1963 8.805 -11.397 0.607 1.00 0.75 O ATOM 1165 CB TYR A1963 11.263 -9.517 0.815 1.00 0.62 C ATOM 1166 CG TYR A1963 11.560 -10.629 1.826 1.00 0.78 C ATOM 1167 CD1 TYR A1963 11.625 -10.350 3.187 1.00 0.78 C ATOM 1168 CD2 TYR A1963 11.722 -11.950 1.425 1.00 1.03 C ATOM 1169 CE1 TYR A1963 11.850 -11.341 4.109 1.00 1.01 C ATOM 1170 CE2 TYR A1963 11.937 -12.953 2.348 1.00 1.27 C ATOM 1171 CZ TYR A1963 12.002 -12.640 3.689 1.00 1.25 C ATOM 1172 OH TYR A1963 12.184 -13.635 4.618 1.00 1.52 O ATOM 0 H TYR A1963 9.552 -9.597 2.679 1.00 0.47 H new ATOM 0 HA TYR A1963 9.652 -8.302 0.043 1.00 0.48 H new ATOM 0 HB2 TYR A1963 11.663 -9.806 -0.157 1.00 0.62 H new ATOM 0 HB3 TYR A1963 11.788 -8.612 1.120 1.00 0.62 H new ATOM 0 HD1 TYR A1963 11.496 -9.332 3.525 1.00 0.78 H new ATOM 0 HD2 TYR A1963 11.679 -12.195 0.374 1.00 1.03 H new ATOM 0 HE1 TYR A1963 11.907 -11.101 5.160 1.00 1.01 H new ATOM 0 HE2 TYR A1963 12.054 -13.976 2.022 1.00 1.27 H new ATOM 0 HH TYR A1963 12.274 -14.497 4.161 1.00 1.52 H new ATOM 1182 N GLU A1964 8.545 -10.136 -1.214 1.00 0.54 N ATOM 1183 CA GLU A1964 7.828 -11.174 -1.915 1.00 0.70 C ATOM 1184 C GLU A1964 7.958 -10.905 -3.420 1.00 0.80 C ATOM 1185 O GLU A1964 7.538 -9.836 -3.898 1.00 0.78 O ATOM 1186 CB GLU A1964 6.357 -11.167 -1.448 1.00 0.87 C ATOM 1187 CG GLU A1964 5.626 -12.503 -1.544 1.00 1.25 C ATOM 1188 CD GLU A1964 5.529 -13.028 -2.935 1.00 1.87 C ATOM 1189 OE1 GLU A1964 4.759 -12.467 -3.726 1.00 2.75 O ATOM 1190 OE2 GLU A1964 6.230 -13.999 -3.271 1.00 2.22 O ATOM 0 H GLU A1964 8.656 -9.266 -1.734 1.00 0.54 H new ATOM 0 HA GLU A1964 8.236 -12.162 -1.703 1.00 0.70 H new ATOM 0 HB2 GLU A1964 6.326 -10.830 -0.412 1.00 0.87 H new ATOM 0 HB3 GLU A1964 5.811 -10.432 -2.039 1.00 0.87 H new ATOM 0 HG2 GLU A1964 6.141 -13.236 -0.923 1.00 1.25 H new ATOM 0 HG3 GLU A1964 4.622 -12.389 -1.136 1.00 1.25 H new ATOM 1197 N ASP A1965 8.557 -11.873 -4.146 1.00 1.04 N ATOM 1198 CA ASP A1965 8.866 -11.778 -5.604 1.00 1.25 C ATOM 1199 C ASP A1965 10.066 -10.838 -5.788 1.00 1.07 C ATOM 1200 O ASP A1965 10.306 -10.283 -6.849 1.00 1.08 O ATOM 1201 CB ASP A1965 7.602 -11.337 -6.437 1.00 1.46 C ATOM 1202 CG ASP A1965 7.805 -11.245 -7.957 1.00 2.18 C ATOM 1203 OD1 ASP A1965 8.341 -12.196 -8.567 1.00 2.64 O ATOM 1204 OD2 ASP A1965 7.364 -10.239 -8.579 1.00 2.74 O ATOM 0 H ASP A1965 8.848 -12.761 -3.736 1.00 1.04 H new ATOM 0 HA ASP A1965 9.135 -12.760 -5.993 1.00 1.25 H new ATOM 0 HB2 ASP A1965 6.795 -12.042 -6.239 1.00 1.46 H new ATOM 0 HB3 ASP A1965 7.272 -10.364 -6.074 1.00 1.46 H new ATOM 1209 N GLN A1966 10.848 -10.702 -4.689 1.00 1.03 N ATOM 1210 CA GLN A1966 12.025 -9.800 -4.588 1.00 1.04 C ATOM 1211 C GLN A1966 11.604 -8.334 -4.629 1.00 0.84 C ATOM 1212 O GLN A1966 12.424 -7.428 -4.672 1.00 1.05 O ATOM 1213 CB GLN A1966 13.121 -10.117 -5.623 1.00 1.33 C ATOM 1214 CG GLN A1966 13.791 -11.472 -5.416 1.00 1.71 C ATOM 1215 CD GLN A1966 14.925 -11.718 -6.394 1.00 2.12 C ATOM 1216 OE1 GLN A1966 14.906 -11.238 -7.527 1.00 2.66 O ATOM 1217 NE2 GLN A1966 15.916 -12.470 -5.982 1.00 2.40 N ATOM 0 H GLN A1966 10.676 -11.226 -3.831 1.00 1.03 H new ATOM 0 HA GLN A1966 12.477 -9.988 -3.614 1.00 1.04 H new ATOM 0 HB2 GLN A1966 12.684 -10.087 -6.621 1.00 1.33 H new ATOM 0 HB3 GLN A1966 13.881 -9.337 -5.584 1.00 1.33 H new ATOM 0 HG2 GLN A1966 14.175 -11.531 -4.398 1.00 1.71 H new ATOM 0 HG3 GLN A1966 13.047 -12.261 -5.522 1.00 1.71 H new ATOM 0 HE21 GLN A1966 15.906 -12.855 -5.037 1.00 2.40 H new ATOM 0 HE22 GLN A1966 16.698 -12.670 -6.606 1.00 2.40 H new ATOM 1226 N VAL A1967 10.318 -8.146 -4.572 1.00 0.60 N ATOM 1227 CA VAL A1967 9.685 -6.868 -4.555 1.00 0.49 C ATOM 1228 C VAL A1967 9.184 -6.664 -3.130 1.00 0.41 C ATOM 1229 O VAL A1967 8.913 -7.651 -2.417 1.00 0.41 O ATOM 1230 CB VAL A1967 8.479 -6.856 -5.565 1.00 0.52 C ATOM 1231 CG1 VAL A1967 7.762 -5.522 -5.599 1.00 1.01 C ATOM 1232 CG2 VAL A1967 8.946 -7.223 -6.964 1.00 1.06 C ATOM 0 H VAL A1967 9.654 -8.919 -4.534 1.00 0.60 H new ATOM 0 HA VAL A1967 10.371 -6.074 -4.851 1.00 0.49 H new ATOM 0 HB VAL A1967 7.769 -7.603 -5.209 1.00 0.52 H new ATOM 0 HG11 VAL A1967 6.939 -5.569 -6.312 1.00 1.01 H new ATOM 0 HG12 VAL A1967 7.371 -5.294 -4.608 1.00 1.01 H new ATOM 0 HG13 VAL A1967 8.460 -4.741 -5.902 1.00 1.01 H new ATOM 0 HG21 VAL A1967 8.096 -7.209 -7.647 1.00 1.06 H new ATOM 0 HG22 VAL A1967 9.693 -6.503 -7.299 1.00 1.06 H new ATOM 0 HG23 VAL A1967 9.384 -8.221 -6.951 1.00 1.06 H new ATOM 1242 N LEU A1968 9.080 -5.446 -2.708 1.00 0.41 N ATOM 1243 CA LEU A1968 8.629 -5.160 -1.386 1.00 0.38 C ATOM 1244 C LEU A1968 7.112 -5.200 -1.373 1.00 0.37 C ATOM 1245 O LEU A1968 6.454 -4.384 -1.998 1.00 0.49 O ATOM 1246 CB LEU A1968 9.142 -3.787 -0.949 1.00 0.42 C ATOM 1247 CG LEU A1968 8.782 -3.355 0.460 1.00 0.43 C ATOM 1248 CD1 LEU A1968 9.344 -4.330 1.465 1.00 0.47 C ATOM 1249 CD2 LEU A1968 9.300 -1.963 0.736 1.00 0.50 C ATOM 0 H LEU A1968 9.305 -4.624 -3.268 1.00 0.41 H new ATOM 0 HA LEU A1968 9.014 -5.902 -0.686 1.00 0.38 H new ATOM 0 HB2 LEU A1968 10.228 -3.781 -1.042 1.00 0.42 H new ATOM 0 HB3 LEU A1968 8.759 -3.041 -1.645 1.00 0.42 H new ATOM 0 HG LEU A1968 7.696 -3.344 0.551 1.00 0.43 H new ATOM 0 HD11 LEU A1968 9.078 -4.008 2.472 1.00 0.47 H new ATOM 0 HD12 LEU A1968 8.931 -5.322 1.280 1.00 0.47 H new ATOM 0 HD13 LEU A1968 10.429 -4.366 1.370 1.00 0.47 H new ATOM 0 HD21 LEU A1968 9.032 -1.670 1.751 1.00 0.50 H new ATOM 0 HD22 LEU A1968 10.385 -1.950 0.629 1.00 0.50 H new ATOM 0 HD23 LEU A1968 8.857 -1.263 0.028 1.00 0.50 H new ATOM 1261 N LYS A1969 6.559 -6.159 -0.707 1.00 0.33 N ATOM 1262 CA LYS A1969 5.144 -6.284 -0.677 1.00 0.36 C ATOM 1263 C LYS A1969 4.543 -5.850 0.610 1.00 0.34 C ATOM 1264 O LYS A1969 4.986 -6.228 1.705 1.00 0.36 O ATOM 1265 CB LYS A1969 4.628 -7.670 -1.051 1.00 0.47 C ATOM 1266 CG LYS A1969 4.697 -7.988 -2.536 1.00 0.73 C ATOM 1267 CD LYS A1969 3.685 -9.073 -2.886 1.00 1.19 C ATOM 1268 CE LYS A1969 3.636 -9.364 -4.380 1.00 1.19 C ATOM 1269 NZ LYS A1969 4.831 -10.083 -4.860 1.00 1.29 N ATOM 0 H LYS A1969 7.068 -6.867 -0.177 1.00 0.33 H new ATOM 0 HA LYS A1969 4.815 -5.597 -1.457 1.00 0.36 H new ATOM 0 HB2 LYS A1969 5.203 -8.418 -0.505 1.00 0.47 H new ATOM 0 HB3 LYS A1969 3.593 -7.760 -0.721 1.00 0.47 H new ATOM 0 HG2 LYS A1969 4.494 -7.089 -3.118 1.00 0.73 H new ATOM 0 HG3 LYS A1969 5.702 -8.318 -2.799 1.00 0.73 H new ATOM 0 HD2 LYS A1969 3.937 -9.987 -2.349 1.00 1.19 H new ATOM 0 HD3 LYS A1969 2.696 -8.766 -2.546 1.00 1.19 H new ATOM 0 HE2 LYS A1969 2.748 -9.956 -4.602 1.00 1.19 H new ATOM 0 HE3 LYS A1969 3.538 -8.425 -4.926 1.00 1.19 H new ATOM 0 HZ1 LYS A1969 4.928 -9.948 -5.887 1.00 1.29 H new ATOM 0 HZ2 LYS A1969 5.676 -9.711 -4.380 1.00 1.29 H new ATOM 0 HZ3 LYS A1969 4.733 -11.097 -4.652 1.00 1.29 H new ATOM 1283 N LEU A1970 3.561 -5.046 0.469 1.00 0.42 N ATOM 1284 CA LEU A1970 2.739 -4.628 1.529 1.00 0.49 C ATOM 1285 C LEU A1970 1.385 -5.188 1.206 1.00 0.46 C ATOM 1286 O LEU A1970 0.904 -5.018 0.094 1.00 0.57 O ATOM 1287 CB LEU A1970 2.683 -3.106 1.566 1.00 0.60 C ATOM 1288 CG LEU A1970 1.850 -2.484 2.678 1.00 0.91 C ATOM 1289 CD1 LEU A1970 2.438 -2.798 4.045 1.00 1.11 C ATOM 1290 CD2 LEU A1970 1.742 -0.992 2.468 1.00 1.75 C ATOM 0 H LEU A1970 3.298 -4.644 -0.431 1.00 0.42 H new ATOM 0 HA LEU A1970 3.103 -4.965 2.500 1.00 0.49 H new ATOM 0 HB2 LEU A1970 3.702 -2.729 1.652 1.00 0.60 H new ATOM 0 HB3 LEU A1970 2.293 -2.756 0.611 1.00 0.60 H new ATOM 0 HG LEU A1970 0.850 -2.916 2.644 1.00 0.91 H new ATOM 0 HD11 LEU A1970 1.822 -2.341 4.820 1.00 1.11 H new ATOM 0 HD12 LEU A1970 2.463 -3.878 4.191 1.00 1.11 H new ATOM 0 HD13 LEU A1970 3.451 -2.401 4.105 1.00 1.11 H new ATOM 0 HD21 LEU A1970 1.144 -0.554 3.268 1.00 1.75 H new ATOM 0 HD22 LEU A1970 2.738 -0.550 2.476 1.00 1.75 H new ATOM 0 HD23 LEU A1970 1.265 -0.793 1.508 1.00 1.75 H new ATOM 1302 N VAL A1971 0.808 -5.910 2.096 1.00 0.46 N ATOM 1303 CA VAL A1971 -0.483 -6.479 1.827 1.00 0.48 C ATOM 1304 C VAL A1971 -1.458 -6.097 2.896 1.00 0.45 C ATOM 1305 O VAL A1971 -1.115 -6.061 4.080 1.00 0.60 O ATOM 1306 CB VAL A1971 -0.455 -8.038 1.638 1.00 0.64 C ATOM 1307 CG1 VAL A1971 0.322 -8.425 0.388 1.00 0.73 C ATOM 1308 CG2 VAL A1971 0.130 -8.743 2.862 1.00 0.74 C ATOM 0 H VAL A1971 1.197 -6.126 3.014 1.00 0.46 H new ATOM 0 HA VAL A1971 -0.807 -6.063 0.873 1.00 0.48 H new ATOM 0 HB VAL A1971 -1.488 -8.365 1.521 1.00 0.64 H new ATOM 0 HG11 VAL A1971 0.325 -9.510 0.283 1.00 0.73 H new ATOM 0 HG12 VAL A1971 -0.149 -7.977 -0.487 1.00 0.73 H new ATOM 0 HG13 VAL A1971 1.348 -8.066 0.472 1.00 0.73 H new ATOM 0 HG21 VAL A1971 0.133 -9.820 2.695 1.00 0.74 H new ATOM 0 HG22 VAL A1971 1.151 -8.398 3.027 1.00 0.74 H new ATOM 0 HG23 VAL A1971 -0.476 -8.514 3.738 1.00 0.74 H new ATOM 1318 N TYR A1972 -2.639 -5.759 2.487 1.00 0.38 N ATOM 1319 CA TYR A1972 -3.697 -5.450 3.403 1.00 0.39 C ATOM 1320 C TYR A1972 -4.890 -6.252 3.027 1.00 0.45 C ATOM 1321 O TYR A1972 -5.255 -6.321 1.848 1.00 0.55 O ATOM 1322 CB TYR A1972 -4.027 -3.948 3.452 1.00 0.43 C ATOM 1323 CG TYR A1972 -2.937 -3.100 4.062 1.00 0.56 C ATOM 1324 CD1 TYR A1972 -2.499 -3.309 5.360 1.00 0.75 C ATOM 1325 CD2 TYR A1972 -2.342 -2.094 3.328 1.00 0.79 C ATOM 1326 CE1 TYR A1972 -1.500 -2.531 5.902 1.00 0.97 C ATOM 1327 CE2 TYR A1972 -1.351 -1.316 3.861 1.00 0.98 C ATOM 1328 CZ TYR A1972 -0.949 -1.562 5.216 1.00 1.04 C ATOM 1329 OH TYR A1972 0.052 -0.727 5.670 1.00 1.27 O ATOM 0 H TYR A1972 -2.901 -5.688 1.504 1.00 0.38 H new ATOM 0 HA TYR A1972 -3.370 -5.709 4.410 1.00 0.39 H new ATOM 0 HB2 TYR A1972 -4.223 -3.596 2.439 1.00 0.43 H new ATOM 0 HB3 TYR A1972 -4.945 -3.807 4.022 1.00 0.43 H new ATOM 0 HD1 TYR A1972 -2.947 -4.092 5.954 1.00 0.75 H new ATOM 0 HD2 TYR A1972 -2.665 -1.917 2.313 1.00 0.79 H new ATOM 0 HE1 TYR A1972 -1.165 -2.724 6.911 1.00 0.97 H new ATOM 0 HE2 TYR A1972 -0.884 -0.537 3.277 1.00 0.98 H new ATOM 0 HH TYR A1972 0.607 -1.205 6.321 1.00 1.27 H new ATOM 1339 N GLU A1973 -5.468 -6.893 3.987 1.00 0.57 N ATOM 1340 CA GLU A1973 -6.579 -7.738 3.742 1.00 0.73 C ATOM 1341 C GLU A1973 -7.681 -7.545 4.752 1.00 0.58 C ATOM 1342 O GLU A1973 -7.511 -6.796 5.714 1.00 0.57 O ATOM 1343 CB GLU A1973 -6.145 -9.209 3.563 1.00 1.09 C ATOM 1344 CG GLU A1973 -5.058 -9.725 4.502 1.00 1.33 C ATOM 1345 CD GLU A1973 -5.450 -9.748 5.945 1.00 1.89 C ATOM 1346 OE1 GLU A1973 -6.385 -10.486 6.293 1.00 2.17 O ATOM 1347 OE2 GLU A1973 -4.866 -8.979 6.742 1.00 2.75 O ATOM 0 H GLU A1973 -5.180 -6.843 4.964 1.00 0.57 H new ATOM 0 HA GLU A1973 -7.016 -7.439 2.789 1.00 0.73 H new ATOM 0 HB2 GLU A1973 -7.026 -9.840 3.683 1.00 1.09 H new ATOM 0 HB3 GLU A1973 -5.798 -9.338 2.538 1.00 1.09 H new ATOM 0 HG2 GLU A1973 -4.780 -10.734 4.197 1.00 1.33 H new ATOM 0 HG3 GLU A1973 -4.171 -9.102 4.389 1.00 1.33 H new ATOM 1354 N ASP A1974 -8.810 -8.174 4.465 1.00 0.73 N ATOM 1355 CA ASP A1974 -10.044 -8.139 5.266 1.00 0.79 C ATOM 1356 C ASP A1974 -10.488 -6.729 5.650 1.00 0.83 C ATOM 1357 O ASP A1974 -10.092 -6.171 6.679 1.00 1.13 O ATOM 1358 CB ASP A1974 -10.008 -9.063 6.488 1.00 1.03 C ATOM 1359 CG ASP A1974 -11.363 -9.134 7.169 1.00 1.29 C ATOM 1360 OD1 ASP A1974 -12.261 -9.829 6.655 1.00 1.56 O ATOM 1361 OD2 ASP A1974 -11.576 -8.482 8.204 1.00 1.57 O ATOM 0 H ASP A1974 -8.905 -8.752 3.630 1.00 0.73 H new ATOM 0 HA ASP A1974 -10.805 -8.534 4.594 1.00 0.79 H new ATOM 0 HB2 ASP A1974 -9.701 -10.063 6.181 1.00 1.03 H new ATOM 0 HB3 ASP A1974 -9.262 -8.703 7.196 1.00 1.03 H new ATOM 1366 N GLY A1975 -11.269 -6.141 4.795 1.00 1.18 N ATOM 1367 CA GLY A1975 -11.801 -4.846 5.074 1.00 1.43 C ATOM 1368 C GLY A1975 -13.253 -4.956 5.404 1.00 1.27 C ATOM 1369 O GLY A1975 -13.618 -5.225 6.547 1.00 1.57 O ATOM 0 H GLY A1975 -11.551 -6.539 3.899 1.00 1.18 H new ATOM 0 HA2 GLY A1975 -11.263 -4.393 5.907 1.00 1.43 H new ATOM 0 HA3 GLY A1975 -11.663 -4.193 4.212 1.00 1.43 H new ATOM 1373 N ASP A1976 -14.072 -4.780 4.412 1.00 0.96 N ATOM 1374 CA ASP A1976 -15.497 -4.894 4.572 1.00 0.90 C ATOM 1375 C ASP A1976 -16.003 -6.052 3.718 1.00 0.95 C ATOM 1376 O ASP A1976 -15.660 -6.130 2.529 1.00 1.08 O ATOM 1377 CB ASP A1976 -16.166 -3.598 4.148 1.00 0.95 C ATOM 1378 CG ASP A1976 -17.623 -3.580 4.476 1.00 1.57 C ATOM 1379 OD1 ASP A1976 -17.988 -3.274 5.624 1.00 2.24 O ATOM 1380 OD2 ASP A1976 -18.443 -3.908 3.574 1.00 2.08 O ATOM 0 H ASP A1976 -13.774 -4.552 3.464 1.00 0.96 H new ATOM 0 HA ASP A1976 -15.737 -5.085 5.618 1.00 0.90 H new ATOM 0 HB2 ASP A1976 -15.674 -2.759 4.641 1.00 0.95 H new ATOM 0 HB3 ASP A1976 -16.035 -3.458 3.075 1.00 0.95 H new ATOM 1385 N PRO A1977 -16.791 -6.974 4.308 1.00 1.16 N ATOM 1386 CA PRO A1977 -17.298 -8.175 3.618 1.00 1.39 C ATOM 1387 C PRO A1977 -18.073 -7.881 2.331 1.00 1.45 C ATOM 1388 O PRO A1977 -19.117 -7.214 2.339 1.00 1.66 O ATOM 1389 CB PRO A1977 -18.209 -8.834 4.651 1.00 1.68 C ATOM 1390 CG PRO A1977 -17.705 -8.336 5.955 1.00 1.68 C ATOM 1391 CD PRO A1977 -17.255 -6.930 5.703 1.00 1.41 C ATOM 0 HA PRO A1977 -16.470 -8.802 3.287 1.00 1.39 H new ATOM 0 HB2 PRO A1977 -19.252 -8.557 4.496 1.00 1.68 H new ATOM 0 HB3 PRO A1977 -18.155 -9.921 4.593 1.00 1.68 H new ATOM 0 HG2 PRO A1977 -18.486 -8.367 6.715 1.00 1.68 H new ATOM 0 HG3 PRO A1977 -16.882 -8.952 6.318 1.00 1.68 H new ATOM 0 HD2 PRO A1977 -18.068 -6.217 5.835 1.00 1.41 H new ATOM 0 HD3 PRO A1977 -16.457 -6.634 6.384 1.00 1.41 H new ATOM 1399 N CYS A1978 -17.540 -8.365 1.242 1.00 1.46 N ATOM 1400 CA CYS A1978 -18.147 -8.227 -0.057 1.00 1.62 C ATOM 1401 C CYS A1978 -19.264 -9.254 -0.223 1.00 1.87 C ATOM 1402 O CYS A1978 -19.238 -10.295 0.425 1.00 1.90 O ATOM 1403 CB CYS A1978 -17.089 -8.420 -1.134 1.00 1.58 C ATOM 1404 SG CYS A1978 -15.743 -7.200 -1.070 1.00 1.81 S ATOM 0 H CYS A1978 -16.657 -8.875 1.231 1.00 1.46 H new ATOM 0 HA CYS A1978 -18.576 -7.229 -0.152 1.00 1.62 H new ATOM 0 HB2 CYS A1978 -16.665 -9.420 -1.038 1.00 1.58 H new ATOM 0 HB3 CYS A1978 -17.567 -8.369 -2.112 1.00 1.58 H new ATOM 1409 N PRO A1979 -20.263 -8.973 -1.086 1.00 2.20 N ATOM 1410 CA PRO A1979 -21.410 -9.872 -1.312 1.00 2.55 C ATOM 1411 C PRO A1979 -21.001 -11.272 -1.781 1.00 2.56 C ATOM 1412 O PRO A1979 -21.616 -12.263 -1.415 1.00 2.76 O ATOM 1413 CB PRO A1979 -22.204 -9.167 -2.416 1.00 2.93 C ATOM 1414 CG PRO A1979 -21.819 -7.737 -2.307 1.00 2.90 C ATOM 1415 CD PRO A1979 -20.382 -7.736 -1.895 1.00 2.38 C ATOM 0 HA PRO A1979 -21.966 -10.037 -0.389 1.00 2.55 H new ATOM 0 HB2 PRO A1979 -21.958 -9.569 -3.399 1.00 2.93 H new ATOM 0 HB3 PRO A1979 -23.277 -9.299 -2.277 1.00 2.93 H new ATOM 0 HG2 PRO A1979 -21.954 -7.221 -3.258 1.00 2.90 H new ATOM 0 HG3 PRO A1979 -22.437 -7.220 -1.573 1.00 2.90 H new ATOM 0 HD2 PRO A1979 -19.715 -7.753 -2.757 1.00 2.38 H new ATOM 0 HD3 PRO A1979 -20.130 -6.849 -1.314 1.00 2.38 H new ATOM 1423 N THR A1980 -19.998 -11.337 -2.588 1.00 2.44 N ATOM 1424 CA THR A1980 -19.507 -12.535 -3.116 1.00 2.58 C ATOM 1425 C THR A1980 -18.494 -13.189 -2.170 1.00 2.52 C ATOM 1426 O THR A1980 -18.566 -14.399 -1.868 1.00 2.86 O ATOM 1427 CB THR A1980 -18.834 -12.130 -4.384 1.00 2.52 C ATOM 1428 OG1 THR A1980 -18.260 -10.817 -4.163 1.00 2.72 O ATOM 1429 CG2 THR A1980 -19.813 -12.089 -5.539 1.00 2.83 C ATOM 0 H THR A1980 -19.485 -10.514 -2.903 1.00 2.44 H new ATOM 0 HA THR A1980 -20.301 -13.267 -3.267 1.00 2.58 H new ATOM 0 HB THR A1980 -18.064 -12.855 -4.647 1.00 2.52 H new ATOM 0 HG1 THR A1980 -17.387 -10.763 -4.606 1.00 2.72 H new ATOM 0 HG21 THR A1980 -19.291 -11.790 -6.448 1.00 2.83 H new ATOM 0 HG22 THR A1980 -20.251 -13.077 -5.680 1.00 2.83 H new ATOM 0 HG23 THR A1980 -20.603 -11.370 -5.321 1.00 2.83 H new ATOM 1437 N ASP A1981 -17.576 -12.391 -1.701 1.00 2.25 N ATOM 1438 CA ASP A1981 -16.511 -12.847 -0.834 1.00 2.32 C ATOM 1439 C ASP A1981 -16.701 -12.387 0.580 1.00 2.24 C ATOM 1440 O ASP A1981 -16.194 -11.339 0.981 1.00 2.36 O ATOM 1441 CB ASP A1981 -15.122 -12.433 -1.340 1.00 2.46 C ATOM 1442 CG ASP A1981 -14.485 -13.438 -2.273 1.00 2.87 C ATOM 1443 OD1 ASP A1981 -14.804 -13.426 -3.468 1.00 3.37 O ATOM 1444 OD2 ASP A1981 -13.651 -14.253 -1.839 1.00 3.20 O ATOM 0 H ASP A1981 -17.541 -11.393 -1.909 1.00 2.25 H new ATOM 0 HA ASP A1981 -16.562 -13.936 -0.852 1.00 2.32 H new ATOM 0 HB2 ASP A1981 -15.204 -11.476 -1.854 1.00 2.46 H new ATOM 0 HB3 ASP A1981 -14.465 -12.280 -0.484 1.00 2.46 H new ATOM 1449 N LEU A1982 -17.494 -13.118 1.317 1.00 2.24 N ATOM 1450 CA LEU A1982 -17.678 -12.835 2.721 1.00 2.35 C ATOM 1451 C LEU A1982 -16.749 -13.733 3.486 1.00 2.41 C ATOM 1452 O LEU A1982 -16.055 -13.316 4.412 1.00 2.56 O ATOM 1453 CB LEU A1982 -19.114 -13.113 3.238 1.00 2.55 C ATOM 1454 CG LEU A1982 -20.307 -12.526 2.483 1.00 2.64 C ATOM 1455 CD1 LEU A1982 -20.724 -13.439 1.344 1.00 2.83 C ATOM 1456 CD2 LEU A1982 -21.467 -12.272 3.430 1.00 2.91 C ATOM 0 H LEU A1982 -18.026 -13.917 0.970 1.00 2.24 H new ATOM 0 HA LEU A1982 -17.482 -11.772 2.862 1.00 2.35 H new ATOM 0 HB2 LEU A1982 -19.247 -14.194 3.271 1.00 2.55 H new ATOM 0 HB3 LEU A1982 -19.168 -12.754 4.266 1.00 2.55 H new ATOM 0 HG LEU A1982 -20.005 -11.570 2.054 1.00 2.64 H new ATOM 0 HD11 LEU A1982 -21.574 -13.002 0.820 1.00 2.83 H new ATOM 0 HD12 LEU A1982 -19.892 -13.558 0.650 1.00 2.83 H new ATOM 0 HD13 LEU A1982 -21.005 -14.413 1.743 1.00 2.83 H new ATOM 0 HD21 LEU A1982 -22.306 -11.854 2.874 1.00 2.91 H new ATOM 0 HD22 LEU A1982 -21.770 -13.211 3.894 1.00 2.91 H new ATOM 0 HD23 LEU A1982 -21.158 -11.568 4.203 1.00 2.91 H new ATOM 1468 N LYS A1983 -16.727 -14.983 3.071 1.00 2.40 N ATOM 1469 CA LYS A1983 -16.013 -16.002 3.788 1.00 2.57 C ATOM 1470 C LYS A1983 -14.836 -16.565 3.010 1.00 2.46 C ATOM 1471 O LYS A1983 -13.999 -17.272 3.577 1.00 2.62 O ATOM 1472 CB LYS A1983 -16.980 -17.104 4.231 1.00 2.75 C ATOM 1473 CG LYS A1983 -17.723 -17.770 3.102 1.00 2.91 C ATOM 1474 CD LYS A1983 -18.752 -18.780 3.610 1.00 3.23 C ATOM 1475 CE LYS A1983 -18.112 -19.969 4.319 1.00 3.77 C ATOM 1476 NZ LYS A1983 -17.317 -20.802 3.399 1.00 4.43 N ATOM 0 H LYS A1983 -17.203 -15.313 2.231 1.00 2.40 H new ATOM 0 HA LYS A1983 -15.580 -15.536 4.673 1.00 2.57 H new ATOM 0 HB2 LYS A1983 -16.421 -17.862 4.779 1.00 2.75 H new ATOM 0 HB3 LYS A1983 -17.704 -16.678 4.925 1.00 2.75 H new ATOM 0 HG2 LYS A1983 -18.225 -17.012 2.502 1.00 2.91 H new ATOM 0 HG3 LYS A1983 -17.012 -18.275 2.448 1.00 2.91 H new ATOM 0 HD2 LYS A1983 -19.438 -18.280 4.295 1.00 3.23 H new ATOM 0 HD3 LYS A1983 -19.346 -19.140 2.770 1.00 3.23 H new ATOM 0 HE2 LYS A1983 -17.473 -19.609 5.125 1.00 3.77 H new ATOM 0 HE3 LYS A1983 -18.890 -20.578 4.778 1.00 3.77 H new ATOM 0 HZ1 LYS A1983 -17.028 -21.675 3.884 1.00 4.43 H new ATOM 0 HZ2 LYS A1983 -17.890 -21.042 2.565 1.00 4.43 H new ATOM 0 HZ3 LYS A1983 -16.471 -20.277 3.098 1.00 4.43 H new ATOM 1490 N MET A1984 -14.757 -16.265 1.719 1.00 2.32 N ATOM 1491 CA MET A1984 -13.643 -16.761 0.926 1.00 2.29 C ATOM 1492 C MET A1984 -12.383 -15.921 1.157 1.00 2.18 C ATOM 1493 O MET A1984 -11.631 -16.191 2.107 1.00 2.40 O ATOM 1494 CB MET A1984 -13.971 -16.917 -0.572 1.00 2.28 C ATOM 1495 CG MET A1984 -15.079 -17.908 -0.891 1.00 2.33 C ATOM 1496 SD MET A1984 -15.332 -18.155 -2.677 1.00 2.53 S ATOM 1497 CE MET A1984 -15.848 -16.514 -3.215 1.00 2.68 C ATOM 0 H MET A1984 -15.433 -15.695 1.211 1.00 2.32 H new ATOM 0 HA MET A1984 -13.443 -17.772 1.280 1.00 2.29 H new ATOM 0 HB2 MET A1984 -14.252 -15.942 -0.970 1.00 2.28 H new ATOM 0 HB3 MET A1984 -13.066 -17.226 -1.096 1.00 2.28 H new ATOM 0 HG2 MET A1984 -14.844 -18.867 -0.428 1.00 2.33 H new ATOM 0 HG3 MET A1984 -16.010 -17.558 -0.444 1.00 2.33 H new ATOM 0 HE1 MET A1984 -16.634 -16.607 -3.964 1.00 2.68 H new ATOM 0 HE2 MET A1984 -16.226 -15.953 -2.360 1.00 2.68 H new ATOM 0 HE3 MET A1984 -14.996 -15.988 -3.646 1.00 2.68 H new ATOM 1507 N LYS A1985 -12.148 -14.911 0.336 1.00 2.14 N ATOM 1508 CA LYS A1985 -10.994 -14.048 0.526 1.00 2.09 C ATOM 1509 C LYS A1985 -11.374 -12.572 0.479 1.00 1.89 C ATOM 1510 O LYS A1985 -12.557 -12.231 0.450 1.00 2.34 O ATOM 1511 CB LYS A1985 -9.867 -14.352 -0.482 1.00 2.67 C ATOM 1512 CG LYS A1985 -10.220 -14.171 -1.947 1.00 3.08 C ATOM 1513 CD LYS A1985 -8.983 -14.367 -2.815 1.00 3.73 C ATOM 1514 CE LYS A1985 -9.304 -14.293 -4.298 1.00 4.42 C ATOM 1515 NZ LYS A1985 -10.197 -15.383 -4.721 1.00 4.89 N ATOM 0 H LYS A1985 -12.735 -14.670 -0.462 1.00 2.14 H new ATOM 0 HA LYS A1985 -10.612 -14.265 1.523 1.00 2.09 H new ATOM 0 HB2 LYS A1985 -9.017 -13.710 -0.251 1.00 2.67 H new ATOM 0 HB3 LYS A1985 -9.540 -15.381 -0.332 1.00 2.67 H new ATOM 0 HG2 LYS A1985 -10.991 -14.886 -2.234 1.00 3.08 H new ATOM 0 HG3 LYS A1985 -10.633 -13.175 -2.109 1.00 3.08 H new ATOM 0 HD2 LYS A1985 -8.243 -13.606 -2.567 1.00 3.73 H new ATOM 0 HD3 LYS A1985 -8.533 -15.334 -2.590 1.00 3.73 H new ATOM 0 HE2 LYS A1985 -9.771 -13.334 -4.521 1.00 4.42 H new ATOM 0 HE3 LYS A1985 -8.379 -14.338 -4.872 1.00 4.42 H new ATOM 0 HZ1 LYS A1985 -9.846 -15.795 -5.609 1.00 4.89 H new ATOM 0 HZ2 LYS A1985 -10.222 -16.117 -3.985 1.00 4.89 H new ATOM 0 HZ3 LYS A1985 -11.156 -15.009 -4.869 1.00 4.89 H new ATOM 1529 N HIS A1986 -10.350 -11.719 0.549 1.00 1.63 N ATOM 1530 CA HIS A1986 -10.438 -10.261 0.372 1.00 1.68 C ATOM 1531 C HIS A1986 -9.084 -9.684 0.728 1.00 1.14 C ATOM 1532 O HIS A1986 -8.818 -9.420 1.896 1.00 1.35 O ATOM 1533 CB HIS A1986 -11.518 -9.590 1.271 1.00 2.46 C ATOM 1534 CG HIS A1986 -11.859 -8.149 0.911 1.00 3.48 C ATOM 1535 ND1 HIS A1986 -13.042 -7.557 1.268 1.00 4.38 N ATOM 1536 CD2 HIS A1986 -11.178 -7.194 0.221 1.00 4.21 C ATOM 1537 CE1 HIS A1986 -13.081 -6.324 0.826 1.00 5.37 C ATOM 1538 NE2 HIS A1986 -11.972 -6.073 0.183 1.00 5.32 N ATOM 0 H HIS A1986 -9.398 -12.033 0.738 1.00 1.63 H new ATOM 0 HA HIS A1986 -10.726 -10.063 -0.660 1.00 1.68 H new ATOM 0 HB2 HIS A1986 -12.430 -10.185 1.222 1.00 2.46 H new ATOM 0 HB3 HIS A1986 -11.175 -9.618 2.305 1.00 2.46 H new ATOM 0 HD1 HIS A1986 -13.785 -8.010 1.801 1.00 4.38 H new ATOM 0 HD2 HIS A1986 -10.196 -7.298 -0.216 1.00 4.21 H new ATOM 0 HE1 HIS A1986 -13.896 -5.630 0.970 1.00 5.37 H new ATOM 1547 N LYS A1987 -8.224 -9.524 -0.249 1.00 1.12 N ATOM 1548 CA LYS A1987 -6.890 -9.007 0.008 1.00 1.18 C ATOM 1549 C LYS A1987 -6.405 -8.130 -1.120 1.00 1.02 C ATOM 1550 O LYS A1987 -6.755 -8.338 -2.287 1.00 1.30 O ATOM 1551 CB LYS A1987 -5.879 -10.141 0.295 1.00 1.91 C ATOM 1552 CG LYS A1987 -5.752 -11.200 -0.789 1.00 2.70 C ATOM 1553 CD LYS A1987 -4.699 -12.250 -0.425 1.00 3.34 C ATOM 1554 CE LYS A1987 -5.044 -12.991 0.862 1.00 3.96 C ATOM 1555 NZ LYS A1987 -4.072 -14.064 1.169 1.00 4.45 N ATOM 0 H LYS A1987 -8.417 -9.741 -1.227 1.00 1.12 H new ATOM 0 HA LYS A1987 -6.960 -8.391 0.904 1.00 1.18 H new ATOM 0 HB2 LYS A1987 -4.898 -9.695 0.459 1.00 1.91 H new ATOM 0 HB3 LYS A1987 -6.166 -10.632 1.225 1.00 1.91 H new ATOM 0 HG2 LYS A1987 -6.716 -11.686 -0.939 1.00 2.70 H new ATOM 0 HG3 LYS A1987 -5.484 -10.726 -1.733 1.00 2.70 H new ATOM 0 HD2 LYS A1987 -4.606 -12.967 -1.241 1.00 3.34 H new ATOM 0 HD3 LYS A1987 -3.729 -11.766 -0.314 1.00 3.34 H new ATOM 0 HE2 LYS A1987 -5.074 -12.283 1.690 1.00 3.96 H new ATOM 0 HE3 LYS A1987 -6.042 -13.421 0.775 1.00 3.96 H new ATOM 0 HZ1 LYS A1987 -4.347 -14.540 2.052 1.00 4.45 H new ATOM 0 HZ2 LYS A1987 -4.061 -14.755 0.392 1.00 4.45 H new ATOM 0 HZ3 LYS A1987 -3.123 -13.652 1.279 1.00 4.45 H new ATOM 1569 N SER A1988 -5.639 -7.151 -0.777 1.00 0.68 N ATOM 1570 CA SER A1988 -5.076 -6.263 -1.727 1.00 0.60 C ATOM 1571 C SER A1988 -3.541 -6.289 -1.604 1.00 0.50 C ATOM 1572 O SER A1988 -2.979 -6.119 -0.500 1.00 0.57 O ATOM 1573 CB SER A1988 -5.646 -4.863 -1.509 1.00 0.64 C ATOM 1574 OG SER A1988 -7.079 -4.892 -1.521 1.00 1.41 O ATOM 0 H SER A1988 -5.384 -6.945 0.189 1.00 0.68 H new ATOM 0 HA SER A1988 -5.333 -6.573 -2.740 1.00 0.60 H new ATOM 0 HB2 SER A1988 -5.293 -4.465 -0.557 1.00 0.64 H new ATOM 0 HB3 SER A1988 -5.284 -4.192 -2.288 1.00 0.64 H new ATOM 0 HG SER A1988 -7.426 -3.987 -1.378 1.00 1.41 H new ATOM 1580 N TYR A1989 -2.890 -6.548 -2.721 1.00 0.51 N ATOM 1581 CA TYR A1989 -1.445 -6.659 -2.805 1.00 0.49 C ATOM 1582 C TYR A1989 -0.879 -5.339 -3.276 1.00 0.41 C ATOM 1583 O TYR A1989 -1.343 -4.805 -4.281 1.00 0.42 O ATOM 1584 CB TYR A1989 -1.055 -7.710 -3.856 1.00 0.63 C ATOM 1585 CG TYR A1989 -1.587 -9.114 -3.649 1.00 0.75 C ATOM 1586 CD1 TYR A1989 -2.909 -9.434 -3.944 1.00 1.69 C ATOM 1587 CD2 TYR A1989 -0.752 -10.132 -3.215 1.00 1.18 C ATOM 1588 CE1 TYR A1989 -3.379 -10.718 -3.805 1.00 2.13 C ATOM 1589 CE2 TYR A1989 -1.221 -11.421 -3.064 1.00 1.40 C ATOM 1590 CZ TYR A1989 -2.533 -11.708 -3.364 1.00 1.66 C ATOM 1591 OH TYR A1989 -3.002 -13.003 -3.249 1.00 2.20 O ATOM 0 H TYR A1989 -3.360 -6.690 -3.615 1.00 0.51 H new ATOM 0 HA TYR A1989 -1.061 -6.937 -1.824 1.00 0.49 H new ATOM 0 HB2 TYR A1989 -1.395 -7.358 -4.830 1.00 0.63 H new ATOM 0 HB3 TYR A1989 0.033 -7.762 -3.897 1.00 0.63 H new ATOM 0 HD1 TYR A1989 -3.578 -8.659 -4.288 1.00 1.69 H new ATOM 0 HD2 TYR A1989 0.282 -9.913 -2.992 1.00 1.18 H new ATOM 0 HE1 TYR A1989 -4.407 -10.948 -4.041 1.00 2.13 H new ATOM 0 HE2 TYR A1989 -0.562 -12.201 -2.712 1.00 1.40 H new ATOM 0 HH TYR A1989 -2.282 -13.584 -2.926 1.00 2.20 H new ATOM 1601 N PHE A1990 0.086 -4.814 -2.569 1.00 0.40 N ATOM 1602 CA PHE A1990 0.741 -3.584 -2.965 1.00 0.40 C ATOM 1603 C PHE A1990 2.215 -3.877 -3.162 1.00 0.40 C ATOM 1604 O PHE A1990 2.933 -4.202 -2.208 1.00 0.51 O ATOM 1605 CB PHE A1990 0.519 -2.497 -1.902 1.00 0.49 C ATOM 1606 CG PHE A1990 -0.930 -2.366 -1.539 1.00 0.84 C ATOM 1607 CD1 PHE A1990 -1.821 -1.765 -2.410 1.00 1.31 C ATOM 1608 CD2 PHE A1990 -1.389 -2.799 -0.314 1.00 1.45 C ATOM 1609 CE1 PHE A1990 -3.140 -1.607 -2.064 1.00 2.02 C ATOM 1610 CE2 PHE A1990 -2.705 -2.635 0.040 1.00 2.10 C ATOM 1611 CZ PHE A1990 -3.615 -2.212 -0.905 1.00 2.31 C ATOM 0 H PHE A1990 0.443 -5.221 -1.705 1.00 0.40 H new ATOM 0 HA PHE A1990 0.321 -3.210 -3.899 1.00 0.40 H new ATOM 0 HB2 PHE A1990 1.098 -2.736 -1.010 1.00 0.49 H new ATOM 0 HB3 PHE A1990 0.889 -1.542 -2.275 1.00 0.49 H new ATOM 0 HD1 PHE A1990 -1.475 -1.417 -3.372 1.00 1.31 H new ATOM 0 HD2 PHE A1990 -0.706 -3.273 0.375 1.00 1.45 H new ATOM 0 HE1 PHE A1990 -3.801 -1.020 -2.684 1.00 2.02 H new ATOM 0 HE2 PHE A1990 -3.025 -2.836 1.052 1.00 2.10 H new ATOM 0 HZ PHE A1990 -4.675 -2.348 -0.749 1.00 2.31 H new ATOM 1621 N SER A1991 2.645 -3.831 -4.393 1.00 0.35 N ATOM 1622 CA SER A1991 3.997 -4.182 -4.741 1.00 0.36 C ATOM 1623 C SER A1991 4.894 -2.947 -4.901 1.00 0.40 C ATOM 1624 O SER A1991 4.847 -2.245 -5.911 1.00 0.55 O ATOM 1625 CB SER A1991 3.981 -5.018 -6.019 1.00 0.36 C ATOM 1626 OG SER A1991 3.070 -6.111 -5.878 1.00 1.09 O ATOM 0 H SER A1991 2.068 -3.549 -5.185 1.00 0.35 H new ATOM 0 HA SER A1991 4.423 -4.766 -3.925 1.00 0.36 H new ATOM 0 HB2 SER A1991 3.688 -4.397 -6.866 1.00 0.36 H new ATOM 0 HB3 SER A1991 4.982 -5.394 -6.230 1.00 0.36 H new ATOM 0 HG SER A1991 3.065 -6.641 -6.702 1.00 1.09 H new ATOM 1632 N PHE A1992 5.684 -2.689 -3.900 1.00 0.36 N ATOM 1633 CA PHE A1992 6.616 -1.596 -3.903 1.00 0.37 C ATOM 1634 C PHE A1992 7.898 -2.048 -4.567 1.00 0.39 C ATOM 1635 O PHE A1992 8.659 -2.847 -4.029 1.00 0.40 O ATOM 1636 CB PHE A1992 6.877 -1.084 -2.482 1.00 0.40 C ATOM 1637 CG PHE A1992 5.686 -0.427 -1.842 1.00 0.48 C ATOM 1638 CD1 PHE A1992 4.646 -1.182 -1.319 1.00 0.58 C ATOM 1639 CD2 PHE A1992 5.606 0.951 -1.767 1.00 0.56 C ATOM 1640 CE1 PHE A1992 3.558 -0.573 -0.737 1.00 0.71 C ATOM 1641 CE2 PHE A1992 4.518 1.563 -1.183 1.00 0.68 C ATOM 1642 CZ PHE A1992 3.493 0.800 -0.670 1.00 0.74 C ATOM 0 H PHE A1992 5.700 -3.241 -3.043 1.00 0.36 H new ATOM 0 HA PHE A1992 6.193 -0.764 -4.465 1.00 0.37 H new ATOM 0 HB2 PHE A1992 7.197 -1.919 -1.859 1.00 0.40 H new ATOM 0 HB3 PHE A1992 7.702 -0.372 -2.509 1.00 0.40 H new ATOM 0 HD1 PHE A1992 4.691 -2.260 -1.369 1.00 0.58 H new ATOM 0 HD2 PHE A1992 6.405 1.555 -2.171 1.00 0.56 H new ATOM 0 HE1 PHE A1992 2.755 -1.172 -0.333 1.00 0.71 H new ATOM 0 HE2 PHE A1992 4.469 2.640 -1.128 1.00 0.68 H new ATOM 0 HZ PHE A1992 2.638 1.279 -0.215 1.00 0.74 H new ATOM 1652 N VAL A1993 8.108 -1.560 -5.734 1.00 0.44 N ATOM 1653 CA VAL A1993 9.219 -1.946 -6.545 1.00 0.51 C ATOM 1654 C VAL A1993 10.258 -0.821 -6.635 1.00 0.53 C ATOM 1655 O VAL A1993 9.903 0.368 -6.790 1.00 0.58 O ATOM 1656 CB VAL A1993 8.723 -2.438 -7.944 1.00 0.59 C ATOM 1657 CG1 VAL A1993 7.727 -1.468 -8.539 1.00 0.76 C ATOM 1658 CG2 VAL A1993 9.872 -2.653 -8.904 1.00 0.91 C ATOM 0 H VAL A1993 7.502 -0.864 -6.168 1.00 0.44 H new ATOM 0 HA VAL A1993 9.729 -2.787 -6.074 1.00 0.51 H new ATOM 0 HB VAL A1993 8.230 -3.397 -7.787 1.00 0.59 H new ATOM 0 HG11 VAL A1993 7.399 -1.835 -9.512 1.00 0.76 H new ATOM 0 HG12 VAL A1993 6.867 -1.377 -7.876 1.00 0.76 H new ATOM 0 HG13 VAL A1993 8.197 -0.492 -8.659 1.00 0.76 H new ATOM 0 HG21 VAL A1993 9.485 -2.994 -9.864 1.00 0.91 H new ATOM 0 HG22 VAL A1993 10.411 -1.716 -9.043 1.00 0.91 H new ATOM 0 HG23 VAL A1993 10.550 -3.404 -8.498 1.00 0.91 H new ATOM 1668 N CYS A1994 11.516 -1.209 -6.457 1.00 0.59 N ATOM 1669 CA CYS A1994 12.678 -0.331 -6.461 1.00 0.67 C ATOM 1670 C CYS A1994 12.753 0.542 -7.708 1.00 0.65 C ATOM 1671 O CYS A1994 13.016 0.052 -8.822 1.00 0.84 O ATOM 1672 CB CYS A1994 13.947 -1.184 -6.386 1.00 0.88 C ATOM 1673 SG CYS A1994 13.640 -2.937 -5.986 1.00 1.47 S ATOM 0 H CYS A1994 11.763 -2.186 -6.299 1.00 0.59 H new ATOM 0 HA CYS A1994 12.588 0.330 -5.599 1.00 0.67 H new ATOM 0 HB2 CYS A1994 14.468 -1.126 -7.341 1.00 0.88 H new ATOM 0 HB3 CYS A1994 14.613 -0.761 -5.633 1.00 0.88 H new ATOM 1678 N LYS A1995 12.432 1.801 -7.550 1.00 0.77 N ATOM 1679 CA LYS A1995 12.642 2.756 -8.588 1.00 0.93 C ATOM 1680 C LYS A1995 13.120 4.068 -8.033 1.00 1.05 C ATOM 1681 O LYS A1995 12.325 4.920 -7.632 1.00 1.39 O ATOM 1682 CB LYS A1995 11.457 2.907 -9.554 1.00 1.37 C ATOM 1683 CG LYS A1995 11.655 4.004 -10.599 1.00 1.79 C ATOM 1684 CD LYS A1995 10.743 3.831 -11.795 1.00 2.03 C ATOM 1685 CE LYS A1995 11.258 2.734 -12.721 1.00 2.56 C ATOM 1686 NZ LYS A1995 12.536 3.119 -13.389 1.00 3.14 N ATOM 0 H LYS A1995 12.020 2.184 -6.699 1.00 0.77 H new ATOM 0 HA LYS A1995 13.441 2.355 -9.211 1.00 0.93 H new ATOM 0 HB2 LYS A1995 11.291 1.958 -10.063 1.00 1.37 H new ATOM 0 HB3 LYS A1995 10.556 3.122 -8.980 1.00 1.37 H new ATOM 0 HG2 LYS A1995 11.470 4.976 -10.142 1.00 1.79 H new ATOM 0 HG3 LYS A1995 12.693 4.001 -10.933 1.00 1.79 H new ATOM 0 HD2 LYS A1995 9.737 3.584 -11.457 1.00 2.03 H new ATOM 0 HD3 LYS A1995 10.673 4.771 -12.343 1.00 2.03 H new ATOM 0 HE2 LYS A1995 11.410 1.819 -12.149 1.00 2.56 H new ATOM 0 HE3 LYS A1995 10.505 2.516 -13.478 1.00 2.56 H new ATOM 0 HZ1 LYS A1995 12.771 2.417 -14.120 1.00 3.14 H new ATOM 0 HZ2 LYS A1995 12.429 4.055 -13.830 1.00 3.14 H new ATOM 0 HZ3 LYS A1995 13.300 3.154 -12.684 1.00 3.14 H new ATOM 1700 N SER A1996 14.418 4.230 -8.028 1.00 1.31 N ATOM 1701 CA SER A1996 15.071 5.431 -7.554 1.00 1.68 C ATOM 1702 C SER A1996 14.842 6.561 -8.565 1.00 1.67 C ATOM 1703 O SER A1996 15.072 7.735 -8.290 1.00 2.05 O ATOM 1704 CB SER A1996 16.558 5.139 -7.407 1.00 2.15 C ATOM 1705 OG SER A1996 16.745 3.908 -6.720 1.00 2.57 O ATOM 0 H SER A1996 15.068 3.517 -8.360 1.00 1.31 H new ATOM 0 HA SER A1996 14.664 5.739 -6.591 1.00 1.68 H new ATOM 0 HB2 SER A1996 17.027 5.092 -8.390 1.00 2.15 H new ATOM 0 HB3 SER A1996 17.044 5.948 -6.861 1.00 2.15 H new ATOM 0 HG SER A1996 17.111 4.083 -5.828 1.00 2.57 H new ATOM 1711 N ASP A1997 14.362 6.173 -9.740 1.00 1.56 N ATOM 1712 CA ASP A1997 14.049 7.097 -10.826 1.00 1.73 C ATOM 1713 C ASP A1997 12.764 7.842 -10.506 1.00 1.59 C ATOM 1714 O ASP A1997 12.479 8.900 -11.066 1.00 2.04 O ATOM 1715 CB ASP A1997 13.881 6.344 -12.151 1.00 1.99 C ATOM 1716 CG ASP A1997 15.051 5.457 -12.483 1.00 2.32 C ATOM 1717 OD1 ASP A1997 16.109 5.973 -12.898 1.00 2.65 O ATOM 1718 OD2 ASP A1997 14.931 4.211 -12.318 1.00 2.80 O ATOM 0 H ASP A1997 14.177 5.197 -9.970 1.00 1.56 H new ATOM 0 HA ASP A1997 14.874 7.803 -10.927 1.00 1.73 H new ATOM 0 HB2 ASP A1997 12.976 5.738 -12.105 1.00 1.99 H new ATOM 0 HB3 ASP A1997 13.741 7.065 -12.956 1.00 1.99 H new ATOM 1723 N ALA A1998 11.985 7.280 -9.587 1.00 1.32 N ATOM 1724 CA ALA A1998 10.751 7.896 -9.137 1.00 1.24 C ATOM 1725 C ALA A1998 11.075 8.943 -8.079 1.00 1.57 C ATOM 1726 O ALA A1998 10.246 9.791 -7.740 1.00 1.87 O ATOM 1727 CB ALA A1998 9.806 6.843 -8.600 1.00 1.44 C ATOM 0 H ALA A1998 12.194 6.389 -9.138 1.00 1.32 H new ATOM 0 HA ALA A1998 10.254 8.386 -9.974 1.00 1.24 H new ATOM 0 HB1 ALA A1998 8.884 7.318 -8.266 1.00 1.44 H new ATOM 0 HB2 ALA A1998 9.579 6.123 -9.386 1.00 1.44 H new ATOM 0 HB3 ALA A1998 10.274 6.328 -7.761 1.00 1.44 H new ATOM 1733 N GLY A1999 12.278 8.827 -7.546 1.00 2.05 N ATOM 1734 CA GLY A1999 12.838 9.802 -6.643 1.00 2.88 C ATOM 1735 C GLY A1999 12.127 9.932 -5.318 1.00 2.81 C ATOM 1736 O GLY A1999 11.831 8.934 -4.641 1.00 3.07 O ATOM 0 H GLY A1999 12.898 8.039 -7.734 1.00 2.05 H new ATOM 0 HA2 GLY A1999 13.880 9.543 -6.454 1.00 2.88 H new ATOM 0 HA3 GLY A1999 12.835 10.774 -7.136 1.00 2.88 H new ATOM 1740 N ASP A2000 11.822 11.151 -4.992 1.00 2.90 N ATOM 1741 CA ASP A2000 11.244 11.545 -3.719 1.00 3.13 C ATOM 1742 C ASP A2000 9.745 11.419 -3.751 1.00 2.60 C ATOM 1743 O ASP A2000 9.110 11.024 -2.752 1.00 2.99 O ATOM 1744 CB ASP A2000 11.624 13.003 -3.438 1.00 3.84 C ATOM 1745 CG ASP A2000 10.951 13.586 -2.217 1.00 3.99 C ATOM 1746 OD1 ASP A2000 11.448 13.383 -1.081 1.00 4.30 O ATOM 1747 OD2 ASP A2000 9.897 14.226 -2.356 1.00 4.11 O ATOM 0 H ASP A2000 11.970 11.939 -5.623 1.00 2.90 H new ATOM 0 HA ASP A2000 11.628 10.891 -2.936 1.00 3.13 H new ATOM 0 HB2 ASP A2000 12.705 13.069 -3.312 1.00 3.84 H new ATOM 0 HB3 ASP A2000 11.367 13.609 -4.307 1.00 3.84 H new ATOM 1752 N ASP A2001 9.181 11.742 -4.892 1.00 2.08 N ATOM 1753 CA ASP A2001 7.740 11.716 -5.064 1.00 1.96 C ATOM 1754 C ASP A2001 7.291 10.309 -5.132 1.00 1.77 C ATOM 1755 O ASP A2001 6.469 9.857 -4.314 1.00 2.29 O ATOM 1756 CB ASP A2001 7.305 12.392 -6.365 1.00 2.29 C ATOM 1757 CG ASP A2001 7.765 13.824 -6.491 1.00 2.96 C ATOM 1758 OD1 ASP A2001 7.168 14.717 -5.853 1.00 3.24 O ATOM 1759 OD2 ASP A2001 8.748 14.085 -7.209 1.00 3.70 O ATOM 0 H ASP A2001 9.699 12.028 -5.723 1.00 2.08 H new ATOM 0 HA ASP A2001 7.301 12.249 -4.220 1.00 1.96 H new ATOM 0 HB2 ASP A2001 7.693 11.820 -7.208 1.00 2.29 H new ATOM 0 HB3 ASP A2001 6.218 12.362 -6.433 1.00 2.29 H new ATOM 1764 N SER A2002 7.861 9.607 -6.117 1.00 1.56 N ATOM 1765 CA SER A2002 7.520 8.249 -6.445 1.00 1.44 C ATOM 1766 C SER A2002 6.071 8.168 -6.988 1.00 1.26 C ATOM 1767 O SER A2002 5.337 9.176 -7.002 1.00 1.36 O ATOM 1768 CB SER A2002 7.743 7.344 -5.243 1.00 1.64 C ATOM 1769 OG SER A2002 9.087 7.446 -4.763 1.00 1.88 O ATOM 0 H SER A2002 8.591 9.993 -6.716 1.00 1.56 H new ATOM 0 HA SER A2002 8.176 7.895 -7.240 1.00 1.44 H new ATOM 0 HB2 SER A2002 7.048 7.613 -4.447 1.00 1.64 H new ATOM 0 HB3 SER A2002 7.529 6.311 -5.517 1.00 1.64 H new ATOM 0 HG SER A2002 9.551 8.165 -5.241 1.00 1.88 H new ATOM 1775 N GLN A2003 5.668 7.018 -7.465 1.00 1.23 N ATOM 1776 CA GLN A2003 4.317 6.877 -7.999 1.00 1.09 C ATOM 1777 C GLN A2003 3.722 5.496 -7.779 1.00 0.88 C ATOM 1778 O GLN A2003 4.429 4.472 -7.849 1.00 1.00 O ATOM 1779 CB GLN A2003 4.249 7.198 -9.493 1.00 1.33 C ATOM 1780 CG GLN A2003 5.135 6.297 -10.355 1.00 1.53 C ATOM 1781 CD GLN A2003 4.979 6.518 -11.847 1.00 1.86 C ATOM 1782 OE1 GLN A2003 5.930 6.339 -12.603 1.00 2.51 O ATOM 1783 NE2 GLN A2003 3.802 6.884 -12.286 1.00 1.74 N ATOM 0 H GLN A2003 6.237 6.172 -7.500 1.00 1.23 H new ATOM 0 HA GLN A2003 3.727 7.602 -7.438 1.00 1.09 H new ATOM 0 HB2 GLN A2003 3.216 7.106 -9.829 1.00 1.33 H new ATOM 0 HB3 GLN A2003 4.543 8.236 -9.647 1.00 1.33 H new ATOM 0 HG2 GLN A2003 6.177 6.462 -10.081 1.00 1.53 H new ATOM 0 HG3 GLN A2003 4.906 5.256 -10.127 1.00 1.53 H new ATOM 0 HE21 GLN A2003 3.034 7.024 -11.630 1.00 1.74 H new ATOM 0 HE22 GLN A2003 3.653 7.029 -13.284 1.00 1.74 H new ATOM 1792 N PRO A2004 2.422 5.458 -7.502 1.00 0.72 N ATOM 1793 CA PRO A2004 1.656 4.237 -7.418 1.00 0.61 C ATOM 1794 C PRO A2004 1.070 3.863 -8.783 1.00 0.60 C ATOM 1795 O PRO A2004 0.738 4.737 -9.600 1.00 0.74 O ATOM 1796 CB PRO A2004 0.515 4.591 -6.452 1.00 0.66 C ATOM 1797 CG PRO A2004 0.640 6.066 -6.179 1.00 0.77 C ATOM 1798 CD PRO A2004 1.585 6.618 -7.194 1.00 0.83 C ATOM 0 HA PRO A2004 2.261 3.391 -7.092 1.00 0.61 H new ATOM 0 HB2 PRO A2004 -0.454 4.357 -6.892 1.00 0.66 H new ATOM 0 HB3 PRO A2004 0.593 4.016 -5.529 1.00 0.66 H new ATOM 0 HG2 PRO A2004 -0.331 6.555 -6.250 1.00 0.77 H new ATOM 0 HG3 PRO A2004 1.012 6.241 -5.170 1.00 0.77 H new ATOM 0 HD2 PRO A2004 1.063 6.989 -8.076 1.00 0.83 H new ATOM 0 HD3 PRO A2004 2.170 7.448 -6.797 1.00 0.83 H new ATOM 1806 N VAL A2005 0.951 2.595 -9.022 1.00 0.57 N ATOM 1807 CA VAL A2005 0.400 2.071 -10.245 1.00 0.59 C ATOM 1808 C VAL A2005 -0.734 1.129 -9.886 1.00 0.59 C ATOM 1809 O VAL A2005 -0.576 0.255 -9.025 1.00 0.62 O ATOM 1810 CB VAL A2005 1.477 1.304 -11.083 1.00 0.66 C ATOM 1811 CG1 VAL A2005 0.878 0.716 -12.360 1.00 0.73 C ATOM 1812 CG2 VAL A2005 2.642 2.221 -11.433 1.00 0.69 C ATOM 0 H VAL A2005 1.239 1.874 -8.361 1.00 0.57 H new ATOM 0 HA VAL A2005 0.041 2.900 -10.856 1.00 0.59 H new ATOM 0 HB VAL A2005 1.843 0.483 -10.467 1.00 0.66 H new ATOM 0 HG11 VAL A2005 1.654 0.191 -12.917 1.00 0.73 H new ATOM 0 HG12 VAL A2005 0.082 0.018 -12.101 1.00 0.73 H new ATOM 0 HG13 VAL A2005 0.471 1.519 -12.974 1.00 0.73 H new ATOM 0 HG21 VAL A2005 3.379 1.667 -12.015 1.00 0.69 H new ATOM 0 HG22 VAL A2005 2.277 3.065 -12.018 1.00 0.69 H new ATOM 0 HG23 VAL A2005 3.105 2.587 -10.517 1.00 0.69 H new ATOM 1822 N PHE A2006 -1.871 1.327 -10.488 1.00 0.62 N ATOM 1823 CA PHE A2006 -2.998 0.474 -10.242 1.00 0.65 C ATOM 1824 C PHE A2006 -3.104 -0.583 -11.329 1.00 0.63 C ATOM 1825 O PHE A2006 -3.358 -0.275 -12.492 1.00 0.71 O ATOM 1826 CB PHE A2006 -4.321 1.278 -10.038 1.00 0.76 C ATOM 1827 CG PHE A2006 -4.723 2.246 -11.135 1.00 0.86 C ATOM 1828 CD1 PHE A2006 -4.256 3.551 -11.130 1.00 0.91 C ATOM 1829 CD2 PHE A2006 -5.585 1.855 -12.151 1.00 1.01 C ATOM 1830 CE1 PHE A2006 -4.633 4.440 -12.117 1.00 1.08 C ATOM 1831 CE2 PHE A2006 -5.966 2.744 -13.138 1.00 1.17 C ATOM 1832 CZ PHE A2006 -5.488 4.037 -13.121 1.00 1.21 C ATOM 0 H PHE A2006 -2.043 2.077 -11.157 1.00 0.62 H new ATOM 0 HA PHE A2006 -2.834 -0.044 -9.297 1.00 0.65 H new ATOM 0 HB2 PHE A2006 -5.133 0.563 -9.905 1.00 0.76 H new ATOM 0 HB3 PHE A2006 -4.235 1.839 -9.108 1.00 0.76 H new ATOM 0 HD1 PHE A2006 -3.589 3.876 -10.345 1.00 0.91 H new ATOM 0 HD2 PHE A2006 -5.962 0.843 -12.170 1.00 1.01 H new ATOM 0 HE1 PHE A2006 -4.258 5.453 -12.103 1.00 1.08 H new ATOM 0 HE2 PHE A2006 -6.638 2.426 -13.922 1.00 1.17 H new ATOM 0 HZ PHE A2006 -5.783 4.733 -13.893 1.00 1.21 H new ATOM 1842 N LEU A2007 -2.857 -1.823 -10.959 1.00 0.62 N ATOM 1843 CA LEU A2007 -2.906 -2.917 -11.907 1.00 0.71 C ATOM 1844 C LEU A2007 -4.343 -3.294 -12.166 1.00 0.81 C ATOM 1845 O LEU A2007 -4.844 -3.128 -13.283 1.00 0.97 O ATOM 1846 CB LEU A2007 -2.087 -4.148 -11.436 1.00 0.81 C ATOM 1847 CG LEU A2007 -0.538 -4.048 -11.457 1.00 0.85 C ATOM 1848 CD1 LEU A2007 -0.018 -2.932 -10.569 1.00 1.29 C ATOM 1849 CD2 LEU A2007 0.075 -5.375 -11.042 1.00 1.10 C ATOM 0 H LEU A2007 -2.620 -2.099 -10.006 1.00 0.62 H new ATOM 0 HA LEU A2007 -2.445 -2.577 -12.834 1.00 0.71 H new ATOM 0 HB2 LEU A2007 -2.392 -4.381 -10.416 1.00 0.81 H new ATOM 0 HB3 LEU A2007 -2.375 -4.997 -12.056 1.00 0.81 H new ATOM 0 HG LEU A2007 -0.243 -3.810 -12.479 1.00 0.85 H new ATOM 0 HD11 LEU A2007 1.071 -2.904 -10.619 1.00 1.29 H new ATOM 0 HD12 LEU A2007 -0.421 -1.978 -10.910 1.00 1.29 H new ATOM 0 HD13 LEU A2007 -0.329 -3.111 -9.540 1.00 1.29 H new ATOM 0 HD21 LEU A2007 1.162 -5.295 -11.060 1.00 1.10 H new ATOM 0 HD22 LEU A2007 -0.254 -5.628 -10.034 1.00 1.10 H new ATOM 0 HD23 LEU A2007 -0.243 -6.155 -11.734 1.00 1.10 H new ATOM 1861 N SER A2008 -5.023 -3.760 -11.144 1.00 0.80 N ATOM 1862 CA SER A2008 -6.408 -4.124 -11.276 1.00 0.99 C ATOM 1863 C SER A2008 -7.097 -4.184 -9.930 1.00 0.80 C ATOM 1864 O SER A2008 -6.494 -4.574 -8.913 1.00 0.64 O ATOM 1865 CB SER A2008 -6.554 -5.467 -12.014 1.00 1.31 C ATOM 1866 OG SER A2008 -5.801 -6.504 -11.380 1.00 1.75 O ATOM 0 H SER A2008 -4.635 -3.895 -10.210 1.00 0.80 H new ATOM 0 HA SER A2008 -6.894 -3.348 -11.867 1.00 0.99 H new ATOM 0 HB2 SER A2008 -7.606 -5.751 -12.049 1.00 1.31 H new ATOM 0 HB3 SER A2008 -6.220 -5.354 -13.045 1.00 1.31 H new ATOM 0 HG SER A2008 -5.918 -7.342 -11.874 1.00 1.75 H new ATOM 1872 N PHE A2009 -8.320 -3.751 -9.908 1.00 0.90 N ATOM 1873 CA PHE A2009 -9.146 -3.885 -8.755 1.00 0.77 C ATOM 1874 C PHE A2009 -10.265 -4.836 -9.141 1.00 0.80 C ATOM 1875 O PHE A2009 -11.039 -4.560 -10.069 1.00 0.93 O ATOM 1876 CB PHE A2009 -9.724 -2.507 -8.340 1.00 0.85 C ATOM 1877 CG PHE A2009 -10.508 -2.499 -7.039 1.00 0.77 C ATOM 1878 CD1 PHE A2009 -11.782 -3.036 -6.986 1.00 1.14 C ATOM 1879 CD2 PHE A2009 -9.964 -1.965 -5.873 1.00 0.72 C ATOM 1880 CE1 PHE A2009 -12.503 -3.037 -5.804 1.00 1.16 C ATOM 1881 CE2 PHE A2009 -10.679 -1.961 -4.693 1.00 0.81 C ATOM 1882 CZ PHE A2009 -11.937 -2.469 -4.649 1.00 0.87 C ATOM 0 H PHE A2009 -8.774 -3.291 -10.698 1.00 0.90 H new ATOM 0 HA PHE A2009 -8.580 -4.266 -7.905 1.00 0.77 H new ATOM 0 HB2 PHE A2009 -8.901 -1.797 -8.254 1.00 0.85 H new ATOM 0 HB3 PHE A2009 -10.373 -2.148 -9.139 1.00 0.85 H new ATOM 0 HD1 PHE A2009 -12.220 -3.460 -7.878 1.00 1.14 H new ATOM 0 HD2 PHE A2009 -8.968 -1.548 -5.893 1.00 0.72 H new ATOM 0 HE1 PHE A2009 -13.492 -3.470 -5.769 1.00 1.16 H new ATOM 0 HE2 PHE A2009 -10.235 -1.551 -3.798 1.00 0.81 H new ATOM 0 HZ PHE A2009 -12.502 -2.437 -3.729 1.00 0.87 H new ATOM 1892 N ASP A2010 -10.334 -5.953 -8.497 1.00 0.74 N ATOM 1893 CA ASP A2010 -11.394 -6.889 -8.762 1.00 0.83 C ATOM 1894 C ASP A2010 -12.373 -6.821 -7.627 1.00 0.88 C ATOM 1895 O ASP A2010 -12.017 -7.100 -6.490 1.00 0.97 O ATOM 1896 CB ASP A2010 -10.850 -8.312 -8.912 1.00 0.97 C ATOM 1897 CG ASP A2010 -11.921 -9.305 -9.291 1.00 1.63 C ATOM 1898 OD1 ASP A2010 -12.626 -9.801 -8.410 1.00 2.43 O ATOM 1899 OD2 ASP A2010 -12.063 -9.605 -10.495 1.00 2.01 O ATOM 0 H ASP A2010 -9.671 -6.248 -7.780 1.00 0.74 H new ATOM 0 HA ASP A2010 -11.884 -6.629 -9.700 1.00 0.83 H new ATOM 0 HB2 ASP A2010 -10.067 -8.320 -9.671 1.00 0.97 H new ATOM 0 HB3 ASP A2010 -10.388 -8.621 -7.974 1.00 0.97 H new ATOM 1904 N GLU A2011 -13.578 -6.400 -7.914 1.00 1.03 N ATOM 1905 CA GLU A2011 -14.598 -6.277 -6.895 1.00 1.24 C ATOM 1906 C GLU A2011 -15.424 -7.552 -6.814 1.00 1.30 C ATOM 1907 O GLU A2011 -16.226 -7.726 -5.901 1.00 1.46 O ATOM 1908 CB GLU A2011 -15.500 -5.061 -7.140 1.00 1.52 C ATOM 1909 CG GLU A2011 -16.258 -5.091 -8.456 1.00 1.76 C ATOM 1910 CD GLU A2011 -17.214 -3.936 -8.590 1.00 2.09 C ATOM 1911 OE1 GLU A2011 -18.353 -4.010 -8.053 1.00 2.23 O ATOM 1912 OE2 GLU A2011 -16.846 -2.925 -9.213 1.00 2.75 O ATOM 0 H GLU A2011 -13.882 -6.134 -8.851 1.00 1.03 H new ATOM 0 HA GLU A2011 -14.096 -6.124 -5.940 1.00 1.24 H new ATOM 0 HB2 GLU A2011 -16.218 -4.988 -6.324 1.00 1.52 H new ATOM 0 HB3 GLU A2011 -14.888 -4.159 -7.108 1.00 1.52 H new ATOM 0 HG2 GLU A2011 -15.548 -5.070 -9.283 1.00 1.76 H new ATOM 0 HG3 GLU A2011 -16.810 -6.028 -8.534 1.00 1.76 H new ATOM 1919 N GLN A2012 -15.215 -8.442 -7.768 1.00 1.32 N ATOM 1920 CA GLN A2012 -15.933 -9.696 -7.809 1.00 1.52 C ATOM 1921 C GLN A2012 -15.491 -10.584 -6.657 1.00 1.49 C ATOM 1922 O GLN A2012 -16.313 -11.099 -5.921 1.00 1.71 O ATOM 1923 CB GLN A2012 -15.718 -10.405 -9.151 1.00 1.75 C ATOM 1924 CG GLN A2012 -16.396 -11.771 -9.277 1.00 2.10 C ATOM 1925 CD GLN A2012 -17.914 -11.717 -9.279 1.00 2.62 C ATOM 1926 OE1 GLN A2012 -18.542 -10.832 -8.694 1.00 3.40 O ATOM 1927 NE2 GLN A2012 -18.516 -12.672 -9.921 1.00 2.81 N ATOM 0 H GLN A2012 -14.548 -8.314 -8.529 1.00 1.32 H new ATOM 0 HA GLN A2012 -16.998 -9.490 -7.706 1.00 1.52 H new ATOM 0 HB2 GLN A2012 -16.085 -9.759 -9.949 1.00 1.75 H new ATOM 0 HB3 GLN A2012 -14.647 -10.532 -9.310 1.00 1.75 H new ATOM 0 HG2 GLN A2012 -16.060 -12.247 -10.198 1.00 2.10 H new ATOM 0 HG3 GLN A2012 -16.068 -12.404 -8.453 1.00 2.10 H new ATOM 0 HE21 GLN A2012 -17.970 -13.391 -10.396 1.00 2.81 H new ATOM 0 HE22 GLN A2012 -19.535 -12.703 -9.950 1.00 2.81 H new ATOM 1936 N THR A2013 -14.210 -10.767 -6.513 1.00 1.37 N ATOM 1937 CA THR A2013 -13.691 -11.542 -5.431 1.00 1.47 C ATOM 1938 C THR A2013 -13.011 -10.616 -4.408 1.00 1.37 C ATOM 1939 O THR A2013 -12.472 -11.061 -3.388 1.00 1.57 O ATOM 1940 CB THR A2013 -12.715 -12.651 -5.933 1.00 1.72 C ATOM 1941 OG1 THR A2013 -12.456 -13.590 -4.887 1.00 1.95 O ATOM 1942 CG2 THR A2013 -11.390 -12.061 -6.419 1.00 1.76 C ATOM 0 H THR A2013 -13.502 -10.384 -7.140 1.00 1.37 H new ATOM 0 HA THR A2013 -14.521 -12.053 -4.943 1.00 1.47 H new ATOM 0 HB THR A2013 -13.196 -13.152 -6.773 1.00 1.72 H new ATOM 0 HG1 THR A2013 -13.268 -13.718 -4.354 1.00 1.95 H new ATOM 0 HG21 THR A2013 -10.737 -12.865 -6.760 1.00 1.76 H new ATOM 0 HG22 THR A2013 -11.579 -11.372 -7.242 1.00 1.76 H new ATOM 0 HG23 THR A2013 -10.908 -11.525 -5.601 1.00 1.76 H new ATOM 1950 N CYS A2014 -13.046 -9.319 -4.698 1.00 1.20 N ATOM 1951 CA CYS A2014 -12.469 -8.309 -3.836 1.00 1.22 C ATOM 1952 C CYS A2014 -10.998 -8.555 -3.548 1.00 1.19 C ATOM 1953 O CYS A2014 -10.572 -8.736 -2.405 1.00 1.49 O ATOM 1954 CB CYS A2014 -13.290 -8.104 -2.579 1.00 1.49 C ATOM 1955 SG CYS A2014 -14.907 -7.338 -2.899 1.00 1.65 S ATOM 0 H CYS A2014 -13.478 -8.944 -5.542 1.00 1.20 H new ATOM 0 HA CYS A2014 -12.505 -7.369 -4.386 1.00 1.22 H new ATOM 0 HB2 CYS A2014 -13.441 -9.066 -2.090 1.00 1.49 H new ATOM 0 HB3 CYS A2014 -12.730 -7.478 -1.884 1.00 1.49 H new ATOM 1960 N THR A2015 -10.249 -8.602 -4.594 1.00 1.02 N ATOM 1961 CA THR A2015 -8.838 -8.767 -4.535 1.00 1.04 C ATOM 1962 C THR A2015 -8.241 -7.721 -5.447 1.00 0.96 C ATOM 1963 O THR A2015 -8.754 -7.474 -6.537 1.00 1.08 O ATOM 1964 CB THR A2015 -8.437 -10.204 -4.938 1.00 1.15 C ATOM 1965 OG1 THR A2015 -9.058 -11.125 -4.017 1.00 1.56 O ATOM 1966 CG2 THR A2015 -6.923 -10.402 -4.892 1.00 1.39 C ATOM 0 H THR A2015 -10.613 -8.524 -5.544 1.00 1.02 H new ATOM 0 HA THR A2015 -8.460 -8.631 -3.522 1.00 1.04 H new ATOM 0 HB THR A2015 -8.769 -10.382 -5.961 1.00 1.15 H new ATOM 0 HG1 THR A2015 -8.366 -11.645 -3.557 1.00 1.56 H new ATOM 0 HG21 THR A2015 -6.681 -11.424 -5.182 1.00 1.39 H new ATOM 0 HG22 THR A2015 -6.444 -9.706 -5.581 1.00 1.39 H new ATOM 0 HG23 THR A2015 -6.562 -10.217 -3.880 1.00 1.39 H new ATOM 1974 N SER A2016 -7.245 -7.043 -4.986 1.00 0.87 N ATOM 1975 CA SER A2016 -6.713 -5.947 -5.732 1.00 0.83 C ATOM 1976 C SER A2016 -5.212 -6.058 -5.879 1.00 0.71 C ATOM 1977 O SER A2016 -4.523 -6.551 -4.982 1.00 0.74 O ATOM 1978 CB SER A2016 -7.103 -4.662 -5.029 1.00 0.87 C ATOM 1979 OG SER A2016 -8.504 -4.648 -4.788 1.00 1.36 O ATOM 0 H SER A2016 -6.781 -7.226 -4.096 1.00 0.87 H new ATOM 0 HA SER A2016 -7.125 -5.955 -6.741 1.00 0.83 H new ATOM 0 HB2 SER A2016 -6.562 -4.574 -4.087 1.00 0.87 H new ATOM 0 HB3 SER A2016 -6.822 -3.804 -5.639 1.00 0.87 H new ATOM 0 HG SER A2016 -8.882 -3.802 -5.107 1.00 1.36 H new ATOM 1985 N TYR A2017 -4.720 -5.627 -7.008 1.00 0.64 N ATOM 1986 CA TYR A2017 -3.313 -5.655 -7.304 1.00 0.57 C ATOM 1987 C TYR A2017 -2.851 -4.250 -7.618 1.00 0.49 C ATOM 1988 O TYR A2017 -3.321 -3.623 -8.586 1.00 0.56 O ATOM 1989 CB TYR A2017 -3.024 -6.595 -8.492 1.00 0.71 C ATOM 1990 CG TYR A2017 -3.403 -8.046 -8.249 1.00 0.86 C ATOM 1991 CD1 TYR A2017 -4.700 -8.491 -8.467 1.00 1.01 C ATOM 1992 CD2 TYR A2017 -2.462 -8.968 -7.804 1.00 0.92 C ATOM 1993 CE1 TYR A2017 -5.048 -9.813 -8.249 1.00 1.18 C ATOM 1994 CE2 TYR A2017 -2.800 -10.285 -7.586 1.00 1.09 C ATOM 1995 CZ TYR A2017 -4.102 -10.701 -7.801 1.00 1.20 C ATOM 1996 OH TYR A2017 -4.428 -12.031 -7.590 1.00 1.38 O ATOM 0 H TYR A2017 -5.292 -5.241 -7.759 1.00 0.64 H new ATOM 0 HA TYR A2017 -2.769 -6.035 -6.439 1.00 0.57 H new ATOM 0 HB2 TYR A2017 -3.564 -6.232 -9.367 1.00 0.71 H new ATOM 0 HB3 TYR A2017 -1.961 -6.544 -8.730 1.00 0.71 H new ATOM 0 HD1 TYR A2017 -5.450 -7.794 -8.812 1.00 1.01 H new ATOM 0 HD2 TYR A2017 -1.447 -8.645 -7.626 1.00 0.92 H new ATOM 0 HE1 TYR A2017 -6.060 -10.144 -8.431 1.00 1.18 H new ATOM 0 HE2 TYR A2017 -2.053 -10.989 -7.249 1.00 1.09 H new ATOM 0 HH TYR A2017 -3.637 -12.516 -7.274 1.00 1.38 H new ATOM 2006 N PHE A2018 -2.003 -3.733 -6.782 1.00 0.39 N ATOM 2007 CA PHE A2018 -1.445 -2.417 -6.946 1.00 0.39 C ATOM 2008 C PHE A2018 0.057 -2.497 -6.785 1.00 0.36 C ATOM 2009 O PHE A2018 0.576 -3.428 -6.156 1.00 0.40 O ATOM 2010 CB PHE A2018 -2.007 -1.435 -5.904 1.00 0.47 C ATOM 2011 CG PHE A2018 -3.475 -1.114 -6.015 1.00 0.57 C ATOM 2012 CD1 PHE A2018 -4.429 -1.909 -5.405 1.00 0.74 C ATOM 2013 CD2 PHE A2018 -3.896 0.001 -6.712 1.00 0.74 C ATOM 2014 CE1 PHE A2018 -5.769 -1.596 -5.492 1.00 0.87 C ATOM 2015 CE2 PHE A2018 -5.240 0.316 -6.805 1.00 0.89 C ATOM 2016 CZ PHE A2018 -6.175 -0.485 -6.192 1.00 0.87 C ATOM 0 H PHE A2018 -1.670 -4.220 -5.950 1.00 0.39 H new ATOM 0 HA PHE A2018 -1.710 -2.053 -7.939 1.00 0.39 H new ATOM 0 HB2 PHE A2018 -1.820 -1.845 -4.911 1.00 0.47 H new ATOM 0 HB3 PHE A2018 -1.446 -0.503 -5.975 1.00 0.47 H new ATOM 0 HD1 PHE A2018 -4.120 -2.785 -4.854 1.00 0.74 H new ATOM 0 HD2 PHE A2018 -3.166 0.636 -7.191 1.00 0.74 H new ATOM 0 HE1 PHE A2018 -6.502 -2.226 -5.009 1.00 0.87 H new ATOM 0 HE2 PHE A2018 -5.554 1.189 -7.358 1.00 0.89 H new ATOM 0 HZ PHE A2018 -7.225 -0.242 -6.260 1.00 0.87 H new ATOM 2026 N SER A2019 0.740 -1.551 -7.341 1.00 0.45 N ATOM 2027 CA SER A2019 2.162 -1.468 -7.240 1.00 0.47 C ATOM 2028 C SER A2019 2.561 -0.020 -6.982 1.00 0.45 C ATOM 2029 O SER A2019 1.739 0.893 -7.124 1.00 0.49 O ATOM 2030 CB SER A2019 2.821 -2.019 -8.520 1.00 0.51 C ATOM 2031 OG SER A2019 2.541 -3.405 -8.680 1.00 1.24 O ATOM 0 H SER A2019 0.319 -0.800 -7.888 1.00 0.45 H new ATOM 0 HA SER A2019 2.511 -2.077 -6.406 1.00 0.47 H new ATOM 0 HB2 SER A2019 2.457 -1.468 -9.387 1.00 0.51 H new ATOM 0 HB3 SER A2019 3.899 -1.865 -8.474 1.00 0.51 H new ATOM 0 HG SER A2019 2.968 -3.732 -9.499 1.00 1.24 H new ATOM 2037 N TRP A2020 3.775 0.186 -6.574 1.00 0.52 N ATOM 2038 CA TRP A2020 4.288 1.501 -6.307 1.00 0.57 C ATOM 2039 C TRP A2020 5.784 1.487 -6.618 1.00 0.49 C ATOM 2040 O TRP A2020 6.517 0.662 -6.097 1.00 0.43 O ATOM 2041 CB TRP A2020 4.033 1.862 -4.818 1.00 0.69 C ATOM 2042 CG TRP A2020 4.378 3.283 -4.413 1.00 0.88 C ATOM 2043 CD1 TRP A2020 5.593 3.871 -4.457 1.00 0.81 C ATOM 2044 CD2 TRP A2020 3.496 4.268 -3.842 1.00 1.75 C ATOM 2045 NE1 TRP A2020 5.520 5.151 -3.989 1.00 1.00 N ATOM 2046 CE2 TRP A2020 4.258 5.422 -3.610 1.00 1.65 C ATOM 2047 CE3 TRP A2020 2.151 4.295 -3.521 1.00 2.75 C ATOM 2048 CZ2 TRP A2020 3.721 6.588 -3.072 1.00 2.41 C ATOM 2049 CZ3 TRP A2020 1.614 5.452 -2.984 1.00 3.55 C ATOM 2050 CH2 TRP A2020 2.397 6.582 -2.768 1.00 3.35 C ATOM 0 H TRP A2020 4.449 -0.562 -6.414 1.00 0.52 H new ATOM 0 HA TRP A2020 3.792 2.251 -6.924 1.00 0.57 H new ATOM 0 HB2 TRP A2020 2.980 1.687 -4.597 1.00 0.69 H new ATOM 0 HB3 TRP A2020 4.608 1.177 -4.194 1.00 0.69 H new ATOM 0 HD1 TRP A2020 6.495 3.395 -4.812 1.00 0.81 H new ATOM 0 HE1 TRP A2020 6.303 5.803 -3.935 1.00 1.00 H new ATOM 0 HE3 TRP A2020 1.530 3.427 -3.687 1.00 2.75 H new ATOM 0 HZ2 TRP A2020 4.332 7.462 -2.903 1.00 2.41 H new ATOM 0 HZ3 TRP A2020 0.565 5.478 -2.727 1.00 3.55 H new ATOM 0 HH2 TRP A2020 1.944 7.470 -2.351 1.00 3.35 H new ATOM 2061 N HIS A2021 6.218 2.358 -7.486 1.00 0.61 N ATOM 2062 CA HIS A2021 7.626 2.469 -7.818 1.00 0.66 C ATOM 2063 C HIS A2021 8.211 3.546 -6.950 1.00 0.64 C ATOM 2064 O HIS A2021 7.838 4.715 -7.086 1.00 0.81 O ATOM 2065 CB HIS A2021 7.850 2.834 -9.306 1.00 0.86 C ATOM 2066 CG HIS A2021 7.365 1.812 -10.299 1.00 0.93 C ATOM 2067 ND1 HIS A2021 8.174 0.856 -10.877 1.00 1.53 N ATOM 2068 CD2 HIS A2021 6.136 1.612 -10.825 1.00 1.33 C ATOM 2069 CE1 HIS A2021 7.459 0.126 -11.705 1.00 1.61 C ATOM 2070 NE2 HIS A2021 6.225 0.563 -11.690 1.00 1.43 N ATOM 0 H HIS A2021 5.615 3.012 -7.986 1.00 0.61 H new ATOM 0 HA HIS A2021 8.106 1.505 -7.648 1.00 0.66 H new ATOM 0 HB2 HIS A2021 7.350 3.781 -9.510 1.00 0.86 H new ATOM 0 HB3 HIS A2021 8.916 2.996 -9.467 1.00 0.86 H new ATOM 0 HD2 HIS A2021 5.245 2.180 -10.600 1.00 1.33 H new ATOM 0 HE1 HIS A2021 7.828 -0.697 -12.299 1.00 1.61 H new ATOM 0 HE2 HIS A2021 5.454 0.180 -12.238 1.00 1.43 H new ATOM 2079 N THR A2022 9.077 3.175 -6.041 1.00 0.51 N ATOM 2080 CA THR A2022 9.661 4.135 -5.141 1.00 0.50 C ATOM 2081 C THR A2022 11.104 3.796 -4.832 1.00 0.48 C ATOM 2082 O THR A2022 11.520 2.632 -4.920 1.00 0.50 O ATOM 2083 CB THR A2022 8.837 4.318 -3.820 1.00 0.53 C ATOM 2084 OG1 THR A2022 9.416 5.345 -2.995 1.00 0.63 O ATOM 2085 CG2 THR A2022 8.731 3.030 -3.022 1.00 0.56 C ATOM 0 H THR A2022 9.393 2.215 -5.905 1.00 0.51 H new ATOM 0 HA THR A2022 9.634 5.092 -5.662 1.00 0.50 H new ATOM 0 HB THR A2022 7.831 4.612 -4.120 1.00 0.53 H new ATOM 0 HG1 THR A2022 9.390 6.201 -3.472 1.00 0.63 H new ATOM 0 HG21 THR A2022 8.151 3.210 -2.117 1.00 0.56 H new ATOM 0 HG22 THR A2022 8.236 2.268 -3.625 1.00 0.56 H new ATOM 0 HG23 THR A2022 9.729 2.687 -2.751 1.00 0.56 H new ATOM 2093 N SER A2023 11.863 4.817 -4.530 1.00 0.55 N ATOM 2094 CA SER A2023 13.253 4.708 -4.183 1.00 0.60 C ATOM 2095 C SER A2023 13.430 4.025 -2.819 1.00 0.59 C ATOM 2096 O SER A2023 14.472 3.462 -2.545 1.00 0.75 O ATOM 2097 CB SER A2023 13.823 6.108 -4.119 1.00 0.85 C ATOM 2098 OG SER A2023 13.440 6.844 -5.271 1.00 1.21 O ATOM 0 H SER A2023 11.518 5.777 -4.519 1.00 0.55 H new ATOM 0 HA SER A2023 13.769 4.105 -4.930 1.00 0.60 H new ATOM 0 HB2 SER A2023 13.468 6.613 -3.221 1.00 0.85 H new ATOM 0 HB3 SER A2023 14.910 6.064 -4.051 1.00 0.85 H new ATOM 0 HG SER A2023 12.761 7.507 -5.025 1.00 1.21 H new ATOM 2104 N LEU A2024 12.394 4.074 -1.980 1.00 0.61 N ATOM 2105 CA LEU A2024 12.469 3.502 -0.628 1.00 0.74 C ATOM 2106 C LEU A2024 12.038 2.046 -0.597 1.00 0.76 C ATOM 2107 O LEU A2024 12.145 1.388 0.429 1.00 0.93 O ATOM 2108 CB LEU A2024 11.622 4.290 0.386 1.00 0.91 C ATOM 2109 CG LEU A2024 12.096 5.690 0.814 1.00 0.78 C ATOM 2110 CD1 LEU A2024 12.001 6.714 -0.310 1.00 1.53 C ATOM 2111 CD2 LEU A2024 11.301 6.134 2.006 1.00 1.11 C ATOM 0 H LEU A2024 11.496 4.501 -2.208 1.00 0.61 H new ATOM 0 HA LEU A2024 13.519 3.570 -0.343 1.00 0.74 H new ATOM 0 HB2 LEU A2024 10.620 4.393 -0.030 1.00 0.91 H new ATOM 0 HB3 LEU A2024 11.533 3.682 1.286 1.00 0.91 H new ATOM 0 HG LEU A2024 13.152 5.622 1.074 1.00 0.78 H new ATOM 0 HD11 LEU A2024 12.348 7.682 0.050 1.00 1.53 H new ATOM 0 HD12 LEU A2024 12.621 6.394 -1.147 1.00 1.53 H new ATOM 0 HD13 LEU A2024 10.965 6.799 -0.638 1.00 1.53 H new ATOM 0 HD21 LEU A2024 11.632 7.126 2.315 1.00 1.11 H new ATOM 0 HD22 LEU A2024 10.243 6.169 1.745 1.00 1.11 H new ATOM 0 HD23 LEU A2024 11.450 5.430 2.825 1.00 1.11 H new ATOM 2123 N ALA A2025 11.555 1.555 -1.725 1.00 0.66 N ATOM 2124 CA ALA A2025 11.060 0.180 -1.832 1.00 0.72 C ATOM 2125 C ALA A2025 12.187 -0.803 -1.673 1.00 0.85 C ATOM 2126 O ALA A2025 12.020 -1.881 -1.145 1.00 1.20 O ATOM 2127 CB ALA A2025 10.398 -0.016 -3.167 1.00 0.64 C ATOM 0 H ALA A2025 11.492 2.089 -2.592 1.00 0.66 H new ATOM 0 HA ALA A2025 10.335 0.007 -1.037 1.00 0.72 H new ATOM 0 HB1 ALA A2025 10.031 -1.039 -3.244 1.00 0.64 H new ATOM 0 HB2 ALA A2025 9.563 0.678 -3.264 1.00 0.64 H new ATOM 0 HB3 ALA A2025 11.120 0.171 -3.962 1.00 0.64 H new ATOM 2133 N CYS A2026 13.322 -0.398 -2.120 1.00 0.90 N ATOM 2134 CA CYS A2026 14.506 -1.172 -2.052 1.00 1.05 C ATOM 2135 C CYS A2026 15.600 -0.209 -1.662 1.00 1.23 C ATOM 2136 O CYS A2026 15.293 0.962 -1.391 1.00 1.55 O ATOM 2137 CB CYS A2026 14.783 -1.850 -3.396 1.00 1.61 C ATOM 2138 SG CYS A2026 13.413 -2.921 -3.986 1.00 2.15 S ATOM 0 H CYS A2026 13.455 0.514 -2.558 1.00 0.90 H new ATOM 0 HA CYS A2026 14.430 -1.980 -1.325 1.00 1.05 H new ATOM 0 HB2 CYS A2026 14.980 -1.083 -4.145 1.00 1.61 H new ATOM 0 HB3 CYS A2026 15.689 -2.450 -3.309 1.00 1.61 H new ATOM 2143 N GLU A2027 16.835 -0.625 -1.594 1.00 1.51 N ATOM 2144 CA GLU A2027 17.845 0.337 -1.209 1.00 2.04 C ATOM 2145 C GLU A2027 18.344 1.068 -2.421 1.00 2.41 C ATOM 2146 O GLU A2027 18.254 2.299 -2.483 1.00 2.90 O ATOM 2147 CB GLU A2027 18.954 -0.255 -0.345 1.00 2.28 C ATOM 2148 CG GLU A2027 18.438 -0.706 1.008 1.00 2.97 C ATOM 2149 CD GLU A2027 19.515 -0.836 2.047 1.00 3.42 C ATOM 2150 OE1 GLU A2027 19.886 0.156 2.683 1.00 3.85 O ATOM 2151 OE2 GLU A2027 20.024 -1.956 2.245 1.00 3.72 O ATOM 0 H GLU A2027 17.161 -1.572 -1.788 1.00 1.51 H new ATOM 0 HA GLU A2027 17.377 1.070 -0.552 1.00 2.04 H new ATOM 0 HB2 GLU A2027 19.404 -1.102 -0.863 1.00 2.28 H new ATOM 0 HB3 GLU A2027 19.740 0.487 -0.205 1.00 2.28 H new ATOM 0 HG2 GLU A2027 17.690 0.005 1.358 1.00 2.97 H new ATOM 0 HG3 GLU A2027 17.936 -1.667 0.895 1.00 2.97 H new ATOM 2158 N GLU A2028 18.833 0.302 -3.368 1.00 2.55 N ATOM 2159 CA GLU A2028 19.200 0.733 -4.705 1.00 3.01 C ATOM 2160 C GLU A2028 20.005 -0.371 -5.302 1.00 3.22 C ATOM 2161 O GLU A2028 21.232 -0.428 -5.162 1.00 3.86 O ATOM 2162 CB GLU A2028 19.978 2.062 -4.800 1.00 3.98 C ATOM 2163 CG GLU A2028 19.923 2.654 -6.205 1.00 4.60 C ATOM 2164 CD GLU A2028 20.646 3.965 -6.345 1.00 5.42 C ATOM 2165 OE1 GLU A2028 20.371 4.892 -5.548 1.00 5.90 O ATOM 2166 OE2 GLU A2028 21.485 4.112 -7.267 1.00 5.87 O ATOM 0 H GLU A2028 18.996 -0.694 -3.222 1.00 2.55 H new ATOM 0 HA GLU A2028 18.274 0.939 -5.242 1.00 3.01 H new ATOM 0 HB2 GLU A2028 19.564 2.777 -4.088 1.00 3.98 H new ATOM 0 HB3 GLU A2028 21.017 1.895 -4.517 1.00 3.98 H new ATOM 0 HG2 GLU A2028 20.351 1.938 -6.907 1.00 4.60 H new ATOM 0 HG3 GLU A2028 18.880 2.794 -6.489 1.00 4.60 H new ATOM 2173 N GLU A2029 19.322 -1.292 -5.886 1.00 3.21 N ATOM 2174 CA GLU A2029 19.939 -2.419 -6.462 1.00 3.93 C ATOM 2175 C GLU A2029 20.097 -2.107 -7.907 1.00 4.11 C ATOM 2176 O GLU A2029 19.133 -2.175 -8.672 1.00 3.96 O ATOM 2177 CB GLU A2029 19.128 -3.708 -6.215 1.00 4.45 C ATOM 2178 CG GLU A2029 19.139 -4.224 -4.754 1.00 5.45 C ATOM 2179 CD GLU A2029 18.471 -3.310 -3.724 1.00 6.38 C ATOM 2180 OE1 GLU A2029 19.147 -2.426 -3.147 1.00 6.91 O ATOM 2181 OE2 GLU A2029 17.302 -3.487 -3.440 1.00 6.80 O ATOM 0 H GLU A2029 18.306 -1.277 -5.975 1.00 3.21 H new ATOM 0 HA GLU A2029 20.909 -2.617 -6.006 1.00 3.93 H new ATOM 0 HB2 GLU A2029 18.095 -3.531 -6.513 1.00 4.45 H new ATOM 0 HB3 GLU A2029 19.517 -4.493 -6.864 1.00 4.45 H new ATOM 0 HG2 GLU A2029 18.644 -5.195 -4.727 1.00 5.45 H new ATOM 0 HG3 GLU A2029 20.174 -4.386 -4.453 1.00 5.45 H new ATOM 2188 N VAL A2030 21.281 -1.656 -8.240 1.00 4.83 N ATOM 2189 CA VAL A2030 21.605 -1.144 -9.548 1.00 5.43 C ATOM 2190 C VAL A2030 21.563 -2.251 -10.601 1.00 6.11 C ATOM 2191 O VAL A2030 22.403 -3.163 -10.594 1.00 6.82 O ATOM 2192 CB VAL A2030 23.003 -0.458 -9.538 1.00 6.26 C ATOM 2193 CG1 VAL A2030 23.300 0.201 -10.869 1.00 7.15 C ATOM 2194 CG2 VAL A2030 23.102 0.562 -8.406 1.00 6.37 C ATOM 0 H VAL A2030 22.067 -1.634 -7.591 1.00 4.83 H new ATOM 0 HA VAL A2030 20.853 -0.400 -9.810 1.00 5.43 H new ATOM 0 HB VAL A2030 23.749 -1.234 -9.369 1.00 6.26 H new ATOM 0 HG11 VAL A2030 24.283 0.671 -10.831 1.00 7.15 H new ATOM 0 HG12 VAL A2030 23.288 -0.551 -11.658 1.00 7.15 H new ATOM 0 HG13 VAL A2030 22.544 0.958 -11.077 1.00 7.15 H new ATOM 0 HG21 VAL A2030 24.088 1.027 -8.421 1.00 6.37 H new ATOM 0 HG22 VAL A2030 22.337 1.328 -8.538 1.00 6.37 H new ATOM 0 HG23 VAL A2030 22.952 0.060 -7.450 1.00 6.37 H new ATOM 2204 N PRO A2031 20.552 -2.206 -11.496 1.00 6.17 N ATOM 2205 CA PRO A2031 20.399 -3.186 -12.577 1.00 7.02 C ATOM 2206 C PRO A2031 21.588 -3.168 -13.529 1.00 7.96 C ATOM 2207 O PRO A2031 22.074 -4.212 -13.956 1.00 8.70 O ATOM 2208 CB PRO A2031 19.142 -2.721 -13.328 1.00 6.96 C ATOM 2209 CG PRO A2031 18.419 -1.819 -12.389 1.00 6.35 C ATOM 2210 CD PRO A2031 19.453 -1.216 -11.488 1.00 5.74 C ATOM 0 HA PRO A2031 20.330 -4.202 -12.187 1.00 7.02 H new ATOM 0 HB2 PRO A2031 19.407 -2.198 -14.247 1.00 6.96 H new ATOM 0 HB3 PRO A2031 18.520 -3.570 -13.612 1.00 6.96 H new ATOM 0 HG2 PRO A2031 17.881 -1.043 -12.934 1.00 6.35 H new ATOM 0 HG3 PRO A2031 17.679 -2.374 -11.812 1.00 6.35 H new ATOM 0 HD2 PRO A2031 19.787 -0.246 -11.856 1.00 5.74 H new ATOM 0 HD3 PRO A2031 19.064 -1.059 -10.482 1.00 5.74 H new ATOM 2218 N ARG A2032 22.056 -1.980 -13.839 1.00 8.09 N ATOM 2219 CA ARG A2032 23.147 -1.802 -14.758 1.00 9.10 C ATOM 2220 C ARG A2032 24.245 -1.046 -14.055 1.00 9.66 C ATOM 2221 O ARG A2032 24.266 0.194 -14.134 1.00 10.08 O ATOM 2222 CB ARG A2032 22.673 -1.009 -15.977 1.00 9.37 C ATOM 2223 CG ARG A2032 21.554 -1.663 -16.762 1.00 9.14 C ATOM 2224 CD ARG A2032 20.952 -0.684 -17.746 1.00 9.28 C ATOM 2225 NE ARG A2032 20.336 0.458 -17.046 1.00 9.46 N ATOM 2226 CZ ARG A2032 20.294 1.711 -17.499 1.00 9.76 C ATOM 2227 NH1 ARG A2032 20.803 2.012 -18.686 1.00 9.89 N ATOM 2228 NH2 ARG A2032 19.742 2.656 -16.746 1.00 10.17 N ATOM 0 H ARG A2032 21.686 -1.110 -13.457 1.00 8.09 H new ATOM 0 HA ARG A2032 23.515 -2.772 -15.092 1.00 9.10 H new ATOM 0 HB2 ARG A2032 22.340 -0.025 -15.646 1.00 9.37 H new ATOM 0 HB3 ARG A2032 23.521 -0.851 -16.643 1.00 9.37 H new ATOM 0 HG2 ARG A2032 21.937 -2.534 -17.295 1.00 9.14 H new ATOM 0 HG3 ARG A2032 20.784 -2.020 -16.079 1.00 9.14 H new ATOM 0 HD2 ARG A2032 21.725 -0.325 -18.426 1.00 9.28 H new ATOM 0 HD3 ARG A2032 20.202 -1.189 -18.355 1.00 9.28 H new ATOM 0 HE ARG A2032 19.906 0.274 -16.140 1.00 9.46 H new ATOM 0 HH11 ARG A2032 21.230 1.283 -19.258 1.00 9.89 H new ATOM 0 HH12 ARG A2032 20.768 2.973 -19.027 1.00 9.89 H new ATOM 0 HH21 ARG A2032 19.356 2.419 -15.832 1.00 10.17 H new ATOM 0 HH22 ARG A2032 19.704 3.618 -17.082 1.00 10.17 H new TER 2242 ARG A2032