USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1026 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 180:sc= -0.481 USER MOD Set 1.2: A2022 THR OG1 : rot 144:sc= 0.2 USER MOD Set 2.1: A1984 MET CE :methyl -142:sc= -0.151 (180deg=-2.06!) USER MOD Set 2.2: A2013 THR OG1 : rot -30:sc= 0.352 USER MOD Set 2.3: A2015 THR OG1 : rot 48:sc= 0.118 USER MOD Set 3.1: A1897 ASN : amide:sc= -0.516 K(o=1.8,f=-7.4!) USER MOD Set 3.2: A1900 THR OG1 : rot -58:sc= 1.23 USER MOD Set 3.3: A1966 GLN : amide:sc= 1.07 X(o=1.8,f=1.8) USER MOD Set 4.1: A1891 ASN : amide:sc= 0.864 K(o=2.3,f=-3.2) USER MOD Set 4.2: A1959 LYS NZ :NH3+ 171:sc= 1.45 (180deg=0.609) USER MOD Set 5.1: A1888 ASN : amide:sc= -0.196 K(o=0.22,f=-0.6) USER MOD Set 5.2: A1890 GLN : amide:sc= 0.417 K(o=0.22,f=-1.9) USER MOD Single : A1887 SER OG : rot 180:sc= 0 USER MOD Single : A1896 THR OG1 : rot 180:sc= -0.717 USER MOD Single : A1902 HIS : no HD1:sc= -0.0284 X(o=-0.028,f=-0.01) USER MOD Single : A1907 THR OG1 : rot -93:sc= 1.12 USER MOD Single : A1908 SER OG : rot 180:sc= -0.116 USER MOD Single : A1910 LYS NZ :NH3+ -168:sc= 0.901 (180deg=0.709) USER MOD Single : A1913 SER OG : rot -87:sc= 1.39 USER MOD Single : A1915 TYR OH : rot -117:sc= 1.25 USER MOD Single : A1916 THR OG1 : rot 180:sc= 0 USER MOD Single : A1918 THR OG1 : rot 180:sc= 0 USER MOD Single : A1920 SER OG : rot 180:sc= -0.0391 USER MOD Single : A1921 HIS : no HD1:sc= -0.114 X(o=-0.11,f=-0.11) USER MOD Single : A1922 ASN : amide:sc= -0.545 K(o=-0.55,f=0) USER MOD Single : A1924 LYS NZ :NH3+ -170:sc= -0.0271 (180deg=-0.207) USER MOD Single : A1928 ASN : amide:sc= -0.35! C(o=-0.35!,f=-4!) USER MOD Single : A1934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1935 SER OG : rot -120:sc=-0.00591 USER MOD Single : A1936 SER OG : rot 96:sc= 1.3 USER MOD Single : A1939 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1946 THR OG1 : rot 62:sc= 0.288 USER MOD Single : A1950 LYS NZ :NH3+ -164:sc= 0.691 (180deg=0.349) USER MOD Single : A1951 THR OG1 : rot 180:sc= 0.00213 USER MOD Single : A1953 ASN : amide:sc= -0.537 X(o=-0.54,f=-1) USER MOD Single : A1956 LYS NZ :NH3+ -142:sc= 1.28 (180deg=1.11) USER MOD Single : A1958 SER OG : rot 180:sc=-0.00818 USER MOD Single : A1960 THR OG1 : rot 180:sc= 0 USER MOD Single : A1962 THR OG1 : rot 180:sc= -0.0082 USER MOD Single : A1963 TYR OH : rot 180:sc= -0.015 USER MOD Single : A1969 LYS NZ :NH3+ -152:sc= 1.35 (180deg=1.11) USER MOD Single : A1972 TYR OH : rot 60:sc= 0.753 USER MOD Single : A1980 THR OG1 : rot 88:sc= -0.25 USER MOD Single : A1983 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1985 LYS NZ :NH3+ -163:sc= -0.0609 (180deg=-0.399) USER MOD Single : A1986 HIS : no HE2:sc= 0.627 K(o=0.63,f=-4.7!) USER MOD Single : A1987 LYS NZ :NH3+ 167:sc= 1.14 (180deg=1.11) USER MOD Single : A1988 SER OG : rot -59:sc= 0.165 USER MOD Single : A1989 TYR OH : rot 180:sc= 0 USER MOD Single : A1991 SER OG : rot 180:sc= 0 USER MOD Single : A1995 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1996 SER OG : rot 180:sc= 0 USER MOD Single : A2003 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2008 SER OG : rot 180:sc= 0 USER MOD Single : A2012 GLN : amide:sc= -4.68! K(o=-4.7!,f=-0.68) USER MOD Single : A2016 SER OG : rot -83:sc= 1.09 USER MOD Single : A2017 TYR OH : rot 180:sc= 0 USER MOD Single : A2019 SER OG : rot 180:sc= 0 USER MOD Single : A2021 HIS : no HD1:sc= -0.0152 X(o=-0.015,f=-0.013) USER MOD Single : A2023 SER OG : rot 117:sc= 1.11 USER MOD ----------------------------------------------------------------- ATOM 42 N SER A1887 12.157 8.887 6.018 1.00 1.11 N ATOM 43 CA SER A1887 11.549 10.133 6.476 1.00 1.23 C ATOM 44 C SER A1887 10.845 9.996 7.842 1.00 1.05 C ATOM 45 O SER A1887 11.411 10.354 8.882 1.00 1.33 O ATOM 46 CB SER A1887 10.584 10.694 5.400 1.00 1.99 C ATOM 47 OG SER A1887 9.955 11.911 5.800 1.00 2.83 O ATOM 0 HA SER A1887 12.361 10.844 6.626 1.00 1.23 H new ATOM 0 HB2 SER A1887 11.137 10.863 4.476 1.00 1.99 H new ATOM 0 HB3 SER A1887 9.818 9.949 5.182 1.00 1.99 H new ATOM 0 HG SER A1887 9.360 12.222 5.086 1.00 2.83 H new ATOM 53 N ASN A1888 9.647 9.455 7.852 1.00 0.86 N ATOM 54 CA ASN A1888 8.834 9.423 9.061 1.00 0.91 C ATOM 55 C ASN A1888 8.776 8.057 9.660 1.00 0.87 C ATOM 56 O ASN A1888 8.294 7.125 9.051 1.00 1.23 O ATOM 57 CB ASN A1888 7.430 9.904 8.762 1.00 1.19 C ATOM 58 CG ASN A1888 6.538 9.922 9.981 1.00 1.37 C ATOM 59 OD1 ASN A1888 6.985 10.159 11.112 1.00 1.91 O ATOM 60 ND2 ASN A1888 5.287 9.650 9.769 1.00 1.53 N ATOM 0 H ASN A1888 9.207 9.028 7.037 1.00 0.86 H new ATOM 0 HA ASN A1888 9.306 10.088 9.784 1.00 0.91 H new ATOM 0 HB2 ASN A1888 7.478 10.908 8.340 1.00 1.19 H new ATOM 0 HB3 ASN A1888 6.985 9.260 8.003 1.00 1.19 H new ATOM 0 HD21 ASN A1888 4.631 9.626 10.550 1.00 1.53 H new ATOM 0 HD22 ASN A1888 4.960 9.461 8.822 1.00 1.53 H new ATOM 67 N VAL A1889 9.252 7.952 10.855 1.00 0.91 N ATOM 68 CA VAL A1889 9.239 6.709 11.575 1.00 1.02 C ATOM 69 C VAL A1889 8.014 6.621 12.483 1.00 1.13 C ATOM 70 O VAL A1889 7.935 7.262 13.524 1.00 1.41 O ATOM 71 CB VAL A1889 10.564 6.445 12.362 1.00 1.34 C ATOM 72 CG1 VAL A1889 11.687 6.129 11.393 1.00 1.98 C ATOM 73 CG2 VAL A1889 10.961 7.648 13.212 1.00 2.12 C ATOM 0 H VAL A1889 9.666 8.729 11.370 1.00 0.91 H new ATOM 0 HA VAL A1889 9.171 5.914 10.832 1.00 1.02 H new ATOM 0 HB VAL A1889 10.390 5.597 13.024 1.00 1.34 H new ATOM 0 HG11 VAL A1889 12.607 5.946 11.949 1.00 1.98 H new ATOM 0 HG12 VAL A1889 11.430 5.241 10.815 1.00 1.98 H new ATOM 0 HG13 VAL A1889 11.833 6.972 10.718 1.00 1.98 H new ATOM 0 HG21 VAL A1889 11.886 7.428 13.744 1.00 2.12 H new ATOM 0 HG22 VAL A1889 11.110 8.515 12.568 1.00 2.12 H new ATOM 0 HG23 VAL A1889 10.171 7.862 13.931 1.00 2.12 H new ATOM 83 N GLN A1890 7.030 5.885 12.031 1.00 1.17 N ATOM 84 CA GLN A1890 5.814 5.679 12.802 1.00 1.48 C ATOM 85 C GLN A1890 6.054 4.712 13.937 1.00 1.69 C ATOM 86 O GLN A1890 6.167 5.112 15.093 1.00 2.49 O ATOM 87 CB GLN A1890 4.672 5.182 11.907 1.00 1.71 C ATOM 88 CG GLN A1890 4.219 6.205 10.898 1.00 1.52 C ATOM 89 CD GLN A1890 3.577 7.420 11.562 1.00 2.03 C ATOM 90 OE1 GLN A1890 4.247 8.372 11.932 1.00 2.63 O ATOM 91 NE2 GLN A1890 2.287 7.412 11.696 1.00 2.40 N ATOM 0 H GLN A1890 7.041 5.412 11.127 1.00 1.17 H new ATOM 0 HA GLN A1890 5.522 6.640 13.225 1.00 1.48 H new ATOM 0 HB2 GLN A1890 4.995 4.283 11.383 1.00 1.71 H new ATOM 0 HB3 GLN A1890 3.826 4.899 12.533 1.00 1.71 H new ATOM 0 HG2 GLN A1890 5.072 6.527 10.301 1.00 1.52 H new ATOM 0 HG3 GLN A1890 3.505 5.747 10.213 1.00 1.52 H new ATOM 0 HE21 GLN A1890 1.746 6.607 11.380 1.00 2.40 H new ATOM 0 HE22 GLN A1890 1.813 8.211 12.117 1.00 2.40 H new ATOM 100 N ASN A1891 6.166 3.442 13.601 1.00 1.59 N ATOM 101 CA ASN A1891 6.363 2.406 14.598 1.00 1.88 C ATOM 102 C ASN A1891 7.282 1.370 14.028 1.00 1.48 C ATOM 103 O ASN A1891 8.399 1.196 14.495 1.00 1.86 O ATOM 104 CB ASN A1891 5.035 1.727 14.998 1.00 2.50 C ATOM 105 CG ASN A1891 3.948 2.692 15.429 1.00 3.17 C ATOM 106 OD1 ASN A1891 3.149 3.134 14.611 1.00 3.82 O ATOM 107 ND2 ASN A1891 3.913 3.034 16.679 1.00 3.53 N ATOM 0 H ASN A1891 6.124 3.101 12.641 1.00 1.59 H new ATOM 0 HA ASN A1891 6.785 2.867 15.491 1.00 1.88 H new ATOM 0 HB2 ASN A1891 4.671 1.141 14.154 1.00 2.50 H new ATOM 0 HB3 ASN A1891 5.228 1.028 15.812 1.00 2.50 H new ATOM 0 HD21 ASN A1891 3.205 3.690 17.009 1.00 3.53 H new ATOM 0 HD22 ASN A1891 4.593 2.647 17.333 1.00 3.53 H new ATOM 114 N ASP A1892 6.818 0.700 12.978 1.00 1.00 N ATOM 115 CA ASP A1892 7.623 -0.327 12.326 1.00 1.01 C ATOM 116 C ASP A1892 7.331 -0.381 10.830 1.00 1.00 C ATOM 117 O ASP A1892 7.594 0.600 10.150 1.00 1.59 O ATOM 118 CB ASP A1892 7.512 -1.720 13.013 1.00 1.40 C ATOM 119 CG ASP A1892 8.447 -2.788 12.422 1.00 2.05 C ATOM 120 OD1 ASP A1892 9.689 -2.709 12.645 1.00 2.61 O ATOM 121 OD2 ASP A1892 7.962 -3.700 11.718 1.00 2.66 O ATOM 0 H ASP A1892 5.898 0.847 12.563 1.00 1.00 H new ATOM 0 HA ASP A1892 8.667 -0.037 12.445 1.00 1.01 H new ATOM 0 HB2 ASP A1892 7.731 -1.608 14.075 1.00 1.40 H new ATOM 0 HB3 ASP A1892 6.483 -2.070 12.935 1.00 1.40 H new ATOM 126 N CYS A1893 6.675 -1.455 10.353 1.00 0.74 N ATOM 127 CA CYS A1893 6.448 -1.709 8.921 1.00 0.87 C ATOM 128 C CYS A1893 7.711 -1.428 8.115 1.00 0.75 C ATOM 129 O CYS A1893 7.864 -0.364 7.456 1.00 0.80 O ATOM 130 CB CYS A1893 5.238 -0.974 8.352 1.00 1.17 C ATOM 131 SG CYS A1893 4.831 -1.424 6.618 1.00 1.58 S ATOM 0 H CYS A1893 6.284 -2.177 10.958 1.00 0.74 H new ATOM 0 HA CYS A1893 6.208 -2.769 8.831 1.00 0.87 H new ATOM 0 HB2 CYS A1893 4.373 -1.180 8.982 1.00 1.17 H new ATOM 0 HB3 CYS A1893 5.421 0.099 8.404 1.00 1.17 H new ATOM 136 N ARG A1894 8.643 -2.321 8.273 1.00 0.73 N ATOM 137 CA ARG A1894 9.926 -2.265 7.650 1.00 0.73 C ATOM 138 C ARG A1894 10.483 -3.662 7.713 1.00 0.72 C ATOM 139 O ARG A1894 10.228 -4.377 8.692 1.00 0.92 O ATOM 140 CB ARG A1894 10.819 -1.235 8.372 1.00 0.85 C ATOM 141 CG ARG A1894 11.036 -1.506 9.846 1.00 1.21 C ATOM 142 CD ARG A1894 11.559 -0.284 10.572 1.00 1.35 C ATOM 143 NE ARG A1894 12.799 0.248 10.003 1.00 1.45 N ATOM 144 CZ ARG A1894 13.925 0.455 10.702 1.00 1.80 C ATOM 145 NH1 ARG A1894 14.030 0.008 11.956 1.00 2.09 N ATOM 146 NH2 ARG A1894 14.949 1.087 10.133 1.00 2.57 N ATOM 0 H ARG A1894 8.521 -3.142 8.866 1.00 0.73 H new ATOM 0 HA ARG A1894 9.871 -1.936 6.612 1.00 0.73 H new ATOM 0 HB2 ARG A1894 11.789 -1.205 7.876 1.00 0.85 H new ATOM 0 HB3 ARG A1894 10.373 -0.247 8.260 1.00 0.85 H new ATOM 0 HG2 ARG A1894 10.097 -1.824 10.299 1.00 1.21 H new ATOM 0 HG3 ARG A1894 11.741 -2.329 9.964 1.00 1.21 H new ATOM 0 HD2 ARG A1894 10.796 0.495 10.552 1.00 1.35 H new ATOM 0 HD3 ARG A1894 11.728 -0.538 11.618 1.00 1.35 H new ATOM 0 HE ARG A1894 12.807 0.476 9.009 1.00 1.45 H new ATOM 0 HH11 ARG A1894 13.252 -0.493 12.386 1.00 2.09 H new ATOM 0 HH12 ARG A1894 14.888 0.167 12.484 1.00 2.09 H new ATOM 0 HH21 ARG A1894 14.876 1.412 9.169 1.00 2.57 H new ATOM 0 HH22 ARG A1894 15.807 1.246 10.661 1.00 2.57 H new ATOM 160 N VAL A1895 11.175 -4.083 6.699 1.00 0.58 N ATOM 161 CA VAL A1895 11.637 -5.444 6.656 1.00 0.60 C ATOM 162 C VAL A1895 13.082 -5.527 6.193 1.00 0.52 C ATOM 163 O VAL A1895 13.489 -4.864 5.241 1.00 0.47 O ATOM 164 CB VAL A1895 10.702 -6.342 5.779 1.00 0.63 C ATOM 165 CG1 VAL A1895 10.680 -5.915 4.323 1.00 0.57 C ATOM 166 CG2 VAL A1895 11.049 -7.812 5.914 1.00 0.72 C ATOM 0 H VAL A1895 11.433 -3.512 5.894 1.00 0.58 H new ATOM 0 HA VAL A1895 11.598 -5.832 7.674 1.00 0.60 H new ATOM 0 HB VAL A1895 9.692 -6.200 6.165 1.00 0.63 H new ATOM 0 HG11 VAL A1895 10.016 -6.572 3.761 1.00 0.57 H new ATOM 0 HG12 VAL A1895 10.321 -4.888 4.250 1.00 0.57 H new ATOM 0 HG13 VAL A1895 11.687 -5.978 3.910 1.00 0.57 H new ATOM 0 HG21 VAL A1895 10.378 -8.403 5.290 1.00 0.72 H new ATOM 0 HG22 VAL A1895 12.078 -7.974 5.594 1.00 0.72 H new ATOM 0 HG23 VAL A1895 10.940 -8.117 6.955 1.00 0.72 H new ATOM 176 N THR A1896 13.850 -6.300 6.881 1.00 0.63 N ATOM 177 CA THR A1896 15.221 -6.488 6.535 1.00 0.69 C ATOM 178 C THR A1896 15.353 -7.742 5.676 1.00 0.69 C ATOM 179 O THR A1896 15.140 -8.859 6.165 1.00 0.76 O ATOM 180 CB THR A1896 16.076 -6.631 7.805 1.00 0.89 C ATOM 181 OG1 THR A1896 15.800 -5.520 8.688 1.00 0.98 O ATOM 182 CG2 THR A1896 17.561 -6.631 7.454 1.00 1.02 C ATOM 0 H THR A1896 13.546 -6.822 7.703 1.00 0.63 H new ATOM 0 HA THR A1896 15.574 -5.621 5.976 1.00 0.69 H new ATOM 0 HB THR A1896 15.828 -7.574 8.292 1.00 0.89 H new ATOM 0 HG1 THR A1896 16.341 -5.606 9.501 1.00 0.98 H new ATOM 0 HG21 THR A1896 18.150 -6.733 8.365 1.00 1.02 H new ATOM 0 HG22 THR A1896 17.777 -7.465 6.787 1.00 1.02 H new ATOM 0 HG23 THR A1896 17.818 -5.695 6.959 1.00 1.02 H new ATOM 190 N ASN A1897 15.650 -7.560 4.402 1.00 0.75 N ATOM 191 CA ASN A1897 15.817 -8.691 3.498 1.00 0.88 C ATOM 192 C ASN A1897 17.258 -9.167 3.590 1.00 1.04 C ATOM 193 O ASN A1897 18.162 -8.441 3.187 1.00 1.06 O ATOM 194 CB ASN A1897 15.506 -8.284 2.036 1.00 0.95 C ATOM 195 CG ASN A1897 15.521 -9.469 1.052 1.00 1.17 C ATOM 196 OD1 ASN A1897 16.190 -10.466 1.262 1.00 1.65 O ATOM 197 ND2 ASN A1897 14.833 -9.334 -0.049 1.00 1.21 N ATOM 0 H ASN A1897 15.781 -6.646 3.969 1.00 0.75 H new ATOM 0 HA ASN A1897 15.126 -9.484 3.785 1.00 0.88 H new ATOM 0 HB2 ASN A1897 14.527 -7.805 2.001 1.00 0.95 H new ATOM 0 HB3 ASN A1897 16.236 -7.542 1.711 1.00 0.95 H new ATOM 0 HD21 ASN A1897 14.849 -10.071 -0.754 1.00 1.21 H new ATOM 0 HD22 ASN A1897 14.280 -8.491 -0.205 1.00 1.21 H new ATOM 204 N PRO A1898 17.495 -10.377 4.112 1.00 1.26 N ATOM 205 CA PRO A1898 18.848 -10.916 4.276 1.00 1.47 C ATOM 206 C PRO A1898 19.512 -11.267 2.942 1.00 1.54 C ATOM 207 O PRO A1898 20.735 -11.234 2.823 1.00 1.71 O ATOM 208 CB PRO A1898 18.631 -12.181 5.106 1.00 1.73 C ATOM 209 CG PRO A1898 17.238 -12.593 4.803 1.00 1.69 C ATOM 210 CD PRO A1898 16.467 -11.327 4.588 1.00 1.40 C ATOM 0 HA PRO A1898 19.514 -10.189 4.740 1.00 1.47 H new ATOM 0 HB2 PRO A1898 19.343 -12.960 4.834 1.00 1.73 H new ATOM 0 HB3 PRO A1898 18.764 -11.985 6.170 1.00 1.73 H new ATOM 0 HG2 PRO A1898 17.203 -13.226 3.916 1.00 1.69 H new ATOM 0 HG3 PRO A1898 16.815 -13.172 5.624 1.00 1.69 H new ATOM 0 HD2 PRO A1898 15.672 -11.460 3.854 1.00 1.40 H new ATOM 0 HD3 PRO A1898 15.996 -10.982 5.509 1.00 1.40 H new ATOM 218 N ALA A1899 18.705 -11.584 1.938 1.00 1.48 N ATOM 219 CA ALA A1899 19.223 -11.963 0.633 1.00 1.62 C ATOM 220 C ALA A1899 19.811 -10.754 -0.061 1.00 1.54 C ATOM 221 O ALA A1899 20.864 -10.831 -0.708 1.00 1.69 O ATOM 222 CB ALA A1899 18.127 -12.589 -0.224 1.00 1.72 C ATOM 0 H ALA A1899 17.687 -11.586 2.004 1.00 1.48 H new ATOM 0 HA ALA A1899 20.008 -12.706 0.774 1.00 1.62 H new ATOM 0 HB1 ALA A1899 18.538 -12.865 -1.195 1.00 1.72 H new ATOM 0 HB2 ALA A1899 17.741 -13.479 0.272 1.00 1.72 H new ATOM 0 HB3 ALA A1899 17.319 -11.871 -0.362 1.00 1.72 H new ATOM 228 N THR A1900 19.144 -9.643 0.087 1.00 1.37 N ATOM 229 CA THR A1900 19.588 -8.418 -0.504 1.00 1.38 C ATOM 230 C THR A1900 20.608 -7.737 0.416 1.00 1.36 C ATOM 231 O THR A1900 21.643 -7.257 -0.032 1.00 1.53 O ATOM 232 CB THR A1900 18.389 -7.481 -0.713 1.00 1.31 C ATOM 233 OG1 THR A1900 17.328 -8.212 -1.311 1.00 1.45 O ATOM 234 CG2 THR A1900 18.755 -6.340 -1.630 1.00 1.46 C ATOM 0 H THR A1900 18.278 -9.565 0.621 1.00 1.37 H new ATOM 0 HA THR A1900 20.054 -8.635 -1.465 1.00 1.38 H new ATOM 0 HB THR A1900 18.089 -7.081 0.256 1.00 1.31 H new ATOM 0 HG1 THR A1900 17.632 -8.593 -2.161 1.00 1.45 H new ATOM 0 HG21 THR A1900 17.891 -5.689 -1.764 1.00 1.46 H new ATOM 0 HG22 THR A1900 19.574 -5.770 -1.192 1.00 1.46 H new ATOM 0 HG23 THR A1900 19.065 -6.736 -2.597 1.00 1.46 H new ATOM 242 N GLY A1901 20.313 -7.732 1.706 1.00 1.23 N ATOM 243 CA GLY A1901 21.157 -7.049 2.664 1.00 1.29 C ATOM 244 C GLY A1901 20.691 -5.627 2.842 1.00 1.27 C ATOM 245 O GLY A1901 21.343 -4.801 3.489 1.00 1.46 O ATOM 0 H GLY A1901 19.497 -8.193 2.110 1.00 1.23 H new ATOM 0 HA2 GLY A1901 21.131 -7.571 3.621 1.00 1.29 H new ATOM 0 HA3 GLY A1901 22.192 -7.061 2.322 1.00 1.29 H new ATOM 249 N HIS A1902 19.552 -5.349 2.261 1.00 1.12 N ATOM 250 CA HIS A1902 18.971 -4.040 2.273 1.00 1.15 C ATOM 251 C HIS A1902 17.729 -4.087 3.141 1.00 0.91 C ATOM 252 O HIS A1902 16.893 -4.994 2.996 1.00 0.84 O ATOM 253 CB HIS A1902 18.611 -3.627 0.827 1.00 1.34 C ATOM 254 CG HIS A1902 18.303 -2.160 0.605 1.00 2.00 C ATOM 255 ND1 HIS A1902 19.077 -1.356 -0.199 1.00 2.46 N ATOM 256 CD2 HIS A1902 17.276 -1.378 1.024 1.00 2.87 C ATOM 257 CE1 HIS A1902 18.546 -0.152 -0.262 1.00 3.18 C ATOM 258 NE2 HIS A1902 17.452 -0.143 0.471 1.00 3.41 N ATOM 0 H HIS A1902 18.996 -6.041 1.759 1.00 1.12 H new ATOM 0 HA HIS A1902 19.670 -3.307 2.674 1.00 1.15 H new ATOM 0 HB2 HIS A1902 19.439 -3.905 0.175 1.00 1.34 H new ATOM 0 HB3 HIS A1902 17.746 -4.210 0.510 1.00 1.34 H new ATOM 0 HD2 HIS A1902 16.468 -1.678 1.675 1.00 2.87 H new ATOM 0 HE1 HIS A1902 18.940 0.685 -0.820 1.00 3.18 H new ATOM 0 HE2 HIS A1902 16.835 0.658 0.604 1.00 3.41 H new ATOM 267 N LEU A1903 17.616 -3.157 4.030 1.00 0.87 N ATOM 268 CA LEU A1903 16.462 -3.051 4.881 1.00 0.75 C ATOM 269 C LEU A1903 15.466 -2.185 4.127 1.00 0.70 C ATOM 270 O LEU A1903 15.762 -1.026 3.815 1.00 0.88 O ATOM 271 CB LEU A1903 16.872 -2.398 6.232 1.00 0.94 C ATOM 272 CG LEU A1903 15.884 -2.467 7.436 1.00 0.99 C ATOM 273 CD1 LEU A1903 16.537 -1.877 8.667 1.00 1.34 C ATOM 274 CD2 LEU A1903 14.575 -1.733 7.175 1.00 1.48 C ATOM 0 H LEU A1903 18.323 -2.440 4.193 1.00 0.87 H new ATOM 0 HA LEU A1903 16.026 -4.023 5.114 1.00 0.75 H new ATOM 0 HB2 LEU A1903 17.809 -2.857 6.548 1.00 0.94 H new ATOM 0 HB3 LEU A1903 17.082 -1.346 6.039 1.00 0.94 H new ATOM 0 HG LEU A1903 15.647 -3.520 7.586 1.00 0.99 H new ATOM 0 HD11 LEU A1903 15.843 -1.927 9.506 1.00 1.34 H new ATOM 0 HD12 LEU A1903 17.438 -2.442 8.907 1.00 1.34 H new ATOM 0 HD13 LEU A1903 16.801 -0.837 8.476 1.00 1.34 H new ATOM 0 HD21 LEU A1903 13.930 -1.817 8.050 1.00 1.48 H new ATOM 0 HD22 LEU A1903 14.781 -0.681 6.976 1.00 1.48 H new ATOM 0 HD23 LEU A1903 14.076 -2.174 6.312 1.00 1.48 H new ATOM 286 N PHE A1904 14.320 -2.727 3.832 1.00 0.53 N ATOM 287 CA PHE A1904 13.327 -2.011 3.078 1.00 0.51 C ATOM 288 C PHE A1904 12.408 -1.352 4.050 1.00 0.48 C ATOM 289 O PHE A1904 11.841 -2.010 4.930 1.00 0.49 O ATOM 290 CB PHE A1904 12.503 -2.938 2.192 1.00 0.51 C ATOM 291 CG PHE A1904 13.274 -3.815 1.251 1.00 0.58 C ATOM 292 CD1 PHE A1904 14.391 -3.319 0.616 1.00 1.01 C ATOM 293 CD2 PHE A1904 12.915 -5.130 1.033 1.00 0.71 C ATOM 294 CE1 PHE A1904 15.133 -4.105 -0.224 1.00 1.17 C ATOM 295 CE2 PHE A1904 13.657 -5.928 0.189 1.00 0.79 C ATOM 296 CZ PHE A1904 14.626 -5.450 -0.528 1.00 0.86 C ATOM 0 H PHE A1904 14.047 -3.671 4.104 1.00 0.53 H new ATOM 0 HA PHE A1904 13.832 -1.291 2.434 1.00 0.51 H new ATOM 0 HB2 PHE A1904 11.896 -3.576 2.835 1.00 0.51 H new ATOM 0 HB3 PHE A1904 11.815 -2.329 1.606 1.00 0.51 H new ATOM 0 HD1 PHE A1904 14.686 -2.294 0.783 1.00 1.01 H new ATOM 0 HD2 PHE A1904 12.046 -5.537 1.528 1.00 0.71 H new ATOM 0 HE1 PHE A1904 16.060 -3.748 -0.649 1.00 1.17 H new ATOM 0 HE2 PHE A1904 13.425 -6.981 0.123 1.00 0.79 H new ATOM 0 HZ PHE A1904 15.052 -6.030 -1.333 1.00 0.86 H new ATOM 306 N ASP A1905 12.287 -0.078 3.926 1.00 0.57 N ATOM 307 CA ASP A1905 11.489 0.700 4.821 1.00 0.61 C ATOM 308 C ASP A1905 10.880 1.883 4.115 1.00 0.55 C ATOM 309 O ASP A1905 11.575 2.724 3.555 1.00 0.71 O ATOM 310 CB ASP A1905 12.316 1.127 6.018 1.00 0.88 C ATOM 311 CG ASP A1905 11.687 2.227 6.812 1.00 1.37 C ATOM 312 OD1 ASP A1905 10.530 2.044 7.212 1.00 1.97 O ATOM 313 OD2 ASP A1905 12.329 3.291 7.040 1.00 1.95 O ATOM 0 H ASP A1905 12.743 0.465 3.193 1.00 0.57 H new ATOM 0 HA ASP A1905 10.665 0.084 5.181 1.00 0.61 H new ATOM 0 HB2 ASP A1905 12.475 0.266 6.667 1.00 0.88 H new ATOM 0 HB3 ASP A1905 13.298 1.452 5.674 1.00 0.88 H new ATOM 318 N LEU A1906 9.585 1.933 4.145 1.00 0.48 N ATOM 319 CA LEU A1906 8.815 2.957 3.474 1.00 0.48 C ATOM 320 C LEU A1906 8.515 4.138 4.411 1.00 0.52 C ATOM 321 O LEU A1906 7.379 4.592 4.493 1.00 0.71 O ATOM 322 CB LEU A1906 7.502 2.331 2.985 1.00 0.50 C ATOM 323 CG LEU A1906 7.639 1.179 1.983 1.00 0.47 C ATOM 324 CD1 LEU A1906 6.306 0.515 1.761 1.00 0.53 C ATOM 325 CD2 LEU A1906 8.182 1.681 0.662 1.00 0.54 C ATOM 0 H LEU A1906 9.013 1.253 4.645 1.00 0.48 H new ATOM 0 HA LEU A1906 9.392 3.344 2.634 1.00 0.48 H new ATOM 0 HB2 LEU A1906 6.950 1.968 3.852 1.00 0.50 H new ATOM 0 HB3 LEU A1906 6.897 3.114 2.528 1.00 0.50 H new ATOM 0 HG LEU A1906 8.337 0.452 2.398 1.00 0.47 H new ATOM 0 HD11 LEU A1906 6.420 -0.301 1.047 1.00 0.53 H new ATOM 0 HD12 LEU A1906 5.934 0.120 2.707 1.00 0.53 H new ATOM 0 HD13 LEU A1906 5.597 1.244 1.368 1.00 0.53 H new ATOM 0 HD21 LEU A1906 8.272 0.848 -0.035 1.00 0.54 H new ATOM 0 HD22 LEU A1906 7.503 2.427 0.250 1.00 0.54 H new ATOM 0 HD23 LEU A1906 9.163 2.130 0.819 1.00 0.54 H new ATOM 337 N THR A1907 9.524 4.650 5.095 1.00 0.66 N ATOM 338 CA THR A1907 9.336 5.770 6.020 1.00 0.74 C ATOM 339 C THR A1907 8.939 7.084 5.335 1.00 0.69 C ATOM 340 O THR A1907 8.304 7.930 5.940 1.00 0.70 O ATOM 341 CB THR A1907 10.561 5.982 6.905 1.00 1.11 C ATOM 342 OG1 THR A1907 11.732 5.625 6.177 1.00 1.59 O ATOM 343 CG2 THR A1907 10.459 5.181 8.182 1.00 1.13 C ATOM 0 H THR A1907 10.484 4.312 5.032 1.00 0.66 H new ATOM 0 HA THR A1907 8.492 5.480 6.646 1.00 0.74 H new ATOM 0 HB THR A1907 10.616 7.034 7.186 1.00 1.11 H new ATOM 0 HG1 THR A1907 11.956 4.688 6.357 1.00 1.59 H new ATOM 0 HG21 THR A1907 11.346 5.353 8.791 1.00 1.13 H new ATOM 0 HG22 THR A1907 9.573 5.491 8.736 1.00 1.13 H new ATOM 0 HG23 THR A1907 10.384 4.121 7.941 1.00 1.13 H new ATOM 351 N SER A1908 9.308 7.254 4.089 1.00 0.83 N ATOM 352 CA SER A1908 8.937 8.455 3.351 1.00 1.00 C ATOM 353 C SER A1908 7.486 8.355 2.839 1.00 0.94 C ATOM 354 O SER A1908 6.928 9.315 2.274 1.00 1.16 O ATOM 355 CB SER A1908 9.928 8.666 2.212 1.00 1.28 C ATOM 356 OG SER A1908 11.255 8.538 2.716 1.00 1.36 O ATOM 0 H SER A1908 9.863 6.583 3.558 1.00 0.83 H new ATOM 0 HA SER A1908 8.979 9.321 4.012 1.00 1.00 H new ATOM 0 HB2 SER A1908 9.754 7.935 1.422 1.00 1.28 H new ATOM 0 HB3 SER A1908 9.788 9.652 1.770 1.00 1.28 H new ATOM 0 HG SER A1908 11.896 8.671 1.987 1.00 1.36 H new ATOM 362 N LEU A1909 6.884 7.197 3.042 1.00 0.76 N ATOM 363 CA LEU A1909 5.535 6.975 2.605 1.00 0.87 C ATOM 364 C LEU A1909 4.599 6.894 3.821 1.00 0.82 C ATOM 365 O LEU A1909 3.531 7.496 3.822 1.00 1.00 O ATOM 366 CB LEU A1909 5.470 5.701 1.734 1.00 0.89 C ATOM 367 CG LEU A1909 4.301 5.598 0.734 1.00 1.28 C ATOM 368 CD1 LEU A1909 2.955 5.395 1.418 1.00 2.03 C ATOM 369 CD2 LEU A1909 4.276 6.848 -0.133 1.00 1.67 C ATOM 0 H LEU A1909 7.317 6.400 3.509 1.00 0.76 H new ATOM 0 HA LEU A1909 5.201 7.811 1.990 1.00 0.87 H new ATOM 0 HB2 LEU A1909 6.402 5.625 1.175 1.00 0.89 H new ATOM 0 HB3 LEU A1909 5.425 4.838 2.398 1.00 0.89 H new ATOM 0 HG LEU A1909 4.467 4.715 0.117 1.00 1.28 H new ATOM 0 HD11 LEU A1909 2.170 5.330 0.664 1.00 2.03 H new ATOM 0 HD12 LEU A1909 2.978 4.473 1.999 1.00 2.03 H new ATOM 0 HD13 LEU A1909 2.753 6.237 2.080 1.00 2.03 H new ATOM 0 HD21 LEU A1909 3.451 6.782 -0.843 1.00 1.67 H new ATOM 0 HD22 LEU A1909 4.142 7.726 0.499 1.00 1.67 H new ATOM 0 HD23 LEU A1909 5.217 6.933 -0.677 1.00 1.67 H new ATOM 381 N LYS A1910 5.023 6.154 4.853 1.00 0.69 N ATOM 382 CA LYS A1910 4.229 5.997 6.072 1.00 0.78 C ATOM 383 C LYS A1910 4.029 7.342 6.771 1.00 0.81 C ATOM 384 O LYS A1910 4.966 7.928 7.331 1.00 0.92 O ATOM 385 CB LYS A1910 4.850 4.963 7.051 1.00 0.85 C ATOM 386 CG LYS A1910 6.298 5.249 7.440 1.00 1.10 C ATOM 387 CD LYS A1910 6.751 4.469 8.666 1.00 1.40 C ATOM 388 CE LYS A1910 6.864 2.953 8.442 1.00 2.20 C ATOM 389 NZ LYS A1910 7.916 2.533 7.459 1.00 2.72 N ATOM 0 H LYS A1910 5.913 5.655 4.865 1.00 0.69 H new ATOM 0 HA LYS A1910 3.256 5.612 5.767 1.00 0.78 H new ATOM 0 HB2 LYS A1910 4.244 4.929 7.956 1.00 0.85 H new ATOM 0 HB3 LYS A1910 4.798 3.974 6.596 1.00 0.85 H new ATOM 0 HG2 LYS A1910 6.949 5.005 6.600 1.00 1.10 H new ATOM 0 HG3 LYS A1910 6.413 6.316 7.632 1.00 1.10 H new ATOM 0 HD2 LYS A1910 7.720 4.851 8.988 1.00 1.40 H new ATOM 0 HD3 LYS A1910 6.050 4.653 9.480 1.00 1.40 H new ATOM 0 HE2 LYS A1910 7.071 2.474 9.399 1.00 2.20 H new ATOM 0 HE3 LYS A1910 5.899 2.579 8.100 1.00 2.20 H new ATOM 0 HZ1 LYS A1910 7.787 1.529 7.220 1.00 2.72 H new ATOM 0 HZ2 LYS A1910 7.834 3.108 6.596 1.00 2.72 H new ATOM 0 HZ3 LYS A1910 8.858 2.670 7.878 1.00 2.72 H new ATOM 403 N ARG A1911 2.844 7.837 6.723 1.00 0.82 N ATOM 404 CA ARG A1911 2.571 9.092 7.317 1.00 0.91 C ATOM 405 C ARG A1911 1.301 9.072 8.124 1.00 0.98 C ATOM 406 O ARG A1911 0.579 8.090 8.131 1.00 1.03 O ATOM 407 CB ARG A1911 2.639 10.230 6.288 1.00 0.99 C ATOM 408 CG ARG A1911 1.761 10.083 5.052 1.00 1.05 C ATOM 409 CD ARG A1911 2.145 11.152 4.044 1.00 1.26 C ATOM 410 NE ARG A1911 1.348 11.131 2.814 1.00 1.50 N ATOM 411 CZ ARG A1911 1.759 11.646 1.641 1.00 1.86 C ATOM 412 NH1 ARG A1911 3.030 12.016 1.470 1.00 1.90 N ATOM 413 NH2 ARG A1911 0.919 11.741 0.626 1.00 2.60 N ATOM 0 H ARG A1911 2.045 7.388 6.275 1.00 0.82 H new ATOM 0 HA ARG A1911 3.362 9.299 8.038 1.00 0.91 H new ATOM 0 HB2 ARG A1911 2.369 11.160 6.789 1.00 0.99 H new ATOM 0 HB3 ARG A1911 3.674 10.333 5.961 1.00 0.99 H new ATOM 0 HG2 ARG A1911 1.887 9.092 4.616 1.00 1.05 H new ATOM 0 HG3 ARG A1911 0.710 10.181 5.323 1.00 1.05 H new ATOM 0 HD2 ARG A1911 2.044 12.131 4.513 1.00 1.26 H new ATOM 0 HD3 ARG A1911 3.197 11.030 3.785 1.00 1.26 H new ATOM 0 HE ARG A1911 0.425 10.699 2.850 1.00 1.50 H new ATOM 0 HH11 ARG A1911 3.699 11.909 2.232 1.00 1.90 H new ATOM 0 HH12 ARG A1911 3.332 12.405 0.577 1.00 1.90 H new ATOM 0 HH21 ARG A1911 -0.045 11.423 0.730 1.00 2.60 H new ATOM 0 HH22 ARG A1911 1.234 12.132 -0.262 1.00 2.60 H new ATOM 427 N GLU A1912 1.058 10.154 8.790 1.00 1.18 N ATOM 428 CA GLU A1912 -0.041 10.317 9.733 1.00 1.43 C ATOM 429 C GLU A1912 -1.410 10.364 9.050 1.00 1.27 C ATOM 430 O GLU A1912 -2.409 9.920 9.604 1.00 1.48 O ATOM 431 CB GLU A1912 0.186 11.603 10.578 1.00 1.83 C ATOM 432 CG GLU A1912 0.158 12.951 9.809 1.00 2.47 C ATOM 433 CD GLU A1912 1.146 13.024 8.661 1.00 2.80 C ATOM 434 OE1 GLU A1912 2.365 13.169 8.916 1.00 3.16 O ATOM 435 OE2 GLU A1912 0.724 12.877 7.490 1.00 3.25 O ATOM 0 H GLU A1912 1.633 10.992 8.700 1.00 1.18 H new ATOM 0 HA GLU A1912 -0.048 9.440 10.380 1.00 1.43 H new ATOM 0 HB2 GLU A1912 -0.576 11.639 11.357 1.00 1.83 H new ATOM 0 HB3 GLU A1912 1.150 11.516 11.079 1.00 1.83 H new ATOM 0 HG2 GLU A1912 -0.847 13.116 9.421 1.00 2.47 H new ATOM 0 HG3 GLU A1912 0.367 13.761 10.508 1.00 2.47 H new ATOM 442 N SER A1913 -1.440 10.901 7.869 1.00 1.09 N ATOM 443 CA SER A1913 -2.659 11.101 7.160 1.00 1.05 C ATOM 444 C SER A1913 -3.039 9.903 6.267 1.00 0.93 C ATOM 445 O SER A1913 -3.980 9.132 6.582 1.00 1.08 O ATOM 446 CB SER A1913 -2.516 12.393 6.367 1.00 1.25 C ATOM 447 OG SER A1913 -1.240 12.437 5.701 1.00 1.86 O ATOM 0 H SER A1913 -0.609 11.215 7.368 1.00 1.09 H new ATOM 0 HA SER A1913 -3.485 11.182 7.867 1.00 1.05 H new ATOM 0 HB2 SER A1913 -3.319 12.467 5.633 1.00 1.25 H new ATOM 0 HB3 SER A1913 -2.614 13.249 7.034 1.00 1.25 H new ATOM 0 HG SER A1913 -0.568 12.814 6.306 1.00 1.86 H new ATOM 453 N GLY A1914 -2.316 9.753 5.186 1.00 0.88 N ATOM 454 CA GLY A1914 -2.554 8.709 4.239 1.00 0.88 C ATOM 455 C GLY A1914 -1.929 9.073 2.925 1.00 0.86 C ATOM 456 O GLY A1914 -1.225 10.097 2.839 1.00 1.14 O ATOM 0 H GLY A1914 -1.537 10.364 4.942 1.00 0.88 H new ATOM 0 HA2 GLY A1914 -2.137 7.770 4.604 1.00 0.88 H new ATOM 0 HA3 GLY A1914 -3.626 8.555 4.114 1.00 0.88 H new ATOM 460 N TYR A1915 -2.148 8.279 1.928 1.00 0.70 N ATOM 461 CA TYR A1915 -1.629 8.538 0.623 1.00 0.82 C ATOM 462 C TYR A1915 -2.749 8.330 -0.382 1.00 0.65 C ATOM 463 O TYR A1915 -3.542 7.403 -0.259 1.00 0.66 O ATOM 464 CB TYR A1915 -0.428 7.624 0.327 1.00 1.06 C ATOM 465 CG TYR A1915 0.314 7.980 -0.936 1.00 1.50 C ATOM 466 CD1 TYR A1915 -0.073 7.473 -2.161 1.00 1.97 C ATOM 467 CD2 TYR A1915 1.398 8.840 -0.897 1.00 2.32 C ATOM 468 CE1 TYR A1915 0.597 7.810 -3.305 1.00 2.95 C ATOM 469 CE2 TYR A1915 2.075 9.182 -2.046 1.00 3.26 C ATOM 470 CZ TYR A1915 1.667 8.661 -3.246 1.00 3.50 C ATOM 471 OH TYR A1915 2.325 9.005 -4.407 1.00 4.60 O ATOM 0 H TYR A1915 -2.698 7.423 1.997 1.00 0.70 H new ATOM 0 HA TYR A1915 -1.269 9.565 0.556 1.00 0.82 H new ATOM 0 HB2 TYR A1915 0.264 7.667 1.168 1.00 1.06 H new ATOM 0 HB3 TYR A1915 -0.777 6.594 0.254 1.00 1.06 H new ATOM 0 HD1 TYR A1915 -0.917 6.801 -2.217 1.00 1.97 H new ATOM 0 HD2 TYR A1915 1.718 9.249 0.050 1.00 2.32 H new ATOM 0 HE1 TYR A1915 0.281 7.404 -4.255 1.00 2.95 H new ATOM 0 HE2 TYR A1915 2.919 9.854 -2.002 1.00 3.26 H new ATOM 0 HH TYR A1915 3.250 8.684 -4.366 1.00 4.60 H new ATOM 481 N THR A1916 -2.833 9.187 -1.338 1.00 0.65 N ATOM 482 CA THR A1916 -3.888 9.112 -2.279 1.00 0.60 C ATOM 483 C THR A1916 -3.390 8.773 -3.665 1.00 0.60 C ATOM 484 O THR A1916 -2.264 9.124 -4.077 1.00 0.76 O ATOM 485 CB THR A1916 -4.702 10.439 -2.315 1.00 0.79 C ATOM 486 OG1 THR A1916 -5.904 10.285 -3.097 1.00 1.21 O ATOM 487 CG2 THR A1916 -3.860 11.569 -2.905 1.00 1.26 C ATOM 0 H THR A1916 -2.177 9.953 -1.487 1.00 0.65 H new ATOM 0 HA THR A1916 -4.543 8.304 -1.952 1.00 0.60 H new ATOM 0 HB THR A1916 -4.974 10.687 -1.289 1.00 0.79 H new ATOM 0 HG1 THR A1916 -6.400 11.130 -3.104 1.00 1.21 H new ATOM 0 HG21 THR A1916 -4.445 12.488 -2.922 1.00 1.26 H new ATOM 0 HG22 THR A1916 -2.970 11.717 -2.293 1.00 1.26 H new ATOM 0 HG23 THR A1916 -3.563 11.309 -3.921 1.00 1.26 H new ATOM 495 N ILE A1917 -4.199 8.031 -4.329 1.00 0.52 N ATOM 496 CA ILE A1917 -4.068 7.748 -5.714 1.00 0.56 C ATOM 497 C ILE A1917 -5.457 7.980 -6.264 1.00 0.57 C ATOM 498 O ILE A1917 -6.399 8.246 -5.490 1.00 0.59 O ATOM 499 CB ILE A1917 -3.693 6.281 -6.030 1.00 0.59 C ATOM 500 CG1 ILE A1917 -3.216 5.510 -4.786 1.00 0.69 C ATOM 501 CG2 ILE A1917 -2.618 6.249 -7.130 1.00 0.74 C ATOM 502 CD1 ILE A1917 -2.984 4.032 -5.034 1.00 0.74 C ATOM 0 H ILE A1917 -5.010 7.582 -3.902 1.00 0.52 H new ATOM 0 HA ILE A1917 -3.273 8.364 -6.135 1.00 0.56 H new ATOM 0 HB ILE A1917 -4.595 5.779 -6.380 1.00 0.59 H new ATOM 0 HG12 ILE A1917 -2.290 5.958 -4.425 1.00 0.69 H new ATOM 0 HG13 ILE A1917 -3.956 5.624 -3.993 1.00 0.69 H new ATOM 0 HG21 ILE A1917 -2.355 5.215 -7.352 1.00 0.74 H new ATOM 0 HG22 ILE A1917 -3.005 6.726 -8.031 1.00 0.74 H new ATOM 0 HG23 ILE A1917 -1.732 6.784 -6.788 1.00 0.74 H new ATOM 0 HD11 ILE A1917 -2.650 3.556 -4.112 1.00 0.74 H new ATOM 0 HD12 ILE A1917 -3.913 3.568 -5.365 1.00 0.74 H new ATOM 0 HD13 ILE A1917 -2.222 3.907 -5.803 1.00 0.74 H new ATOM 514 N THR A1918 -5.632 7.843 -7.516 1.00 0.65 N ATOM 515 CA THR A1918 -6.927 8.072 -8.074 1.00 0.72 C ATOM 516 C THR A1918 -7.548 6.739 -8.444 1.00 0.68 C ATOM 517 O THR A1918 -6.853 5.846 -8.959 1.00 0.76 O ATOM 518 CB THR A1918 -6.849 8.996 -9.312 1.00 0.94 C ATOM 519 OG1 THR A1918 -5.985 10.111 -9.003 1.00 1.07 O ATOM 520 CG2 THR A1918 -8.235 9.537 -9.661 1.00 1.06 C ATOM 0 H THR A1918 -4.908 7.575 -8.183 1.00 0.65 H new ATOM 0 HA THR A1918 -7.548 8.574 -7.332 1.00 0.72 H new ATOM 0 HB THR A1918 -6.463 8.427 -10.158 1.00 0.94 H new ATOM 0 HG1 THR A1918 -5.926 10.704 -9.781 1.00 1.07 H new ATOM 0 HG21 THR A1918 -8.163 10.185 -10.534 1.00 1.06 H new ATOM 0 HG22 THR A1918 -8.905 8.706 -9.880 1.00 1.06 H new ATOM 0 HG23 THR A1918 -8.626 10.106 -8.818 1.00 1.06 H new ATOM 528 N ASP A1919 -8.824 6.586 -8.136 1.00 0.69 N ATOM 529 CA ASP A1919 -9.577 5.393 -8.478 1.00 0.74 C ATOM 530 C ASP A1919 -9.811 5.363 -9.992 1.00 0.99 C ATOM 531 O ASP A1919 -9.441 6.325 -10.677 1.00 1.30 O ATOM 532 CB ASP A1919 -10.883 5.391 -7.653 1.00 0.76 C ATOM 533 CG ASP A1919 -11.958 4.452 -8.127 1.00 0.99 C ATOM 534 OD1 ASP A1919 -11.801 3.235 -7.997 1.00 1.28 O ATOM 535 OD2 ASP A1919 -12.995 4.945 -8.651 1.00 1.62 O ATOM 0 H ASP A1919 -9.369 7.290 -7.639 1.00 0.69 H new ATOM 0 HA ASP A1919 -9.032 4.482 -8.230 1.00 0.74 H new ATOM 0 HB2 ASP A1919 -10.638 5.140 -6.621 1.00 0.76 H new ATOM 0 HB3 ASP A1919 -11.288 6.403 -7.647 1.00 0.76 H new ATOM 540 N SER A1920 -10.415 4.286 -10.493 1.00 1.06 N ATOM 541 CA SER A1920 -10.656 4.052 -11.909 1.00 1.32 C ATOM 542 C SER A1920 -11.123 5.325 -12.632 1.00 1.30 C ATOM 543 O SER A1920 -10.520 5.746 -13.627 1.00 1.75 O ATOM 544 CB SER A1920 -11.703 2.945 -12.029 1.00 1.64 C ATOM 545 OG SER A1920 -12.900 3.288 -11.321 1.00 2.13 O ATOM 0 H SER A1920 -10.760 3.530 -9.902 1.00 1.06 H new ATOM 0 HA SER A1920 -9.724 3.752 -12.389 1.00 1.32 H new ATOM 0 HB2 SER A1920 -11.935 2.772 -13.080 1.00 1.64 H new ATOM 0 HB3 SER A1920 -11.298 2.013 -11.635 1.00 1.64 H new ATOM 0 HG SER A1920 -13.554 2.564 -11.415 1.00 2.13 H new ATOM 551 N HIS A1921 -12.146 5.965 -12.088 1.00 1.22 N ATOM 552 CA HIS A1921 -12.636 7.217 -12.632 1.00 1.77 C ATOM 553 C HIS A1921 -13.626 7.871 -11.670 1.00 1.73 C ATOM 554 O HIS A1921 -14.174 8.929 -11.959 1.00 2.31 O ATOM 555 CB HIS A1921 -13.296 6.969 -14.016 1.00 2.44 C ATOM 556 CG HIS A1921 -13.671 8.209 -14.772 1.00 3.25 C ATOM 557 ND1 HIS A1921 -14.958 8.494 -15.154 1.00 4.13 N ATOM 558 CD2 HIS A1921 -12.911 9.225 -15.234 1.00 3.75 C ATOM 559 CE1 HIS A1921 -14.977 9.627 -15.813 1.00 4.85 C ATOM 560 NE2 HIS A1921 -13.750 10.089 -15.876 1.00 4.66 N ATOM 0 H HIS A1921 -12.653 5.635 -11.267 1.00 1.22 H new ATOM 0 HA HIS A1921 -11.795 7.898 -12.762 1.00 1.77 H new ATOM 0 HB2 HIS A1921 -12.611 6.382 -14.628 1.00 2.44 H new ATOM 0 HB3 HIS A1921 -14.192 6.365 -13.871 1.00 2.44 H new ATOM 0 HD2 HIS A1921 -11.843 9.333 -15.118 1.00 3.75 H new ATOM 0 HE1 HIS A1921 -15.853 10.100 -16.233 1.00 4.85 H new ATOM 0 HE2 HIS A1921 -13.468 10.956 -16.333 1.00 4.66 H new ATOM 569 N ASN A1922 -13.810 7.294 -10.501 1.00 1.59 N ATOM 570 CA ASN A1922 -14.866 7.787 -9.638 1.00 1.80 C ATOM 571 C ASN A1922 -14.358 8.270 -8.302 1.00 1.38 C ATOM 572 O ASN A1922 -14.495 9.442 -7.945 1.00 1.72 O ATOM 573 CB ASN A1922 -15.865 6.675 -9.378 1.00 2.28 C ATOM 574 CG ASN A1922 -17.145 7.149 -8.691 1.00 3.05 C ATOM 575 OD1 ASN A1922 -17.712 6.429 -7.879 1.00 3.29 O ATOM 576 ND2 ASN A1922 -17.646 8.306 -9.060 1.00 3.89 N ATOM 0 H ASN A1922 -13.266 6.513 -10.135 1.00 1.59 H new ATOM 0 HA ASN A1922 -15.322 8.631 -10.156 1.00 1.80 H new ATOM 0 HB2 ASN A1922 -16.125 6.203 -10.325 1.00 2.28 H new ATOM 0 HB3 ASN A1922 -15.393 5.911 -8.760 1.00 2.28 H new ATOM 0 HD21 ASN A1922 -18.531 8.627 -8.668 1.00 3.89 H new ATOM 0 HD22 ASN A1922 -17.150 8.883 -9.739 1.00 3.89 H new ATOM 583 N ARG A1923 -13.782 7.367 -7.576 1.00 0.98 N ATOM 584 CA ARG A1923 -13.436 7.602 -6.177 1.00 0.97 C ATOM 585 C ARG A1923 -11.987 8.067 -6.003 1.00 0.83 C ATOM 586 O ARG A1923 -11.275 8.348 -6.979 1.00 0.99 O ATOM 587 CB ARG A1923 -13.638 6.302 -5.381 1.00 1.46 C ATOM 588 CG ARG A1923 -14.657 5.335 -5.971 1.00 1.89 C ATOM 589 CD ARG A1923 -14.923 4.187 -5.031 1.00 2.66 C ATOM 590 NE ARG A1923 -15.546 3.051 -5.707 1.00 2.93 N ATOM 591 CZ ARG A1923 -16.362 2.172 -5.125 1.00 3.73 C ATOM 592 NH1 ARG A1923 -16.942 2.451 -3.958 1.00 4.35 N ATOM 593 NH2 ARG A1923 -16.643 1.032 -5.737 1.00 4.26 N ATOM 0 H ARG A1923 -13.531 6.440 -7.919 1.00 0.98 H new ATOM 0 HA ARG A1923 -14.087 8.394 -5.808 1.00 0.97 H new ATOM 0 HB2 ARG A1923 -12.679 5.791 -5.301 1.00 1.46 H new ATOM 0 HB3 ARG A1923 -13.948 6.559 -4.368 1.00 1.46 H new ATOM 0 HG2 ARG A1923 -15.588 5.864 -6.177 1.00 1.89 H new ATOM 0 HG3 ARG A1923 -14.290 4.952 -6.923 1.00 1.89 H new ATOM 0 HD2 ARG A1923 -13.985 3.867 -4.577 1.00 2.66 H new ATOM 0 HD3 ARG A1923 -15.570 4.525 -4.222 1.00 2.66 H new ATOM 0 HE ARG A1923 -15.341 2.921 -6.698 1.00 2.93 H new ATOM 0 HH11 ARG A1923 -16.763 3.345 -3.501 1.00 4.35 H new ATOM 0 HH12 ARG A1923 -17.565 1.771 -3.522 1.00 4.35 H new ATOM 0 HH21 ARG A1923 -16.236 0.829 -6.650 1.00 4.26 H new ATOM 0 HH22 ARG A1923 -17.267 0.356 -5.296 1.00 4.26 H new ATOM 607 N LYS A1924 -11.578 8.187 -4.763 1.00 0.68 N ATOM 608 CA LYS A1924 -10.204 8.452 -4.408 1.00 0.67 C ATOM 609 C LYS A1924 -9.661 7.227 -3.737 1.00 0.53 C ATOM 610 O LYS A1924 -10.361 6.583 -2.950 1.00 0.55 O ATOM 611 CB LYS A1924 -10.080 9.622 -3.427 1.00 0.87 C ATOM 612 CG LYS A1924 -10.466 10.972 -3.976 1.00 1.32 C ATOM 613 CD LYS A1924 -9.611 11.354 -5.168 1.00 1.59 C ATOM 614 CE LYS A1924 -9.896 12.776 -5.614 1.00 2.07 C ATOM 615 NZ LYS A1924 -11.321 12.982 -5.931 1.00 2.72 N ATOM 0 H LYS A1924 -12.200 8.102 -3.959 1.00 0.68 H new ATOM 0 HA LYS A1924 -9.656 8.708 -5.315 1.00 0.67 H new ATOM 0 HB2 LYS A1924 -10.702 9.412 -2.557 1.00 0.87 H new ATOM 0 HB3 LYS A1924 -9.049 9.673 -3.077 1.00 0.87 H new ATOM 0 HG2 LYS A1924 -11.516 10.960 -4.269 1.00 1.32 H new ATOM 0 HG3 LYS A1924 -10.362 11.726 -3.196 1.00 1.32 H new ATOM 0 HD2 LYS A1924 -8.557 11.256 -4.909 1.00 1.59 H new ATOM 0 HD3 LYS A1924 -9.803 10.666 -5.992 1.00 1.59 H new ATOM 0 HE2 LYS A1924 -9.596 13.469 -4.828 1.00 2.07 H new ATOM 0 HE3 LYS A1924 -9.292 13.008 -6.491 1.00 2.07 H new ATOM 0 HZ1 LYS A1924 -11.444 13.907 -6.389 1.00 2.72 H new ATOM 0 HZ2 LYS A1924 -11.646 12.231 -6.573 1.00 2.72 H new ATOM 0 HZ3 LYS A1924 -11.879 12.953 -5.054 1.00 2.72 H new ATOM 629 N ILE A1925 -8.453 6.878 -4.026 1.00 0.49 N ATOM 630 CA ILE A1925 -7.872 5.764 -3.358 1.00 0.44 C ATOM 631 C ILE A1925 -7.052 6.289 -2.204 1.00 0.44 C ATOM 632 O ILE A1925 -5.938 6.766 -2.387 1.00 0.51 O ATOM 633 CB ILE A1925 -7.013 4.863 -4.283 1.00 0.51 C ATOM 634 CG1 ILE A1925 -7.853 4.358 -5.463 1.00 0.53 C ATOM 635 CG2 ILE A1925 -6.476 3.677 -3.490 1.00 0.56 C ATOM 636 CD1 ILE A1925 -7.094 3.447 -6.432 1.00 0.64 C ATOM 0 H ILE A1925 -7.855 7.341 -4.711 1.00 0.49 H new ATOM 0 HA ILE A1925 -8.678 5.121 -3.005 1.00 0.44 H new ATOM 0 HB ILE A1925 -6.179 5.449 -4.670 1.00 0.51 H new ATOM 0 HG12 ILE A1925 -8.716 3.817 -5.075 1.00 0.53 H new ATOM 0 HG13 ILE A1925 -8.237 5.216 -6.015 1.00 0.53 H new ATOM 0 HG21 ILE A1925 -5.873 3.046 -4.143 1.00 0.56 H new ATOM 0 HG22 ILE A1925 -5.861 4.039 -2.666 1.00 0.56 H new ATOM 0 HG23 ILE A1925 -7.309 3.097 -3.094 1.00 0.56 H new ATOM 0 HD11 ILE A1925 -7.761 3.135 -7.236 1.00 0.64 H new ATOM 0 HD12 ILE A1925 -6.247 3.989 -6.853 1.00 0.64 H new ATOM 0 HD13 ILE A1925 -6.734 2.568 -5.898 1.00 0.64 H new ATOM 648 N GLU A1926 -7.656 6.282 -1.053 1.00 0.43 N ATOM 649 CA GLU A1926 -7.030 6.738 0.162 1.00 0.48 C ATOM 650 C GLU A1926 -6.436 5.527 0.842 1.00 0.46 C ATOM 651 O GLU A1926 -7.162 4.708 1.402 1.00 0.56 O ATOM 652 CB GLU A1926 -8.081 7.363 1.090 1.00 0.67 C ATOM 653 CG GLU A1926 -7.530 7.982 2.374 1.00 1.40 C ATOM 654 CD GLU A1926 -6.931 9.353 2.167 1.00 1.65 C ATOM 655 OE1 GLU A1926 -7.658 10.357 2.150 1.00 1.95 O ATOM 656 OE2 GLU A1926 -5.692 9.433 1.968 1.00 2.28 O ATOM 0 H GLU A1926 -8.614 5.955 -0.925 1.00 0.43 H new ATOM 0 HA GLU A1926 -6.268 7.485 -0.060 1.00 0.48 H new ATOM 0 HB2 GLU A1926 -8.619 8.133 0.537 1.00 0.67 H new ATOM 0 HB3 GLU A1926 -8.808 6.596 1.358 1.00 0.67 H new ATOM 0 HG2 GLU A1926 -8.332 8.051 3.109 1.00 1.40 H new ATOM 0 HG3 GLU A1926 -6.771 7.321 2.791 1.00 1.40 H new ATOM 663 N LEU A1927 -5.171 5.369 0.744 1.00 0.44 N ATOM 664 CA LEU A1927 -4.522 4.258 1.359 1.00 0.51 C ATOM 665 C LEU A1927 -3.284 4.691 2.071 1.00 0.46 C ATOM 666 O LEU A1927 -2.565 5.551 1.604 1.00 0.61 O ATOM 667 CB LEU A1927 -4.290 3.082 0.360 1.00 0.68 C ATOM 668 CG LEU A1927 -3.686 3.391 -1.035 1.00 0.87 C ATOM 669 CD1 LEU A1927 -2.257 3.889 -0.964 1.00 1.54 C ATOM 670 CD2 LEU A1927 -3.766 2.163 -1.915 1.00 1.48 C ATOM 0 H LEU A1927 -4.550 6.000 0.238 1.00 0.44 H new ATOM 0 HA LEU A1927 -5.191 3.854 2.119 1.00 0.51 H new ATOM 0 HB2 LEU A1927 -3.637 2.359 0.849 1.00 0.68 H new ATOM 0 HB3 LEU A1927 -5.250 2.590 0.202 1.00 0.68 H new ATOM 0 HG LEU A1927 -4.279 4.198 -1.466 1.00 0.87 H new ATOM 0 HD11 LEU A1927 -1.890 4.088 -1.971 1.00 1.54 H new ATOM 0 HD12 LEU A1927 -2.220 4.807 -0.377 1.00 1.54 H new ATOM 0 HD13 LEU A1927 -1.631 3.132 -0.493 1.00 1.54 H new ATOM 0 HD21 LEU A1927 -3.340 2.388 -2.893 1.00 1.48 H new ATOM 0 HD22 LEU A1927 -3.207 1.348 -1.454 1.00 1.48 H new ATOM 0 HD23 LEU A1927 -4.808 1.867 -2.033 1.00 1.48 H new ATOM 682 N ASN A1928 -3.069 4.171 3.211 1.00 0.51 N ATOM 683 CA ASN A1928 -1.896 4.515 3.932 1.00 0.51 C ATOM 684 C ASN A1928 -1.111 3.268 4.160 1.00 0.64 C ATOM 685 O ASN A1928 -1.645 2.252 4.609 1.00 0.81 O ATOM 686 CB ASN A1928 -2.233 5.256 5.222 1.00 0.55 C ATOM 687 CG ASN A1928 -1.036 5.962 5.838 1.00 0.54 C ATOM 688 OD1 ASN A1928 -0.067 6.296 5.153 1.00 0.88 O ATOM 689 ND2 ASN A1928 -1.125 6.268 7.092 1.00 0.80 N ATOM 0 H ASN A1928 -3.685 3.503 3.674 1.00 0.51 H new ATOM 0 HA ASN A1928 -1.285 5.210 3.357 1.00 0.51 H new ATOM 0 HB2 ASN A1928 -3.014 5.989 5.019 1.00 0.55 H new ATOM 0 HB3 ASN A1928 -2.640 4.548 5.944 1.00 0.55 H new ATOM 0 HD21 ASN A1928 -0.380 6.801 7.541 1.00 0.80 H new ATOM 0 HD22 ASN A1928 -1.940 5.977 7.631 1.00 0.80 H new ATOM 696 N VAL A1929 0.121 3.321 3.783 1.00 0.65 N ATOM 697 CA VAL A1929 0.982 2.182 3.803 1.00 0.82 C ATOM 698 C VAL A1929 1.964 2.307 4.938 1.00 0.87 C ATOM 699 O VAL A1929 2.585 3.360 5.112 1.00 1.69 O ATOM 700 CB VAL A1929 1.731 2.048 2.449 1.00 0.99 C ATOM 701 CG1 VAL A1929 2.729 0.913 2.474 1.00 1.51 C ATOM 702 CG2 VAL A1929 0.737 1.845 1.317 1.00 1.73 C ATOM 0 H VAL A1929 0.569 4.173 3.445 1.00 0.65 H new ATOM 0 HA VAL A1929 0.382 1.285 3.952 1.00 0.82 H new ATOM 0 HB VAL A1929 2.283 2.973 2.283 1.00 0.99 H new ATOM 0 HG11 VAL A1929 3.233 0.850 1.510 1.00 1.51 H new ATOM 0 HG12 VAL A1929 3.465 1.093 3.257 1.00 1.51 H new ATOM 0 HG13 VAL A1929 2.209 -0.024 2.673 1.00 1.51 H new ATOM 0 HG21 VAL A1929 1.274 1.752 0.373 1.00 1.73 H new ATOM 0 HG22 VAL A1929 0.161 0.937 1.497 1.00 1.73 H new ATOM 0 HG23 VAL A1929 0.062 2.699 1.268 1.00 1.73 H new ATOM 712 N CYS A1930 2.066 1.244 5.735 1.00 0.74 N ATOM 713 CA CYS A1930 2.976 1.168 6.881 1.00 0.83 C ATOM 714 C CYS A1930 2.516 1.983 8.070 1.00 0.74 C ATOM 715 O CYS A1930 3.190 2.025 9.116 1.00 0.97 O ATOM 716 CB CYS A1930 4.411 1.515 6.501 1.00 1.01 C ATOM 717 SG CYS A1930 5.256 0.242 5.545 1.00 1.20 S ATOM 0 H CYS A1930 1.511 0.398 5.602 1.00 0.74 H new ATOM 0 HA CYS A1930 2.955 0.124 7.194 1.00 0.83 H new ATOM 0 HB2 CYS A1930 4.408 2.442 5.927 1.00 1.01 H new ATOM 0 HB3 CYS A1930 4.979 1.706 7.411 1.00 1.01 H new ATOM 722 N ALA A1931 1.387 2.588 7.926 1.00 0.63 N ATOM 723 CA ALA A1931 0.779 3.377 8.933 1.00 0.65 C ATOM 724 C ALA A1931 -0.696 3.359 8.645 1.00 0.75 C ATOM 725 O ALA A1931 -1.087 3.103 7.513 1.00 1.31 O ATOM 726 CB ALA A1931 1.352 4.796 8.914 1.00 0.62 C ATOM 0 H ALA A1931 0.842 2.542 7.065 1.00 0.63 H new ATOM 0 HA ALA A1931 0.973 2.986 9.932 1.00 0.65 H new ATOM 0 HB1 ALA A1931 0.876 5.391 9.693 1.00 0.62 H new ATOM 0 HB2 ALA A1931 2.426 4.757 9.093 1.00 0.62 H new ATOM 0 HB3 ALA A1931 1.163 5.252 7.942 1.00 0.62 H new ATOM 732 N GLU A1932 -1.492 3.563 9.633 1.00 0.53 N ATOM 733 CA GLU A1932 -2.929 3.505 9.493 1.00 0.58 C ATOM 734 C GLU A1932 -3.482 4.799 8.915 1.00 0.48 C ATOM 735 O GLU A1932 -2.968 5.889 9.203 1.00 0.49 O ATOM 736 CB GLU A1932 -3.628 3.092 10.823 1.00 0.84 C ATOM 737 CG GLU A1932 -3.228 3.864 12.100 1.00 0.82 C ATOM 738 CD GLU A1932 -1.825 3.556 12.591 1.00 1.32 C ATOM 739 OE1 GLU A1932 -0.854 4.222 12.174 1.00 2.07 O ATOM 740 OE2 GLU A1932 -1.666 2.655 13.417 1.00 1.72 O ATOM 0 H GLU A1932 -1.174 3.778 10.578 1.00 0.53 H new ATOM 0 HA GLU A1932 -3.159 2.718 8.775 1.00 0.58 H new ATOM 0 HB2 GLU A1932 -4.704 3.199 10.687 1.00 0.84 H new ATOM 0 HB3 GLU A1932 -3.432 2.033 10.993 1.00 0.84 H new ATOM 0 HG2 GLU A1932 -3.308 4.934 11.906 1.00 0.82 H new ATOM 0 HG3 GLU A1932 -3.939 3.630 12.892 1.00 0.82 H new ATOM 747 N ALA A1933 -4.486 4.682 8.064 1.00 0.51 N ATOM 748 CA ALA A1933 -5.059 5.836 7.404 1.00 0.57 C ATOM 749 C ALA A1933 -6.005 6.554 8.341 1.00 0.59 C ATOM 750 O ALA A1933 -6.928 5.951 8.900 1.00 0.77 O ATOM 751 CB ALA A1933 -5.754 5.433 6.117 1.00 0.74 C ATOM 0 H ALA A1933 -4.921 3.794 7.815 1.00 0.51 H new ATOM 0 HA ALA A1933 -4.256 6.523 7.139 1.00 0.57 H new ATOM 0 HB1 ALA A1933 -6.176 6.317 5.639 1.00 0.74 H new ATOM 0 HB2 ALA A1933 -5.033 4.967 5.445 1.00 0.74 H new ATOM 0 HB3 ALA A1933 -6.552 4.725 6.341 1.00 0.74 H new ATOM 757 N LYS A1934 -5.775 7.825 8.518 1.00 0.62 N ATOM 758 CA LYS A1934 -6.521 8.595 9.485 1.00 0.76 C ATOM 759 C LYS A1934 -7.410 9.642 8.811 1.00 0.88 C ATOM 760 O LYS A1934 -8.357 10.140 9.417 1.00 1.28 O ATOM 761 CB LYS A1934 -5.520 9.263 10.426 1.00 0.98 C ATOM 762 CG LYS A1934 -6.114 9.970 11.633 1.00 1.65 C ATOM 763 CD LYS A1934 -5.016 10.580 12.491 1.00 2.13 C ATOM 764 CE LYS A1934 -4.007 9.529 12.936 1.00 2.78 C ATOM 765 NZ LYS A1934 -2.918 10.110 13.741 1.00 3.10 N ATOM 0 H LYS A1934 -5.073 8.356 8.003 1.00 0.62 H new ATOM 0 HA LYS A1934 -7.185 7.933 10.041 1.00 0.76 H new ATOM 0 HB2 LYS A1934 -4.822 8.505 10.781 1.00 0.98 H new ATOM 0 HB3 LYS A1934 -4.940 9.987 9.854 1.00 0.98 H new ATOM 0 HG2 LYS A1934 -6.800 10.750 11.303 1.00 1.65 H new ATOM 0 HG3 LYS A1934 -6.695 9.263 12.225 1.00 1.65 H new ATOM 0 HD2 LYS A1934 -4.505 11.361 11.929 1.00 2.13 H new ATOM 0 HD3 LYS A1934 -5.458 11.055 13.367 1.00 2.13 H new ATOM 0 HE2 LYS A1934 -4.517 8.761 13.518 1.00 2.78 H new ATOM 0 HE3 LYS A1934 -3.586 9.037 12.059 1.00 2.78 H new ATOM 0 HZ1 LYS A1934 -2.255 9.359 14.022 1.00 3.10 H new ATOM 0 HZ2 LYS A1934 -2.414 10.825 13.178 1.00 3.10 H new ATOM 0 HZ3 LYS A1934 -3.316 10.557 14.592 1.00 3.10 H new ATOM 779 N SER A1935 -7.106 9.971 7.571 1.00 0.93 N ATOM 780 CA SER A1935 -7.839 11.006 6.863 1.00 1.23 C ATOM 781 C SER A1935 -9.270 10.583 6.476 1.00 1.17 C ATOM 782 O SER A1935 -10.233 10.941 7.154 1.00 2.00 O ATOM 783 CB SER A1935 -7.063 11.426 5.646 1.00 1.67 C ATOM 784 OG SER A1935 -5.719 11.714 5.991 1.00 2.17 O ATOM 0 H SER A1935 -6.357 9.538 7.031 1.00 0.93 H new ATOM 0 HA SER A1935 -7.949 11.849 7.546 1.00 1.23 H new ATOM 0 HB2 SER A1935 -7.091 10.634 4.898 1.00 1.67 H new ATOM 0 HB3 SER A1935 -7.526 12.305 5.197 1.00 1.67 H new ATOM 0 HG SER A1935 -5.516 12.646 5.765 1.00 2.17 H new ATOM 790 N SER A1936 -9.410 9.827 5.400 1.00 0.99 N ATOM 791 CA SER A1936 -10.728 9.411 4.955 1.00 1.20 C ATOM 792 C SER A1936 -11.179 8.155 5.697 1.00 0.95 C ATOM 793 O SER A1936 -12.377 7.893 5.841 1.00 1.08 O ATOM 794 CB SER A1936 -10.728 9.195 3.440 1.00 1.80 C ATOM 795 OG SER A1936 -10.311 10.382 2.765 1.00 2.28 O ATOM 0 H SER A1936 -8.637 9.492 4.825 1.00 0.99 H new ATOM 0 HA SER A1936 -11.443 10.201 5.186 1.00 1.20 H new ATOM 0 HB2 SER A1936 -10.062 8.371 3.184 1.00 1.80 H new ATOM 0 HB3 SER A1936 -11.727 8.912 3.107 1.00 1.80 H new ATOM 0 HG SER A1936 -9.353 10.326 2.567 1.00 2.28 H new ATOM 801 N CYS A1937 -10.223 7.409 6.186 1.00 0.87 N ATOM 802 CA CYS A1937 -10.505 6.203 6.920 1.00 0.93 C ATOM 803 C CYS A1937 -10.556 6.571 8.394 1.00 1.22 C ATOM 804 O CYS A1937 -10.169 7.691 8.755 1.00 1.98 O ATOM 805 CB CYS A1937 -9.395 5.188 6.682 1.00 1.06 C ATOM 806 SG CYS A1937 -8.960 4.979 4.928 1.00 1.44 S ATOM 0 H CYS A1937 -9.230 7.619 6.087 1.00 0.87 H new ATOM 0 HA CYS A1937 -11.450 5.765 6.598 1.00 0.93 H new ATOM 0 HB2 CYS A1937 -8.507 5.498 7.233 1.00 1.06 H new ATOM 0 HB3 CYS A1937 -9.702 4.224 7.088 1.00 1.06 H new ATOM 811 N ALA A1938 -11.025 5.683 9.245 1.00 0.97 N ATOM 812 CA ALA A1938 -11.093 6.012 10.646 1.00 1.24 C ATOM 813 C ALA A1938 -9.803 5.730 11.381 1.00 1.13 C ATOM 814 O ALA A1938 -8.949 6.609 11.539 1.00 1.32 O ATOM 815 CB ALA A1938 -12.234 5.302 11.344 1.00 1.48 C ATOM 0 H ALA A1938 -11.357 4.751 8.997 1.00 0.97 H new ATOM 0 HA ALA A1938 -11.272 7.087 10.677 1.00 1.24 H new ATOM 0 HB1 ALA A1938 -12.246 5.581 12.398 1.00 1.48 H new ATOM 0 HB2 ALA A1938 -13.178 5.590 10.882 1.00 1.48 H new ATOM 0 HB3 ALA A1938 -12.100 4.224 11.255 1.00 1.48 H new ATOM 821 N ASN A1939 -9.666 4.510 11.826 1.00 0.94 N ATOM 822 CA ASN A1939 -8.613 4.146 12.679 1.00 0.94 C ATOM 823 C ASN A1939 -7.739 3.026 12.140 1.00 0.69 C ATOM 824 O ASN A1939 -6.587 3.239 11.807 1.00 0.89 O ATOM 825 CB ASN A1939 -9.156 3.835 14.073 1.00 1.19 C ATOM 826 CG ASN A1939 -8.103 3.335 15.023 1.00 1.51 C ATOM 827 OD1 ASN A1939 -7.396 4.117 15.648 1.00 2.13 O ATOM 828 ND2 ASN A1939 -8.036 2.050 15.195 1.00 2.10 N ATOM 0 H ASN A1939 -10.300 3.746 11.592 1.00 0.94 H new ATOM 0 HA ASN A1939 -7.944 5.004 12.742 1.00 0.94 H new ATOM 0 HB2 ASN A1939 -9.612 4.735 14.487 1.00 1.19 H new ATOM 0 HB3 ASN A1939 -9.945 3.088 13.990 1.00 1.19 H new ATOM 0 HD21 ASN A1939 -7.378 1.659 15.869 1.00 2.10 H new ATOM 0 HD22 ASN A1939 -8.641 1.431 14.656 1.00 2.10 H new ATOM 835 N GLY A1940 -8.311 1.852 12.013 1.00 0.57 N ATOM 836 CA GLY A1940 -7.530 0.678 11.711 1.00 0.70 C ATOM 837 C GLY A1940 -7.578 0.259 10.274 1.00 0.61 C ATOM 838 O GLY A1940 -7.127 -0.837 9.934 1.00 0.79 O ATOM 0 H GLY A1940 -9.312 1.685 12.114 1.00 0.57 H new ATOM 0 HA2 GLY A1940 -6.493 0.865 11.988 1.00 0.70 H new ATOM 0 HA3 GLY A1940 -7.882 -0.147 12.330 1.00 0.70 H new ATOM 842 N ALA A1941 -8.126 1.092 9.438 1.00 0.47 N ATOM 843 CA ALA A1941 -8.204 0.806 8.020 1.00 0.46 C ATOM 844 C ALA A1941 -6.949 1.316 7.325 1.00 0.42 C ATOM 845 O ALA A1941 -6.355 2.321 7.754 1.00 0.62 O ATOM 846 CB ALA A1941 -9.449 1.441 7.423 1.00 0.52 C ATOM 0 H ALA A1941 -8.532 1.987 9.710 1.00 0.47 H new ATOM 0 HA ALA A1941 -8.271 -0.272 7.873 1.00 0.46 H new ATOM 0 HB1 ALA A1941 -9.495 1.218 6.357 1.00 0.52 H new ATOM 0 HB2 ALA A1941 -10.334 1.040 7.916 1.00 0.52 H new ATOM 0 HB3 ALA A1941 -9.411 2.521 7.567 1.00 0.52 H new ATOM 852 N ALA A1942 -6.521 0.626 6.292 1.00 0.36 N ATOM 853 CA ALA A1942 -5.336 1.030 5.571 1.00 0.38 C ATOM 854 C ALA A1942 -5.687 1.471 4.177 1.00 0.40 C ATOM 855 O ALA A1942 -5.304 2.550 3.754 1.00 0.49 O ATOM 856 CB ALA A1942 -4.308 -0.087 5.530 1.00 0.44 C ATOM 0 H ALA A1942 -6.974 -0.215 5.933 1.00 0.36 H new ATOM 0 HA ALA A1942 -4.896 1.874 6.103 1.00 0.38 H new ATOM 0 HB1 ALA A1942 -3.428 0.248 4.981 1.00 0.44 H new ATOM 0 HB2 ALA A1942 -4.021 -0.355 6.547 1.00 0.44 H new ATOM 0 HB3 ALA A1942 -4.736 -0.957 5.033 1.00 0.44 H new ATOM 862 N VAL A1943 -6.420 0.638 3.462 1.00 0.41 N ATOM 863 CA VAL A1943 -6.783 0.951 2.098 1.00 0.42 C ATOM 864 C VAL A1943 -8.267 1.219 2.012 1.00 0.39 C ATOM 865 O VAL A1943 -9.084 0.318 2.216 1.00 0.43 O ATOM 866 CB VAL A1943 -6.444 -0.232 1.149 1.00 0.52 C ATOM 867 CG1 VAL A1943 -6.725 0.117 -0.311 1.00 0.73 C ATOM 868 CG2 VAL A1943 -5.006 -0.680 1.330 1.00 0.75 C ATOM 0 H VAL A1943 -6.773 -0.256 3.804 1.00 0.41 H new ATOM 0 HA VAL A1943 -6.218 1.832 1.794 1.00 0.42 H new ATOM 0 HB VAL A1943 -7.097 -1.062 1.419 1.00 0.52 H new ATOM 0 HG11 VAL A1943 -6.475 -0.735 -0.943 1.00 0.73 H new ATOM 0 HG12 VAL A1943 -7.781 0.360 -0.430 1.00 0.73 H new ATOM 0 HG13 VAL A1943 -6.120 0.975 -0.603 1.00 0.73 H new ATOM 0 HG21 VAL A1943 -4.795 -1.509 0.654 1.00 0.75 H new ATOM 0 HG22 VAL A1943 -4.336 0.150 1.107 1.00 0.75 H new ATOM 0 HG23 VAL A1943 -4.853 -1.003 2.360 1.00 0.75 H new ATOM 878 N CYS A1944 -8.616 2.416 1.668 1.00 0.41 N ATOM 879 CA CYS A1944 -9.990 2.780 1.533 1.00 0.49 C ATOM 880 C CYS A1944 -10.242 3.370 0.163 1.00 0.47 C ATOM 881 O CYS A1944 -9.758 4.468 -0.159 1.00 0.54 O ATOM 882 CB CYS A1944 -10.383 3.821 2.579 1.00 0.70 C ATOM 883 SG CYS A1944 -10.033 3.381 4.306 1.00 1.15 S ATOM 0 H CYS A1944 -7.957 3.170 1.472 1.00 0.41 H new ATOM 0 HA CYS A1944 -10.585 1.877 1.672 1.00 0.49 H new ATOM 0 HB2 CYS A1944 -9.865 4.752 2.349 1.00 0.70 H new ATOM 0 HB3 CYS A1944 -11.451 4.018 2.484 1.00 0.70 H new ATOM 888 N ILE A1945 -10.971 2.667 -0.652 1.00 0.46 N ATOM 889 CA ILE A1945 -11.382 3.212 -1.915 1.00 0.49 C ATOM 890 C ILE A1945 -12.550 4.124 -1.557 1.00 0.49 C ATOM 891 O ILE A1945 -13.656 3.673 -1.333 1.00 0.54 O ATOM 892 CB ILE A1945 -11.830 2.102 -2.909 1.00 0.56 C ATOM 893 CG1 ILE A1945 -10.810 0.939 -2.935 1.00 0.54 C ATOM 894 CG2 ILE A1945 -11.972 2.682 -4.305 1.00 0.68 C ATOM 895 CD1 ILE A1945 -9.404 1.323 -3.375 1.00 0.56 C ATOM 0 H ILE A1945 -11.294 1.717 -0.467 1.00 0.46 H new ATOM 0 HA ILE A1945 -10.569 3.736 -2.418 1.00 0.49 H new ATOM 0 HB ILE A1945 -12.792 1.715 -2.574 1.00 0.56 H new ATOM 0 HG12 ILE A1945 -10.755 0.502 -1.938 1.00 0.54 H new ATOM 0 HG13 ILE A1945 -11.184 0.163 -3.603 1.00 0.54 H new ATOM 0 HG21 ILE A1945 -12.286 1.898 -4.994 1.00 0.68 H new ATOM 0 HG22 ILE A1945 -12.718 3.476 -4.295 1.00 0.68 H new ATOM 0 HG23 ILE A1945 -11.014 3.088 -4.629 1.00 0.68 H new ATOM 0 HD11 ILE A1945 -8.764 0.441 -3.360 1.00 0.56 H new ATOM 0 HD12 ILE A1945 -9.437 1.730 -4.386 1.00 0.56 H new ATOM 0 HD13 ILE A1945 -9.002 2.074 -2.695 1.00 0.56 H new ATOM 907 N THR A1946 -12.268 5.370 -1.414 1.00 0.48 N ATOM 908 CA THR A1946 -13.199 6.295 -0.852 1.00 0.51 C ATOM 909 C THR A1946 -13.927 7.090 -1.920 1.00 0.53 C ATOM 910 O THR A1946 -13.325 7.904 -2.611 1.00 0.61 O ATOM 911 CB THR A1946 -12.433 7.235 0.102 1.00 0.61 C ATOM 912 OG1 THR A1946 -11.596 6.427 0.955 1.00 0.91 O ATOM 913 CG2 THR A1946 -13.377 8.037 0.984 1.00 0.79 C ATOM 0 H THR A1946 -11.377 5.785 -1.685 1.00 0.48 H new ATOM 0 HA THR A1946 -13.962 5.741 -0.305 1.00 0.51 H new ATOM 0 HB THR A1946 -11.849 7.933 -0.499 1.00 0.61 H new ATOM 0 HG1 THR A1946 -10.940 5.946 0.409 1.00 0.91 H new ATOM 0 HG21 THR A1946 -12.798 8.686 1.641 1.00 0.79 H new ATOM 0 HG22 THR A1946 -14.032 8.644 0.359 1.00 0.79 H new ATOM 0 HG23 THR A1946 -13.979 7.356 1.586 1.00 0.79 H new ATOM 921 N ASP A1947 -15.197 6.810 -2.075 1.00 0.58 N ATOM 922 CA ASP A1947 -16.050 7.544 -2.977 1.00 0.74 C ATOM 923 C ASP A1947 -16.758 8.629 -2.219 1.00 0.78 C ATOM 924 O ASP A1947 -17.728 8.389 -1.480 1.00 0.77 O ATOM 925 CB ASP A1947 -17.039 6.642 -3.755 1.00 0.91 C ATOM 926 CG ASP A1947 -17.887 5.711 -2.911 1.00 1.21 C ATOM 927 OD1 ASP A1947 -17.395 4.635 -2.523 1.00 1.94 O ATOM 928 OD2 ASP A1947 -19.087 5.985 -2.706 1.00 1.24 O ATOM 0 H ASP A1947 -15.672 6.059 -1.574 1.00 0.58 H new ATOM 0 HA ASP A1947 -15.417 7.993 -3.742 1.00 0.74 H new ATOM 0 HB2 ASP A1947 -17.704 7.281 -4.337 1.00 0.91 H new ATOM 0 HB3 ASP A1947 -16.471 6.042 -4.466 1.00 0.91 H new ATOM 933 N GLY A1948 -16.239 9.817 -2.353 1.00 0.91 N ATOM 934 CA GLY A1948 -16.766 10.942 -1.639 1.00 1.03 C ATOM 935 C GLY A1948 -16.427 10.820 -0.173 1.00 1.03 C ATOM 936 O GLY A1948 -15.246 10.752 0.175 1.00 1.07 O ATOM 0 H GLY A1948 -15.445 10.031 -2.956 1.00 0.91 H new ATOM 0 HA2 GLY A1948 -16.352 11.867 -2.042 1.00 1.03 H new ATOM 0 HA3 GLY A1948 -17.847 10.993 -1.769 1.00 1.03 H new ATOM 940 N PRO A1949 -17.424 10.786 0.713 1.00 1.06 N ATOM 941 CA PRO A1949 -17.200 10.583 2.125 1.00 1.15 C ATOM 942 C PRO A1949 -17.270 9.095 2.518 1.00 1.00 C ATOM 943 O PRO A1949 -16.907 8.721 3.637 1.00 1.12 O ATOM 944 CB PRO A1949 -18.347 11.363 2.779 1.00 1.37 C ATOM 945 CG PRO A1949 -19.408 11.522 1.722 1.00 1.27 C ATOM 946 CD PRO A1949 -18.849 10.998 0.421 1.00 1.09 C ATOM 0 HA PRO A1949 -16.209 10.914 2.435 1.00 1.15 H new ATOM 0 HB2 PRO A1949 -18.738 10.827 3.644 1.00 1.37 H new ATOM 0 HB3 PRO A1949 -18.003 12.335 3.134 1.00 1.37 H new ATOM 0 HG2 PRO A1949 -20.308 10.973 1.999 1.00 1.27 H new ATOM 0 HG3 PRO A1949 -19.692 12.569 1.621 1.00 1.27 H new ATOM 0 HD2 PRO A1949 -19.338 10.072 0.120 1.00 1.09 H new ATOM 0 HD3 PRO A1949 -18.989 11.711 -0.391 1.00 1.09 H new ATOM 954 N LYS A1950 -17.702 8.255 1.590 1.00 0.86 N ATOM 955 CA LYS A1950 -17.872 6.851 1.866 1.00 0.83 C ATOM 956 C LYS A1950 -16.614 6.084 1.533 1.00 0.66 C ATOM 957 O LYS A1950 -16.065 6.219 0.455 1.00 0.71 O ATOM 958 CB LYS A1950 -19.037 6.247 1.079 1.00 0.95 C ATOM 959 CG LYS A1950 -19.192 4.769 1.376 1.00 1.31 C ATOM 960 CD LYS A1950 -20.227 4.086 0.536 1.00 1.91 C ATOM 961 CE LYS A1950 -20.264 2.611 0.886 1.00 2.18 C ATOM 962 NZ LYS A1950 -18.951 1.939 0.659 1.00 2.52 N ATOM 0 H LYS A1950 -17.940 8.530 0.637 1.00 0.86 H new ATOM 0 HA LYS A1950 -18.090 6.768 2.931 1.00 0.83 H new ATOM 0 HB2 LYS A1950 -19.959 6.770 1.331 1.00 0.95 H new ATOM 0 HB3 LYS A1950 -18.871 6.391 0.011 1.00 0.95 H new ATOM 0 HG2 LYS A1950 -18.232 4.275 1.225 1.00 1.31 H new ATOM 0 HG3 LYS A1950 -19.452 4.645 2.427 1.00 1.31 H new ATOM 0 HD2 LYS A1950 -21.205 4.536 0.706 1.00 1.91 H new ATOM 0 HD3 LYS A1950 -19.996 4.215 -0.522 1.00 1.91 H new ATOM 0 HE2 LYS A1950 -20.552 2.495 1.931 1.00 2.18 H new ATOM 0 HE3 LYS A1950 -21.030 2.118 0.288 1.00 2.18 H new ATOM 0 HZ1 LYS A1950 -19.086 0.908 0.647 1.00 2.52 H new ATOM 0 HZ2 LYS A1950 -18.556 2.247 -0.253 1.00 2.52 H new ATOM 0 HZ3 LYS A1950 -18.294 2.193 1.424 1.00 2.52 H new ATOM 976 N THR A1951 -16.174 5.279 2.440 1.00 0.68 N ATOM 977 CA THR A1951 -15.024 4.478 2.211 1.00 0.60 C ATOM 978 C THR A1951 -15.419 3.066 1.783 1.00 0.57 C ATOM 979 O THR A1951 -16.551 2.600 2.040 1.00 0.72 O ATOM 980 CB THR A1951 -14.168 4.389 3.482 1.00 0.73 C ATOM 981 OG1 THR A1951 -14.980 3.935 4.562 1.00 1.05 O ATOM 982 CG2 THR A1951 -13.573 5.733 3.830 1.00 1.07 C ATOM 0 H THR A1951 -16.601 5.159 3.358 1.00 0.68 H new ATOM 0 HA THR A1951 -14.449 4.949 1.413 1.00 0.60 H new ATOM 0 HB THR A1951 -13.352 3.689 3.304 1.00 0.73 H new ATOM 0 HG1 THR A1951 -14.438 3.875 5.376 1.00 1.05 H new ATOM 0 HG21 THR A1951 -12.971 5.641 4.734 1.00 1.07 H new ATOM 0 HG22 THR A1951 -12.944 6.076 3.009 1.00 1.07 H new ATOM 0 HG23 THR A1951 -14.374 6.453 3.998 1.00 1.07 H new ATOM 990 N LEU A1952 -14.538 2.437 1.074 1.00 0.52 N ATOM 991 CA LEU A1952 -14.625 1.044 0.755 1.00 0.52 C ATOM 992 C LEU A1952 -13.315 0.438 1.213 1.00 0.47 C ATOM 993 O LEU A1952 -12.295 0.564 0.531 1.00 0.52 O ATOM 994 CB LEU A1952 -14.823 0.840 -0.761 1.00 0.57 C ATOM 995 CG LEU A1952 -14.905 -0.603 -1.266 1.00 0.63 C ATOM 996 CD1 LEU A1952 -16.121 -1.313 -0.698 1.00 1.14 C ATOM 997 CD2 LEU A1952 -14.931 -0.634 -2.783 1.00 1.15 C ATOM 0 H LEU A1952 -13.711 2.891 0.687 1.00 0.52 H new ATOM 0 HA LEU A1952 -15.478 0.573 1.244 1.00 0.52 H new ATOM 0 HB2 LEU A1952 -15.738 1.354 -1.055 1.00 0.57 H new ATOM 0 HB3 LEU A1952 -14.001 1.333 -1.279 1.00 0.57 H new ATOM 0 HG LEU A1952 -14.016 -1.132 -0.922 1.00 0.63 H new ATOM 0 HD11 LEU A1952 -16.154 -2.336 -1.074 1.00 1.14 H new ATOM 0 HD12 LEU A1952 -16.058 -1.328 0.390 1.00 1.14 H new ATOM 0 HD13 LEU A1952 -17.025 -0.786 -1.002 1.00 1.14 H new ATOM 0 HD21 LEU A1952 -14.989 -1.667 -3.125 1.00 1.15 H new ATOM 0 HD22 LEU A1952 -15.800 -0.083 -3.143 1.00 1.15 H new ATOM 0 HD23 LEU A1952 -14.023 -0.174 -3.172 1.00 1.15 H new ATOM 1009 N ASN A1953 -13.318 -0.112 2.403 1.00 0.48 N ATOM 1010 CA ASN A1953 -12.099 -0.648 2.983 1.00 0.45 C ATOM 1011 C ASN A1953 -11.745 -1.970 2.341 1.00 0.46 C ATOM 1012 O ASN A1953 -12.502 -2.937 2.428 1.00 0.64 O ATOM 1013 CB ASN A1953 -12.208 -0.790 4.516 1.00 0.59 C ATOM 1014 CG ASN A1953 -10.915 -1.302 5.148 1.00 1.20 C ATOM 1015 OD1 ASN A1953 -9.835 -1.074 4.642 1.00 1.86 O ATOM 1016 ND2 ASN A1953 -11.014 -1.959 6.268 1.00 1.93 N ATOM 0 H ASN A1953 -14.146 -0.203 2.992 1.00 0.48 H new ATOM 0 HA ASN A1953 -11.296 0.062 2.782 1.00 0.45 H new ATOM 0 HB2 ASN A1953 -12.463 0.177 4.950 1.00 0.59 H new ATOM 0 HB3 ASN A1953 -13.022 -1.473 4.758 1.00 0.59 H new ATOM 0 HD21 ASN A1953 -10.173 -2.294 6.739 1.00 1.93 H new ATOM 0 HD22 ASN A1953 -11.932 -2.139 6.674 1.00 1.93 H new ATOM 1023 N ALA A1954 -10.618 -1.999 1.693 1.00 0.43 N ATOM 1024 CA ALA A1954 -10.162 -3.185 1.004 1.00 0.58 C ATOM 1025 C ALA A1954 -9.222 -3.984 1.888 1.00 0.70 C ATOM 1026 O ALA A1954 -9.051 -5.200 1.704 1.00 1.17 O ATOM 1027 CB ALA A1954 -9.477 -2.806 -0.302 1.00 0.69 C ATOM 0 H ALA A1954 -9.983 -1.204 1.623 1.00 0.43 H new ATOM 0 HA ALA A1954 -11.026 -3.808 0.773 1.00 0.58 H new ATOM 0 HB1 ALA A1954 -9.138 -3.709 -0.811 1.00 0.69 H new ATOM 0 HB2 ALA A1954 -10.181 -2.272 -0.940 1.00 0.69 H new ATOM 0 HB3 ALA A1954 -8.621 -2.166 -0.091 1.00 0.69 H new ATOM 1033 N GLY A1955 -8.641 -3.315 2.862 1.00 0.42 N ATOM 1034 CA GLY A1955 -7.705 -3.956 3.721 1.00 0.51 C ATOM 1035 C GLY A1955 -7.379 -3.113 4.910 1.00 0.43 C ATOM 1036 O GLY A1955 -7.087 -1.907 4.777 1.00 0.47 O ATOM 0 H GLY A1955 -8.809 -2.330 3.067 1.00 0.42 H new ATOM 0 HA2 GLY A1955 -8.111 -4.912 4.053 1.00 0.51 H new ATOM 0 HA3 GLY A1955 -6.792 -4.173 3.167 1.00 0.51 H new ATOM 1040 N LYS A1956 -7.429 -3.717 6.065 1.00 0.43 N ATOM 1041 CA LYS A1956 -7.158 -3.033 7.293 1.00 0.45 C ATOM 1042 C LYS A1956 -5.654 -2.940 7.503 1.00 0.38 C ATOM 1043 O LYS A1956 -4.878 -3.646 6.845 1.00 0.40 O ATOM 1044 CB LYS A1956 -7.846 -3.759 8.448 1.00 0.61 C ATOM 1045 CG LYS A1956 -7.242 -5.109 8.817 1.00 0.70 C ATOM 1046 CD LYS A1956 -8.275 -6.019 9.461 1.00 0.97 C ATOM 1047 CE LYS A1956 -9.037 -5.346 10.587 1.00 1.54 C ATOM 1048 NZ LYS A1956 -10.180 -6.168 11.022 1.00 2.43 N ATOM 0 H LYS A1956 -7.661 -4.704 6.178 1.00 0.43 H new ATOM 0 HA LYS A1956 -7.555 -2.019 7.252 1.00 0.45 H new ATOM 0 HB2 LYS A1956 -7.821 -3.115 9.327 1.00 0.61 H new ATOM 0 HB3 LYS A1956 -8.895 -3.906 8.190 1.00 0.61 H new ATOM 0 HG2 LYS A1956 -6.840 -5.587 7.923 1.00 0.70 H new ATOM 0 HG3 LYS A1956 -6.407 -4.961 9.502 1.00 0.70 H new ATOM 0 HD2 LYS A1956 -8.981 -6.353 8.701 1.00 0.97 H new ATOM 0 HD3 LYS A1956 -7.777 -6.909 9.847 1.00 0.97 H new ATOM 0 HE2 LYS A1956 -8.368 -5.173 11.430 1.00 1.54 H new ATOM 0 HE3 LYS A1956 -9.392 -4.370 10.257 1.00 1.54 H new ATOM 0 HZ1 LYS A1956 -10.986 -5.550 11.247 1.00 2.43 H new ATOM 0 HZ2 LYS A1956 -10.447 -6.822 10.259 1.00 2.43 H new ATOM 0 HZ3 LYS A1956 -9.914 -6.712 11.868 1.00 2.43 H new ATOM 1062 N LEU A1957 -5.251 -2.089 8.401 1.00 0.42 N ATOM 1063 CA LEU A1957 -3.866 -1.832 8.629 1.00 0.45 C ATOM 1064 C LEU A1957 -3.182 -2.990 9.336 1.00 0.45 C ATOM 1065 O LEU A1957 -3.542 -3.375 10.454 1.00 0.53 O ATOM 1066 CB LEU A1957 -3.677 -0.470 9.361 1.00 0.57 C ATOM 1067 CG LEU A1957 -2.229 0.047 9.613 1.00 0.77 C ATOM 1068 CD1 LEU A1957 -1.556 -0.648 10.787 1.00 1.24 C ATOM 1069 CD2 LEU A1957 -1.377 -0.092 8.356 1.00 1.30 C ATOM 0 H LEU A1957 -5.881 -1.552 8.997 1.00 0.42 H new ATOM 0 HA LEU A1957 -3.369 -1.747 7.663 1.00 0.45 H new ATOM 0 HB2 LEU A1957 -4.205 0.291 8.786 1.00 0.57 H new ATOM 0 HB3 LEU A1957 -4.176 -0.542 10.328 1.00 0.57 H new ATOM 0 HG LEU A1957 -2.315 1.103 9.870 1.00 0.77 H new ATOM 0 HD11 LEU A1957 -0.550 -0.249 10.918 1.00 1.24 H new ATOM 0 HD12 LEU A1957 -2.136 -0.474 11.694 1.00 1.24 H new ATOM 0 HD13 LEU A1957 -1.500 -1.719 10.592 1.00 1.24 H new ATOM 0 HD21 LEU A1957 -0.370 0.275 8.556 1.00 1.30 H new ATOM 0 HD22 LEU A1957 -1.329 -1.141 8.063 1.00 1.30 H new ATOM 0 HD23 LEU A1957 -1.822 0.490 7.549 1.00 1.30 H new ATOM 1081 N SER A1958 -2.250 -3.550 8.643 1.00 0.56 N ATOM 1082 CA SER A1958 -1.360 -4.532 9.145 1.00 0.67 C ATOM 1083 C SER A1958 0.024 -3.891 9.006 1.00 0.65 C ATOM 1084 O SER A1958 0.523 -3.710 7.894 1.00 0.84 O ATOM 1085 CB SER A1958 -1.481 -5.824 8.300 1.00 0.96 C ATOM 1086 OG SER A1958 -0.766 -6.913 8.875 1.00 1.62 O ATOM 0 H SER A1958 -2.083 -3.322 7.663 1.00 0.56 H new ATOM 0 HA SER A1958 -1.566 -4.820 10.176 1.00 0.67 H new ATOM 0 HB2 SER A1958 -2.532 -6.094 8.201 1.00 0.96 H new ATOM 0 HB3 SER A1958 -1.104 -5.635 7.295 1.00 0.96 H new ATOM 0 HG SER A1958 -0.871 -7.707 8.311 1.00 1.62 H new ATOM 1092 N LYS A1959 0.619 -3.497 10.113 1.00 0.59 N ATOM 1093 CA LYS A1959 1.856 -2.714 10.099 1.00 0.71 C ATOM 1094 C LYS A1959 3.096 -3.615 9.980 1.00 0.76 C ATOM 1095 O LYS A1959 4.128 -3.415 10.634 1.00 1.04 O ATOM 1096 CB LYS A1959 1.880 -1.828 11.346 1.00 0.86 C ATOM 1097 CG LYS A1959 2.883 -0.678 11.313 1.00 0.96 C ATOM 1098 CD LYS A1959 2.638 0.316 12.464 1.00 1.10 C ATOM 1099 CE LYS A1959 1.265 1.012 12.341 1.00 0.98 C ATOM 1100 NZ LYS A1959 1.001 1.961 13.440 1.00 1.48 N ATOM 0 H LYS A1959 0.268 -3.705 11.048 1.00 0.59 H new ATOM 0 HA LYS A1959 1.883 -2.074 9.217 1.00 0.71 H new ATOM 0 HB2 LYS A1959 0.883 -1.414 11.496 1.00 0.86 H new ATOM 0 HB3 LYS A1959 2.099 -2.454 12.211 1.00 0.86 H new ATOM 0 HG2 LYS A1959 3.896 -1.075 11.383 1.00 0.96 H new ATOM 0 HG3 LYS A1959 2.810 -0.157 10.359 1.00 0.96 H new ATOM 0 HD2 LYS A1959 2.694 -0.211 13.417 1.00 1.10 H new ATOM 0 HD3 LYS A1959 3.427 1.068 12.469 1.00 1.10 H new ATOM 0 HE2 LYS A1959 1.216 1.543 11.390 1.00 0.98 H new ATOM 0 HE3 LYS A1959 0.480 0.256 12.325 1.00 0.98 H new ATOM 0 HZ1 LYS A1959 0.142 2.507 13.228 1.00 1.48 H new ATOM 0 HZ2 LYS A1959 0.867 1.436 14.328 1.00 1.48 H new ATOM 0 HZ3 LYS A1959 1.808 2.610 13.540 1.00 1.48 H new ATOM 1114 N THR A1960 2.994 -4.538 9.089 1.00 0.74 N ATOM 1115 CA THR A1960 4.025 -5.444 8.777 1.00 0.81 C ATOM 1116 C THR A1960 4.445 -5.130 7.348 1.00 0.77 C ATOM 1117 O THR A1960 3.666 -4.545 6.619 1.00 1.05 O ATOM 1118 CB THR A1960 3.523 -6.924 8.911 1.00 0.92 C ATOM 1119 OG1 THR A1960 4.616 -7.840 8.783 1.00 1.63 O ATOM 1120 CG2 THR A1960 2.452 -7.262 7.873 1.00 1.27 C ATOM 0 H THR A1960 2.148 -4.682 8.537 1.00 0.74 H new ATOM 0 HA THR A1960 4.867 -5.343 9.462 1.00 0.81 H new ATOM 0 HB THR A1960 3.078 -7.020 9.902 1.00 0.92 H new ATOM 0 HG1 THR A1960 4.285 -8.758 8.871 1.00 1.63 H new ATOM 0 HG21 THR A1960 2.133 -8.296 8.003 1.00 1.27 H new ATOM 0 HG22 THR A1960 1.596 -6.600 8.004 1.00 1.27 H new ATOM 0 HG23 THR A1960 2.862 -7.131 6.871 1.00 1.27 H new ATOM 1128 N LEU A1961 5.659 -5.432 6.993 1.00 0.55 N ATOM 1129 CA LEU A1961 6.158 -5.216 5.655 1.00 0.51 C ATOM 1130 C LEU A1961 6.929 -6.449 5.289 1.00 0.51 C ATOM 1131 O LEU A1961 7.579 -7.045 6.173 1.00 0.58 O ATOM 1132 CB LEU A1961 7.075 -3.982 5.597 1.00 0.62 C ATOM 1133 CG LEU A1961 7.590 -3.577 4.202 1.00 0.71 C ATOM 1134 CD1 LEU A1961 6.454 -3.173 3.294 1.00 1.35 C ATOM 1135 CD2 LEU A1961 8.604 -2.460 4.294 1.00 1.32 C ATOM 0 H LEU A1961 6.344 -5.841 7.628 1.00 0.55 H new ATOM 0 HA LEU A1961 5.336 -5.034 4.962 1.00 0.51 H new ATOM 0 HB2 LEU A1961 6.536 -3.135 6.021 1.00 0.62 H new ATOM 0 HB3 LEU A1961 7.936 -4.166 6.239 1.00 0.62 H new ATOM 0 HG LEU A1961 8.079 -4.452 3.773 1.00 0.71 H new ATOM 0 HD11 LEU A1961 6.850 -2.893 2.318 1.00 1.35 H new ATOM 0 HD12 LEU A1961 5.765 -4.010 3.179 1.00 1.35 H new ATOM 0 HD13 LEU A1961 5.926 -2.324 3.728 1.00 1.35 H new ATOM 0 HD21 LEU A1961 8.948 -2.197 3.294 1.00 1.32 H new ATOM 0 HD22 LEU A1961 8.144 -1.589 4.760 1.00 1.32 H new ATOM 0 HD23 LEU A1961 9.452 -2.787 4.895 1.00 1.32 H new ATOM 1147 N THR A1962 6.867 -6.882 4.047 1.00 0.51 N ATOM 1148 CA THR A1962 7.552 -8.085 3.707 1.00 0.58 C ATOM 1149 C THR A1962 8.054 -8.064 2.259 1.00 0.51 C ATOM 1150 O THR A1962 7.807 -7.125 1.528 1.00 0.72 O ATOM 1151 CB THR A1962 6.671 -9.323 4.049 1.00 0.72 C ATOM 1152 OG1 THR A1962 7.292 -10.563 3.690 1.00 1.19 O ATOM 1153 CG2 THR A1962 5.275 -9.207 3.467 1.00 0.61 C ATOM 0 H THR A1962 6.363 -6.427 3.286 1.00 0.51 H new ATOM 0 HA THR A1962 8.452 -8.164 4.317 1.00 0.58 H new ATOM 0 HB THR A1962 6.571 -9.330 5.134 1.00 0.72 H new ATOM 0 HG1 THR A1962 6.699 -11.306 3.927 1.00 1.19 H new ATOM 0 HG21 THR A1962 4.696 -10.092 3.731 1.00 0.61 H new ATOM 0 HG22 THR A1962 4.785 -8.320 3.870 1.00 0.61 H new ATOM 0 HG23 THR A1962 5.339 -9.125 2.382 1.00 0.61 H new ATOM 1161 N TYR A1963 8.758 -9.086 1.875 1.00 0.47 N ATOM 1162 CA TYR A1963 9.393 -9.179 0.585 1.00 0.48 C ATOM 1163 C TYR A1963 9.177 -10.566 0.044 1.00 0.55 C ATOM 1164 O TYR A1963 8.967 -11.506 0.816 1.00 0.75 O ATOM 1165 CB TYR A1963 10.917 -8.900 0.704 1.00 0.62 C ATOM 1166 CG TYR A1963 11.628 -9.832 1.677 1.00 0.78 C ATOM 1167 CD1 TYR A1963 12.154 -11.054 1.263 1.00 1.03 C ATOM 1168 CD2 TYR A1963 11.728 -9.506 3.013 1.00 0.78 C ATOM 1169 CE1 TYR A1963 12.746 -11.911 2.163 1.00 1.27 C ATOM 1170 CE2 TYR A1963 12.329 -10.351 3.912 1.00 1.01 C ATOM 1171 CZ TYR A1963 12.831 -11.550 3.488 1.00 1.25 C ATOM 1172 OH TYR A1963 13.393 -12.407 4.404 1.00 1.52 O ATOM 0 H TYR A1963 8.914 -9.904 2.464 1.00 0.47 H new ATOM 0 HA TYR A1963 8.959 -8.437 -0.085 1.00 0.48 H new ATOM 0 HB2 TYR A1963 11.375 -8.997 -0.281 1.00 0.62 H new ATOM 0 HB3 TYR A1963 11.066 -7.869 1.025 1.00 0.62 H new ATOM 0 HD1 TYR A1963 12.096 -11.333 0.221 1.00 1.03 H new ATOM 0 HD2 TYR A1963 11.325 -8.566 3.359 1.00 0.78 H new ATOM 0 HE1 TYR A1963 13.141 -12.860 1.831 1.00 1.27 H new ATOM 0 HE2 TYR A1963 12.405 -10.070 4.952 1.00 1.01 H new ATOM 0 HH TYR A1963 13.374 -11.994 5.293 1.00 1.52 H new ATOM 1182 N GLU A1964 9.191 -10.687 -1.236 1.00 0.54 N ATOM 1183 CA GLU A1964 9.081 -11.955 -1.902 1.00 0.70 C ATOM 1184 C GLU A1964 9.683 -11.754 -3.263 1.00 0.80 C ATOM 1185 O GLU A1964 9.275 -10.846 -3.949 1.00 0.78 O ATOM 1186 CB GLU A1964 7.600 -12.368 -2.005 1.00 0.87 C ATOM 1187 CG GLU A1964 7.351 -13.713 -2.664 1.00 1.25 C ATOM 1188 CD GLU A1964 5.883 -14.055 -2.715 1.00 1.87 C ATOM 1189 OE1 GLU A1964 5.144 -13.401 -3.452 1.00 2.75 O ATOM 1190 OE2 GLU A1964 5.437 -14.981 -1.990 1.00 2.22 O ATOM 0 H GLU A1964 9.281 -9.895 -1.872 1.00 0.54 H new ATOM 0 HA GLU A1964 9.595 -12.750 -1.361 1.00 0.70 H new ATOM 0 HB2 GLU A1964 7.174 -12.388 -1.002 1.00 0.87 H new ATOM 0 HB3 GLU A1964 7.063 -11.602 -2.564 1.00 0.87 H new ATOM 0 HG2 GLU A1964 7.756 -13.701 -3.676 1.00 1.25 H new ATOM 0 HG3 GLU A1964 7.885 -14.489 -2.116 1.00 1.25 H new ATOM 1197 N ASP A1965 10.723 -12.528 -3.600 1.00 1.04 N ATOM 1198 CA ASP A1965 11.441 -12.399 -4.912 1.00 1.25 C ATOM 1199 C ASP A1965 12.238 -11.105 -4.952 1.00 1.07 C ATOM 1200 O ASP A1965 12.521 -10.570 -6.024 1.00 1.08 O ATOM 1201 CB ASP A1965 10.478 -12.432 -6.133 1.00 1.46 C ATOM 1202 CG ASP A1965 9.871 -13.772 -6.419 1.00 2.18 C ATOM 1203 OD1 ASP A1965 10.467 -14.579 -7.156 1.00 2.64 O ATOM 1204 OD2 ASP A1965 8.791 -14.064 -5.870 1.00 2.74 O ATOM 0 H ASP A1965 11.100 -13.256 -2.993 1.00 1.04 H new ATOM 0 HA ASP A1965 12.105 -13.261 -4.985 1.00 1.25 H new ATOM 0 HB2 ASP A1965 9.676 -11.714 -5.964 1.00 1.46 H new ATOM 0 HB3 ASP A1965 11.023 -12.100 -7.017 1.00 1.46 H new ATOM 1209 N GLN A1966 12.615 -10.625 -3.772 1.00 1.03 N ATOM 1210 CA GLN A1966 13.329 -9.346 -3.568 1.00 1.04 C ATOM 1211 C GLN A1966 12.464 -8.103 -3.817 1.00 0.84 C ATOM 1212 O GLN A1966 12.857 -7.004 -3.438 1.00 1.05 O ATOM 1213 CB GLN A1966 14.693 -9.245 -4.293 1.00 1.33 C ATOM 1214 CG GLN A1966 15.767 -10.169 -3.735 1.00 1.71 C ATOM 1215 CD GLN A1966 17.141 -9.899 -4.325 1.00 2.12 C ATOM 1216 OE1 GLN A1966 17.908 -9.079 -3.804 1.00 2.66 O ATOM 1217 NE2 GLN A1966 17.482 -10.583 -5.372 1.00 2.40 N ATOM 0 H GLN A1966 12.433 -11.120 -2.899 1.00 1.03 H new ATOM 0 HA GLN A1966 13.558 -9.360 -2.502 1.00 1.04 H new ATOM 0 HB2 GLN A1966 14.548 -9.471 -5.349 1.00 1.33 H new ATOM 0 HB3 GLN A1966 15.048 -8.216 -4.233 1.00 1.33 H new ATOM 0 HG2 GLN A1966 15.813 -10.053 -2.652 1.00 1.71 H new ATOM 0 HG3 GLN A1966 15.488 -11.204 -3.934 1.00 1.71 H new ATOM 0 HE21 GLN A1966 16.828 -11.252 -5.779 1.00 2.40 H new ATOM 0 HE22 GLN A1966 18.404 -10.452 -5.788 1.00 2.40 H new ATOM 1226 N VAL A1967 11.303 -8.272 -4.431 1.00 0.60 N ATOM 1227 CA VAL A1967 10.379 -7.169 -4.603 1.00 0.49 C ATOM 1228 C VAL A1967 9.606 -7.004 -3.296 1.00 0.41 C ATOM 1229 O VAL A1967 9.332 -8.006 -2.591 1.00 0.41 O ATOM 1230 CB VAL A1967 9.431 -7.347 -5.866 1.00 0.52 C ATOM 1231 CG1 VAL A1967 8.628 -8.619 -5.830 1.00 1.01 C ATOM 1232 CG2 VAL A1967 8.507 -6.163 -6.064 1.00 1.06 C ATOM 0 H VAL A1967 10.982 -9.160 -4.816 1.00 0.60 H new ATOM 0 HA VAL A1967 10.934 -6.256 -4.817 1.00 0.49 H new ATOM 0 HB VAL A1967 10.108 -7.407 -6.718 1.00 0.52 H new ATOM 0 HG11 VAL A1967 8.002 -8.679 -6.720 1.00 1.01 H new ATOM 0 HG12 VAL A1967 9.303 -9.475 -5.802 1.00 1.01 H new ATOM 0 HG13 VAL A1967 7.997 -8.626 -4.941 1.00 1.01 H new ATOM 0 HG21 VAL A1967 7.880 -6.333 -6.939 1.00 1.06 H new ATOM 0 HG22 VAL A1967 7.876 -6.043 -5.183 1.00 1.06 H new ATOM 0 HG23 VAL A1967 9.099 -5.260 -6.212 1.00 1.06 H new ATOM 1242 N LEU A1968 9.299 -5.780 -2.938 1.00 0.41 N ATOM 1243 CA LEU A1968 8.681 -5.512 -1.663 1.00 0.38 C ATOM 1244 C LEU A1968 7.190 -5.746 -1.783 1.00 0.37 C ATOM 1245 O LEU A1968 6.571 -5.324 -2.761 1.00 0.49 O ATOM 1246 CB LEU A1968 8.986 -4.075 -1.250 1.00 0.42 C ATOM 1247 CG LEU A1968 8.612 -3.670 0.167 1.00 0.43 C ATOM 1248 CD1 LEU A1968 9.375 -4.512 1.159 1.00 0.47 C ATOM 1249 CD2 LEU A1968 8.925 -2.209 0.391 1.00 0.50 C ATOM 0 H LEU A1968 9.467 -4.954 -3.512 1.00 0.41 H new ATOM 0 HA LEU A1968 9.076 -6.178 -0.896 1.00 0.38 H new ATOM 0 HB2 LEU A1968 10.055 -3.905 -1.380 1.00 0.42 H new ATOM 0 HB3 LEU A1968 8.470 -3.407 -1.940 1.00 0.42 H new ATOM 0 HG LEU A1968 7.543 -3.829 0.308 1.00 0.43 H new ATOM 0 HD11 LEU A1968 9.103 -4.217 2.172 1.00 0.47 H new ATOM 0 HD12 LEU A1968 9.129 -5.563 1.009 1.00 0.47 H new ATOM 0 HD13 LEU A1968 10.445 -4.365 1.014 1.00 0.47 H new ATOM 0 HD21 LEU A1968 8.653 -1.931 1.409 1.00 0.50 H new ATOM 0 HD22 LEU A1968 9.991 -2.038 0.241 1.00 0.50 H new ATOM 0 HD23 LEU A1968 8.357 -1.603 -0.315 1.00 0.50 H new ATOM 1261 N LYS A1969 6.611 -6.433 -0.832 1.00 0.33 N ATOM 1262 CA LYS A1969 5.219 -6.767 -0.921 1.00 0.36 C ATOM 1263 C LYS A1969 4.462 -6.516 0.360 1.00 0.34 C ATOM 1264 O LYS A1969 5.011 -6.617 1.497 1.00 0.36 O ATOM 1265 CB LYS A1969 4.994 -8.219 -1.379 1.00 0.47 C ATOM 1266 CG LYS A1969 5.495 -8.520 -2.786 1.00 0.73 C ATOM 1267 CD LYS A1969 5.029 -9.882 -3.264 1.00 1.19 C ATOM 1268 CE LYS A1969 5.566 -10.182 -4.651 1.00 1.19 C ATOM 1269 NZ LYS A1969 5.032 -11.442 -5.192 1.00 1.29 N ATOM 0 H LYS A1969 7.082 -6.769 0.008 1.00 0.33 H new ATOM 0 HA LYS A1969 4.820 -6.094 -1.680 1.00 0.36 H new ATOM 0 HB2 LYS A1969 5.491 -8.889 -0.678 1.00 0.47 H new ATOM 0 HB3 LYS A1969 3.928 -8.441 -1.331 1.00 0.47 H new ATOM 0 HG2 LYS A1969 5.139 -7.751 -3.472 1.00 0.73 H new ATOM 0 HG3 LYS A1969 6.584 -8.481 -2.801 1.00 0.73 H new ATOM 0 HD2 LYS A1969 5.363 -10.650 -2.567 1.00 1.19 H new ATOM 0 HD3 LYS A1969 3.940 -9.914 -3.277 1.00 1.19 H new ATOM 0 HE2 LYS A1969 5.311 -9.363 -5.323 1.00 1.19 H new ATOM 0 HE3 LYS A1969 6.654 -10.236 -4.614 1.00 1.19 H new ATOM 0 HZ1 LYS A1969 5.717 -11.852 -5.858 1.00 1.29 H new ATOM 0 HZ2 LYS A1969 4.864 -12.110 -4.413 1.00 1.29 H new ATOM 0 HZ3 LYS A1969 4.137 -11.255 -5.688 1.00 1.29 H new ATOM 1283 N LEU A1970 3.210 -6.169 0.159 1.00 0.42 N ATOM 1284 CA LEU A1970 2.237 -5.988 1.194 1.00 0.49 C ATOM 1285 C LEU A1970 0.919 -6.516 0.749 1.00 0.46 C ATOM 1286 O LEU A1970 0.581 -6.450 -0.438 1.00 0.57 O ATOM 1287 CB LEU A1970 2.073 -4.531 1.604 1.00 0.60 C ATOM 1288 CG LEU A1970 3.162 -3.972 2.474 1.00 0.91 C ATOM 1289 CD1 LEU A1970 2.858 -2.543 2.850 1.00 1.11 C ATOM 1290 CD2 LEU A1970 3.293 -4.818 3.707 1.00 1.75 C ATOM 0 H LEU A1970 2.834 -6.000 -0.774 1.00 0.42 H new ATOM 0 HA LEU A1970 2.600 -6.537 2.063 1.00 0.49 H new ATOM 0 HB2 LEU A1970 2.007 -3.924 0.701 1.00 0.60 H new ATOM 0 HB3 LEU A1970 1.124 -4.425 2.129 1.00 0.60 H new ATOM 0 HG LEU A1970 4.103 -3.985 1.923 1.00 0.91 H new ATOM 0 HD11 LEU A1970 3.658 -2.155 3.480 1.00 1.11 H new ATOM 0 HD12 LEU A1970 2.781 -1.938 1.947 1.00 1.11 H new ATOM 0 HD13 LEU A1970 1.915 -2.503 3.395 1.00 1.11 H new ATOM 0 HD21 LEU A1970 4.083 -4.416 4.342 1.00 1.75 H new ATOM 0 HD22 LEU A1970 2.350 -4.813 4.254 1.00 1.75 H new ATOM 0 HD23 LEU A1970 3.542 -5.840 3.422 1.00 1.75 H new ATOM 1302 N VAL A1971 0.200 -7.064 1.684 1.00 0.46 N ATOM 1303 CA VAL A1971 -1.121 -7.555 1.463 1.00 0.48 C ATOM 1304 C VAL A1971 -2.044 -7.023 2.549 1.00 0.45 C ATOM 1305 O VAL A1971 -2.046 -7.510 3.679 1.00 0.60 O ATOM 1306 CB VAL A1971 -1.193 -9.128 1.374 1.00 0.64 C ATOM 1307 CG1 VAL A1971 -0.582 -9.620 0.075 1.00 0.73 C ATOM 1308 CG2 VAL A1971 -0.475 -9.798 2.549 1.00 0.74 C ATOM 0 H VAL A1971 0.527 -7.183 2.643 1.00 0.46 H new ATOM 0 HA VAL A1971 -1.449 -7.191 0.489 1.00 0.48 H new ATOM 0 HB VAL A1971 -2.248 -9.399 1.411 1.00 0.64 H new ATOM 0 HG11 VAL A1971 -0.642 -10.708 0.034 1.00 0.73 H new ATOM 0 HG12 VAL A1971 -1.127 -9.194 -0.768 1.00 0.73 H new ATOM 0 HG13 VAL A1971 0.462 -9.312 0.025 1.00 0.73 H new ATOM 0 HG21 VAL A1971 -0.548 -10.881 2.450 1.00 0.74 H new ATOM 0 HG22 VAL A1971 0.574 -9.503 2.550 1.00 0.74 H new ATOM 0 HG23 VAL A1971 -0.940 -9.487 3.485 1.00 0.74 H new ATOM 1318 N TYR A1972 -2.756 -5.973 2.252 1.00 0.38 N ATOM 1319 CA TYR A1972 -3.703 -5.475 3.221 1.00 0.39 C ATOM 1320 C TYR A1972 -5.015 -6.192 3.023 1.00 0.45 C ATOM 1321 O TYR A1972 -5.575 -6.184 1.930 1.00 0.55 O ATOM 1322 CB TYR A1972 -3.841 -3.935 3.199 1.00 0.43 C ATOM 1323 CG TYR A1972 -2.615 -3.206 3.731 1.00 0.56 C ATOM 1324 CD1 TYR A1972 -2.253 -3.260 5.074 1.00 0.75 C ATOM 1325 CD2 TYR A1972 -1.813 -2.474 2.877 1.00 0.79 C ATOM 1326 CE1 TYR A1972 -1.124 -2.596 5.538 1.00 0.97 C ATOM 1327 CE2 TYR A1972 -0.695 -1.814 3.329 1.00 0.98 C ATOM 1328 CZ TYR A1972 -0.395 -1.871 4.756 1.00 1.04 C ATOM 1329 OH TYR A1972 0.779 -1.196 5.095 1.00 1.27 O ATOM 0 H TYR A1972 -2.706 -5.455 1.375 1.00 0.38 H new ATOM 0 HA TYR A1972 -3.331 -5.690 4.223 1.00 0.39 H new ATOM 0 HB2 TYR A1972 -4.031 -3.610 2.176 1.00 0.43 H new ATOM 0 HB3 TYR A1972 -4.710 -3.648 3.791 1.00 0.43 H new ATOM 0 HD1 TYR A1972 -2.859 -3.827 5.766 1.00 0.75 H new ATOM 0 HD2 TYR A1972 -2.070 -2.419 1.830 1.00 0.79 H new ATOM 0 HE1 TYR A1972 -0.849 -2.688 6.578 1.00 0.97 H new ATOM 0 HE2 TYR A1972 -0.058 -1.269 2.648 1.00 0.98 H new ATOM 0 HH TYR A1972 1.447 -1.840 5.410 1.00 1.27 H new ATOM 1339 N GLU A1973 -5.471 -6.846 4.051 1.00 0.57 N ATOM 1340 CA GLU A1973 -6.639 -7.691 3.966 1.00 0.73 C ATOM 1341 C GLU A1973 -7.645 -7.368 5.052 1.00 0.58 C ATOM 1342 O GLU A1973 -7.336 -6.605 5.967 1.00 0.57 O ATOM 1343 CB GLU A1973 -6.214 -9.154 4.041 1.00 1.09 C ATOM 1344 CG GLU A1973 -5.310 -9.466 5.220 1.00 1.33 C ATOM 1345 CD GLU A1973 -4.947 -10.916 5.301 1.00 1.89 C ATOM 1346 OE1 GLU A1973 -4.510 -11.491 4.296 1.00 2.75 O ATOM 1347 OE2 GLU A1973 -5.063 -11.510 6.382 1.00 2.17 O ATOM 0 H GLU A1973 -5.046 -6.812 4.978 1.00 0.57 H new ATOM 0 HA GLU A1973 -7.130 -7.505 3.011 1.00 0.73 H new ATOM 0 HB2 GLU A1973 -7.105 -9.779 4.102 1.00 1.09 H new ATOM 0 HB3 GLU A1973 -5.699 -9.422 3.118 1.00 1.09 H new ATOM 0 HG2 GLU A1973 -4.400 -8.871 5.142 1.00 1.33 H new ATOM 0 HG3 GLU A1973 -5.807 -9.168 6.143 1.00 1.33 H new ATOM 1354 N ASP A1974 -8.824 -7.992 4.941 1.00 0.73 N ATOM 1355 CA ASP A1974 -9.989 -7.804 5.839 1.00 0.79 C ATOM 1356 C ASP A1974 -10.464 -6.365 5.869 1.00 0.83 C ATOM 1357 O ASP A1974 -9.855 -5.493 6.481 1.00 1.13 O ATOM 1358 CB ASP A1974 -9.766 -8.334 7.264 1.00 1.03 C ATOM 1359 CG ASP A1974 -11.037 -8.275 8.128 1.00 1.29 C ATOM 1360 OD1 ASP A1974 -11.268 -7.224 8.800 1.00 1.57 O ATOM 1361 OD2 ASP A1974 -11.833 -9.241 8.128 1.00 1.56 O ATOM 0 H ASP A1974 -9.008 -8.668 4.199 1.00 0.73 H new ATOM 0 HA ASP A1974 -10.779 -8.415 5.402 1.00 0.79 H new ATOM 0 HB2 ASP A1974 -9.415 -9.365 7.213 1.00 1.03 H new ATOM 0 HB3 ASP A1974 -8.979 -7.753 7.744 1.00 1.03 H new ATOM 1366 N GLY A1975 -11.529 -6.130 5.187 1.00 1.18 N ATOM 1367 CA GLY A1975 -12.108 -4.835 5.134 1.00 1.43 C ATOM 1368 C GLY A1975 -13.587 -4.961 5.033 1.00 1.27 C ATOM 1369 O GLY A1975 -14.211 -5.603 5.876 1.00 1.57 O ATOM 0 H GLY A1975 -12.027 -6.837 4.646 1.00 1.18 H new ATOM 0 HA2 GLY A1975 -11.840 -4.268 6.025 1.00 1.43 H new ATOM 0 HA3 GLY A1975 -11.719 -4.285 4.277 1.00 1.43 H new ATOM 1373 N ASP A1976 -14.146 -4.417 4.000 1.00 0.96 N ATOM 1374 CA ASP A1976 -15.564 -4.514 3.755 1.00 0.90 C ATOM 1375 C ASP A1976 -15.854 -5.802 2.991 1.00 0.95 C ATOM 1376 O ASP A1976 -15.417 -5.968 1.841 1.00 1.08 O ATOM 1377 CB ASP A1976 -16.066 -3.284 2.986 1.00 0.95 C ATOM 1378 CG ASP A1976 -17.531 -3.370 2.607 1.00 1.57 C ATOM 1379 OD1 ASP A1976 -18.377 -3.549 3.504 1.00 2.24 O ATOM 1380 OD2 ASP A1976 -17.867 -3.320 1.394 1.00 2.08 O ATOM 0 H ASP A1976 -13.635 -3.888 3.293 1.00 0.96 H new ATOM 0 HA ASP A1976 -16.097 -4.542 4.706 1.00 0.90 H new ATOM 0 HB2 ASP A1976 -15.907 -2.394 3.595 1.00 0.95 H new ATOM 0 HB3 ASP A1976 -15.470 -3.162 2.081 1.00 0.95 H new ATOM 1385 N PRO A1977 -16.535 -6.757 3.637 1.00 1.16 N ATOM 1386 CA PRO A1977 -16.847 -8.051 3.044 1.00 1.39 C ATOM 1387 C PRO A1977 -17.871 -7.916 1.938 1.00 1.45 C ATOM 1388 O PRO A1977 -18.707 -7.018 1.955 1.00 1.66 O ATOM 1389 CB PRO A1977 -17.425 -8.868 4.210 1.00 1.68 C ATOM 1390 CG PRO A1977 -17.120 -8.070 5.431 1.00 1.68 C ATOM 1391 CD PRO A1977 -17.091 -6.647 4.986 1.00 1.41 C ATOM 0 HA PRO A1977 -15.972 -8.516 2.590 1.00 1.39 H new ATOM 0 HB2 PRO A1977 -18.499 -9.016 4.094 1.00 1.68 H new ATOM 0 HB3 PRO A1977 -16.971 -9.857 4.262 1.00 1.68 H new ATOM 0 HG2 PRO A1977 -17.878 -8.225 6.199 1.00 1.68 H new ATOM 0 HG3 PRO A1977 -16.164 -8.365 5.863 1.00 1.68 H new ATOM 0 HD2 PRO A1977 -18.086 -6.201 4.981 1.00 1.41 H new ATOM 0 HD3 PRO A1977 -16.468 -6.030 5.634 1.00 1.41 H new ATOM 1399 N CYS A1978 -17.814 -8.795 1.001 1.00 1.46 N ATOM 1400 CA CYS A1978 -18.687 -8.749 -0.130 1.00 1.62 C ATOM 1401 C CYS A1978 -19.232 -10.144 -0.397 1.00 1.87 C ATOM 1402 O CYS A1978 -18.557 -11.123 -0.103 1.00 1.90 O ATOM 1403 CB CYS A1978 -17.904 -8.191 -1.327 1.00 1.58 C ATOM 1404 SG CYS A1978 -16.257 -8.968 -1.574 1.00 1.81 S ATOM 0 H CYS A1978 -17.157 -9.575 0.993 1.00 1.46 H new ATOM 0 HA CYS A1978 -19.539 -8.094 0.053 1.00 1.62 H new ATOM 0 HB2 CYS A1978 -18.497 -8.327 -2.231 1.00 1.58 H new ATOM 0 HB3 CYS A1978 -17.771 -7.118 -1.192 1.00 1.58 H new ATOM 1409 N PRO A1979 -20.471 -10.268 -0.934 1.00 2.20 N ATOM 1410 CA PRO A1979 -21.106 -11.581 -1.214 1.00 2.55 C ATOM 1411 C PRO A1979 -20.405 -12.336 -2.345 1.00 2.56 C ATOM 1412 O PRO A1979 -20.677 -13.509 -2.612 1.00 2.76 O ATOM 1413 CB PRO A1979 -22.537 -11.205 -1.643 1.00 2.93 C ATOM 1414 CG PRO A1979 -22.717 -9.793 -1.202 1.00 2.90 C ATOM 1415 CD PRO A1979 -21.363 -9.160 -1.286 1.00 2.38 C ATOM 0 HA PRO A1979 -21.061 -12.243 -0.349 1.00 2.55 H new ATOM 0 HB2 PRO A1979 -22.663 -11.300 -2.722 1.00 2.93 H new ATOM 0 HB3 PRO A1979 -23.273 -11.860 -1.177 1.00 2.93 H new ATOM 0 HG2 PRO A1979 -23.431 -9.273 -1.840 1.00 2.90 H new ATOM 0 HG3 PRO A1979 -23.106 -9.748 -0.185 1.00 2.90 H new ATOM 0 HD2 PRO A1979 -21.157 -8.775 -2.285 1.00 2.38 H new ATOM 0 HD3 PRO A1979 -21.263 -8.323 -0.595 1.00 2.38 H new ATOM 1423 N THR A1980 -19.540 -11.650 -3.010 1.00 2.44 N ATOM 1424 CA THR A1980 -18.753 -12.153 -4.053 1.00 2.58 C ATOM 1425 C THR A1980 -17.525 -12.887 -3.488 1.00 2.52 C ATOM 1426 O THR A1980 -17.141 -13.966 -3.962 1.00 2.86 O ATOM 1427 CB THR A1980 -18.342 -10.941 -4.854 1.00 2.52 C ATOM 1428 OG1 THR A1980 -18.509 -9.778 -3.999 1.00 2.72 O ATOM 1429 CG2 THR A1980 -19.187 -10.793 -6.099 1.00 2.83 C ATOM 0 H THR A1980 -19.362 -10.664 -2.818 1.00 2.44 H new ATOM 0 HA THR A1980 -19.290 -12.876 -4.667 1.00 2.58 H new ATOM 0 HB THR A1980 -17.306 -11.046 -5.177 1.00 2.52 H new ATOM 0 HG1 THR A1980 -17.689 -9.631 -3.483 1.00 2.72 H new ATOM 0 HG21 THR A1980 -18.866 -9.911 -6.654 1.00 2.83 H new ATOM 0 HG22 THR A1980 -19.071 -11.678 -6.725 1.00 2.83 H new ATOM 0 HG23 THR A1980 -20.234 -10.683 -5.817 1.00 2.83 H new ATOM 1437 N ASP A1981 -16.947 -12.324 -2.455 1.00 2.25 N ATOM 1438 CA ASP A1981 -15.787 -12.901 -1.809 1.00 2.32 C ATOM 1439 C ASP A1981 -16.077 -13.002 -0.322 1.00 2.24 C ATOM 1440 O ASP A1981 -15.612 -12.200 0.500 1.00 2.36 O ATOM 1441 CB ASP A1981 -14.526 -12.068 -2.088 1.00 2.46 C ATOM 1442 CG ASP A1981 -13.244 -12.688 -1.559 1.00 2.87 C ATOM 1443 OD1 ASP A1981 -12.952 -12.521 -0.364 1.00 3.20 O ATOM 1444 OD2 ASP A1981 -12.554 -13.394 -2.326 1.00 3.37 O ATOM 0 H ASP A1981 -17.266 -11.451 -2.036 1.00 2.25 H new ATOM 0 HA ASP A1981 -15.592 -13.896 -2.209 1.00 2.32 H new ATOM 0 HB2 ASP A1981 -14.430 -11.923 -3.164 1.00 2.46 H new ATOM 0 HB3 ASP A1981 -14.650 -11.081 -1.643 1.00 2.46 H new ATOM 1449 N LEU A1982 -16.991 -13.886 -0.012 1.00 2.24 N ATOM 1450 CA LEU A1982 -17.413 -14.108 1.341 1.00 2.35 C ATOM 1451 C LEU A1982 -16.683 -15.293 1.940 1.00 2.41 C ATOM 1452 O LEU A1982 -16.370 -15.314 3.135 1.00 2.56 O ATOM 1453 CB LEU A1982 -18.957 -14.293 1.464 1.00 2.55 C ATOM 1454 CG LEU A1982 -19.612 -15.614 0.959 1.00 2.64 C ATOM 1455 CD1 LEU A1982 -21.039 -15.704 1.450 1.00 2.83 C ATOM 1456 CD2 LEU A1982 -19.610 -15.751 -0.561 1.00 2.91 C ATOM 0 H LEU A1982 -17.464 -14.474 -0.698 1.00 2.24 H new ATOM 0 HA LEU A1982 -17.156 -13.211 1.905 1.00 2.35 H new ATOM 0 HB2 LEU A1982 -19.217 -14.181 2.517 1.00 2.55 H new ATOM 0 HB3 LEU A1982 -19.429 -13.469 0.929 1.00 2.55 H new ATOM 0 HG LEU A1982 -19.005 -16.425 1.362 1.00 2.64 H new ATOM 0 HD11 LEU A1982 -21.489 -16.630 1.092 1.00 2.83 H new ATOM 0 HD12 LEU A1982 -21.050 -15.692 2.540 1.00 2.83 H new ATOM 0 HD13 LEU A1982 -21.608 -14.855 1.072 1.00 2.83 H new ATOM 0 HD21 LEU A1982 -20.081 -16.693 -0.842 1.00 2.91 H new ATOM 0 HD22 LEU A1982 -20.164 -14.923 -1.002 1.00 2.91 H new ATOM 0 HD23 LEU A1982 -18.583 -15.735 -0.926 1.00 2.91 H new ATOM 1468 N LYS A1983 -16.393 -16.271 1.097 1.00 2.40 N ATOM 1469 CA LYS A1983 -15.808 -17.520 1.540 1.00 2.57 C ATOM 1470 C LYS A1983 -14.427 -17.727 0.972 1.00 2.46 C ATOM 1471 O LYS A1983 -13.918 -18.846 0.934 1.00 2.62 O ATOM 1472 CB LYS A1983 -16.709 -18.698 1.174 1.00 2.75 C ATOM 1473 CG LYS A1983 -18.022 -18.770 1.955 1.00 2.91 C ATOM 1474 CD LYS A1983 -17.787 -18.893 3.464 1.00 3.23 C ATOM 1475 CE LYS A1983 -16.909 -20.098 3.829 1.00 3.77 C ATOM 1476 NZ LYS A1983 -17.506 -21.395 3.438 1.00 4.43 N ATOM 0 H LYS A1983 -16.557 -16.219 0.092 1.00 2.40 H new ATOM 0 HA LYS A1983 -15.717 -17.466 2.625 1.00 2.57 H new ATOM 0 HB2 LYS A1983 -16.938 -18.644 0.110 1.00 2.75 H new ATOM 0 HB3 LYS A1983 -16.156 -19.623 1.335 1.00 2.75 H new ATOM 0 HG2 LYS A1983 -18.614 -17.877 1.752 1.00 2.91 H new ATOM 0 HG3 LYS A1983 -18.604 -19.624 1.608 1.00 2.91 H new ATOM 0 HD2 LYS A1983 -17.316 -17.981 3.830 1.00 3.23 H new ATOM 0 HD3 LYS A1983 -18.748 -18.981 3.971 1.00 3.23 H new ATOM 0 HE2 LYS A1983 -15.938 -19.992 3.345 1.00 3.77 H new ATOM 0 HE3 LYS A1983 -16.731 -20.097 4.904 1.00 3.77 H new ATOM 0 HZ1 LYS A1983 -16.866 -22.168 3.711 1.00 4.43 H new ATOM 0 HZ2 LYS A1983 -18.420 -21.516 3.919 1.00 4.43 H new ATOM 0 HZ3 LYS A1983 -17.652 -21.414 2.408 1.00 4.43 H new ATOM 1490 N MET A1984 -13.819 -16.662 0.564 1.00 2.32 N ATOM 1491 CA MET A1984 -12.510 -16.677 0.068 1.00 2.29 C ATOM 1492 C MET A1984 -11.798 -15.577 0.821 1.00 2.18 C ATOM 1493 O MET A1984 -12.314 -15.110 1.847 1.00 2.40 O ATOM 1494 CB MET A1984 -12.492 -16.447 -1.459 1.00 2.28 C ATOM 1495 CG MET A1984 -13.219 -17.505 -2.278 1.00 2.33 C ATOM 1496 SD MET A1984 -13.028 -17.259 -4.064 1.00 2.53 S ATOM 1497 CE MET A1984 -13.767 -15.638 -4.284 1.00 2.68 C ATOM 0 H MET A1984 -14.245 -15.735 0.573 1.00 2.32 H new ATOM 0 HA MET A1984 -12.020 -17.639 0.216 1.00 2.29 H new ATOM 0 HB2 MET A1984 -12.939 -15.475 -1.670 1.00 2.28 H new ATOM 0 HB3 MET A1984 -11.455 -16.400 -1.792 1.00 2.28 H new ATOM 0 HG2 MET A1984 -12.840 -18.491 -2.008 1.00 2.33 H new ATOM 0 HG3 MET A1984 -14.279 -17.490 -2.024 1.00 2.33 H new ATOM 0 HE1 MET A1984 -14.325 -15.617 -5.220 1.00 2.68 H new ATOM 0 HE2 MET A1984 -14.442 -15.430 -3.454 1.00 2.68 H new ATOM 0 HE3 MET A1984 -12.983 -14.881 -4.312 1.00 2.68 H new ATOM 1507 N LYS A1985 -10.679 -15.179 0.370 1.00 2.14 N ATOM 1508 CA LYS A1985 -9.893 -14.178 1.047 1.00 2.09 C ATOM 1509 C LYS A1985 -9.470 -13.077 0.084 1.00 1.89 C ATOM 1510 O LYS A1985 -8.780 -13.331 -0.917 1.00 2.34 O ATOM 1511 CB LYS A1985 -8.677 -14.827 1.729 1.00 2.67 C ATOM 1512 CG LYS A1985 -7.814 -15.661 0.796 1.00 3.08 C ATOM 1513 CD LYS A1985 -6.635 -16.271 1.513 1.00 3.73 C ATOM 1514 CE LYS A1985 -5.827 -17.148 0.577 1.00 4.42 C ATOM 1515 NZ LYS A1985 -6.635 -18.259 0.015 1.00 4.89 N ATOM 0 H LYS A1985 -10.258 -15.530 -0.490 1.00 2.14 H new ATOM 0 HA LYS A1985 -10.507 -13.716 1.820 1.00 2.09 H new ATOM 0 HB2 LYS A1985 -8.062 -14.044 2.173 1.00 2.67 H new ATOM 0 HB3 LYS A1985 -9.026 -15.459 2.546 1.00 2.67 H new ATOM 0 HG2 LYS A1985 -8.419 -16.453 0.353 1.00 3.08 H new ATOM 0 HG3 LYS A1985 -7.457 -15.037 -0.023 1.00 3.08 H new ATOM 0 HD2 LYS A1985 -6.001 -15.481 1.916 1.00 3.73 H new ATOM 0 HD3 LYS A1985 -6.985 -16.862 2.360 1.00 3.73 H new ATOM 0 HE2 LYS A1985 -5.431 -16.540 -0.237 1.00 4.42 H new ATOM 0 HE3 LYS A1985 -4.971 -17.558 1.114 1.00 4.42 H new ATOM 0 HZ1 LYS A1985 -6.002 -18.985 -0.376 1.00 4.89 H new ATOM 0 HZ2 LYS A1985 -7.220 -18.677 0.766 1.00 4.89 H new ATOM 0 HZ3 LYS A1985 -7.250 -17.894 -0.740 1.00 4.89 H new ATOM 1529 N HIS A1986 -9.897 -11.879 0.335 1.00 1.63 N ATOM 1530 CA HIS A1986 -9.493 -10.775 -0.507 1.00 1.68 C ATOM 1531 C HIS A1986 -8.432 -9.941 0.143 1.00 1.14 C ATOM 1532 O HIS A1986 -8.539 -9.571 1.317 1.00 1.35 O ATOM 1533 CB HIS A1986 -10.662 -9.927 -1.035 1.00 2.46 C ATOM 1534 CG HIS A1986 -11.605 -9.351 -0.022 1.00 3.48 C ATOM 1535 ND1 HIS A1986 -12.810 -9.920 0.244 1.00 4.38 N ATOM 1536 CD2 HIS A1986 -11.552 -8.228 0.726 1.00 4.21 C ATOM 1537 CE1 HIS A1986 -13.472 -9.188 1.091 1.00 5.37 C ATOM 1538 NE2 HIS A1986 -12.737 -8.152 1.415 1.00 5.32 N ATOM 0 H HIS A1986 -10.519 -11.632 1.105 1.00 1.63 H new ATOM 0 HA HIS A1986 -9.056 -11.230 -1.395 1.00 1.68 H new ATOM 0 HB2 HIS A1986 -10.246 -9.104 -1.616 1.00 2.46 H new ATOM 0 HB3 HIS A1986 -11.241 -10.542 -1.724 1.00 2.46 H new ATOM 0 HD1 HIS A1986 -13.146 -10.794 -0.161 1.00 4.38 H new ATOM 0 HD2 HIS A1986 -10.734 -7.524 0.773 1.00 4.21 H new ATOM 0 HE1 HIS A1986 -14.463 -9.399 1.465 1.00 5.37 H new ATOM 1547 N LYS A1987 -7.403 -9.683 -0.605 1.00 1.12 N ATOM 1548 CA LYS A1987 -6.265 -8.931 -0.150 1.00 1.18 C ATOM 1549 C LYS A1987 -6.009 -7.814 -1.142 1.00 1.02 C ATOM 1550 O LYS A1987 -6.509 -7.850 -2.275 1.00 1.30 O ATOM 1551 CB LYS A1987 -5.020 -9.845 -0.133 1.00 1.91 C ATOM 1552 CG LYS A1987 -5.114 -11.081 0.757 1.00 2.70 C ATOM 1553 CD LYS A1987 -4.009 -12.069 0.400 1.00 3.34 C ATOM 1554 CE LYS A1987 -4.088 -13.358 1.215 1.00 3.96 C ATOM 1555 NZ LYS A1987 -3.548 -13.222 2.579 1.00 4.45 N ATOM 0 H LYS A1987 -7.326 -9.995 -1.573 1.00 1.12 H new ATOM 0 HA LYS A1987 -6.456 -8.538 0.849 1.00 1.18 H new ATOM 0 HB2 LYS A1987 -4.818 -10.170 -1.154 1.00 1.91 H new ATOM 0 HB3 LYS A1987 -4.163 -9.253 0.189 1.00 1.91 H new ATOM 0 HG2 LYS A1987 -5.029 -10.792 1.804 1.00 2.70 H new ATOM 0 HG3 LYS A1987 -6.089 -11.554 0.635 1.00 2.70 H new ATOM 0 HD2 LYS A1987 -4.071 -12.310 -0.661 1.00 3.34 H new ATOM 0 HD3 LYS A1987 -3.039 -11.599 0.564 1.00 3.34 H new ATOM 0 HE2 LYS A1987 -5.128 -13.678 1.274 1.00 3.96 H new ATOM 0 HE3 LYS A1987 -3.542 -14.143 0.693 1.00 3.96 H new ATOM 0 HZ1 LYS A1987 -3.826 -14.048 3.146 1.00 4.45 H new ATOM 0 HZ2 LYS A1987 -2.510 -13.164 2.537 1.00 4.45 H new ATOM 0 HZ3 LYS A1987 -3.926 -12.358 3.017 1.00 4.45 H new ATOM 1569 N SER A1988 -5.300 -6.832 -0.731 1.00 0.68 N ATOM 1570 CA SER A1988 -4.850 -5.831 -1.623 1.00 0.60 C ATOM 1571 C SER A1988 -3.346 -5.998 -1.786 1.00 0.50 C ATOM 1572 O SER A1988 -2.583 -5.892 -0.806 1.00 0.57 O ATOM 1573 CB SER A1988 -5.265 -4.435 -1.136 1.00 0.64 C ATOM 1574 OG SER A1988 -4.879 -4.215 0.202 1.00 1.41 O ATOM 0 H SER A1988 -5.013 -6.698 0.239 1.00 0.68 H new ATOM 0 HA SER A1988 -5.316 -5.938 -2.603 1.00 0.60 H new ATOM 0 HB2 SER A1988 -4.812 -3.677 -1.775 1.00 0.64 H new ATOM 0 HB3 SER A1988 -6.346 -4.324 -1.226 1.00 0.64 H new ATOM 0 HG SER A1988 -5.291 -4.893 0.777 1.00 1.41 H new ATOM 1580 N TYR A1989 -2.941 -6.357 -2.992 1.00 0.51 N ATOM 1581 CA TYR A1989 -1.559 -6.625 -3.305 1.00 0.49 C ATOM 1582 C TYR A1989 -0.809 -5.373 -3.628 1.00 0.41 C ATOM 1583 O TYR A1989 -1.115 -4.683 -4.604 1.00 0.42 O ATOM 1584 CB TYR A1989 -1.420 -7.598 -4.478 1.00 0.63 C ATOM 1585 CG TYR A1989 -1.809 -9.018 -4.176 1.00 0.75 C ATOM 1586 CD1 TYR A1989 -0.936 -9.849 -3.495 1.00 1.69 C ATOM 1587 CD2 TYR A1989 -3.023 -9.539 -4.592 1.00 1.18 C ATOM 1588 CE1 TYR A1989 -1.257 -11.160 -3.234 1.00 2.13 C ATOM 1589 CE2 TYR A1989 -3.356 -10.850 -4.329 1.00 1.40 C ATOM 1590 CZ TYR A1989 -2.465 -11.655 -3.649 1.00 1.66 C ATOM 1591 OH TYR A1989 -2.776 -12.966 -3.410 1.00 2.20 O ATOM 0 H TYR A1989 -3.573 -6.470 -3.785 1.00 0.51 H new ATOM 0 HA TYR A1989 -1.132 -7.078 -2.410 1.00 0.49 H new ATOM 0 HB2 TYR A1989 -2.033 -7.237 -5.304 1.00 0.63 H new ATOM 0 HB3 TYR A1989 -0.385 -7.586 -4.820 1.00 0.63 H new ATOM 0 HD1 TYR A1989 0.015 -9.460 -3.163 1.00 1.69 H new ATOM 0 HD2 TYR A1989 -3.717 -8.910 -5.129 1.00 1.18 H new ATOM 0 HE1 TYR A1989 -0.562 -11.795 -2.705 1.00 2.13 H new ATOM 0 HE2 TYR A1989 -4.308 -11.245 -4.653 1.00 1.40 H new ATOM 0 HH TYR A1989 -3.668 -13.161 -3.765 1.00 2.20 H new ATOM 1601 N PHE A1990 0.148 -5.084 -2.818 1.00 0.40 N ATOM 1602 CA PHE A1990 1.035 -3.988 -3.035 1.00 0.40 C ATOM 1603 C PHE A1990 2.376 -4.527 -3.434 1.00 0.40 C ATOM 1604 O PHE A1990 3.062 -5.161 -2.631 1.00 0.51 O ATOM 1605 CB PHE A1990 1.175 -3.129 -1.785 1.00 0.49 C ATOM 1606 CG PHE A1990 -0.038 -2.335 -1.442 1.00 0.84 C ATOM 1607 CD1 PHE A1990 -1.087 -2.931 -0.775 1.00 1.45 C ATOM 1608 CD2 PHE A1990 -0.135 -1.000 -1.782 1.00 1.31 C ATOM 1609 CE1 PHE A1990 -2.209 -2.215 -0.452 1.00 2.10 C ATOM 1610 CE2 PHE A1990 -1.255 -0.277 -1.460 1.00 2.02 C ATOM 1611 CZ PHE A1990 -2.272 -0.842 -0.821 1.00 2.31 C ATOM 0 H PHE A1990 0.343 -5.612 -1.967 1.00 0.40 H new ATOM 0 HA PHE A1990 0.627 -3.358 -3.825 1.00 0.40 H new ATOM 0 HB2 PHE A1990 1.422 -3.774 -0.942 1.00 0.49 H new ATOM 0 HB3 PHE A1990 2.014 -2.447 -1.921 1.00 0.49 H new ATOM 0 HD1 PHE A1990 -1.023 -3.975 -0.504 1.00 1.45 H new ATOM 0 HD2 PHE A1990 0.679 -0.521 -2.306 1.00 1.31 H new ATOM 0 HE1 PHE A1990 -3.029 -2.683 0.072 1.00 2.10 H new ATOM 0 HE2 PHE A1990 -1.310 0.767 -1.730 1.00 2.02 H new ATOM 0 HZ PHE A1990 -3.149 -0.259 -0.581 1.00 2.31 H new ATOM 1621 N SER A1991 2.714 -4.345 -4.668 1.00 0.35 N ATOM 1622 CA SER A1991 3.984 -4.766 -5.167 1.00 0.36 C ATOM 1623 C SER A1991 4.871 -3.545 -5.335 1.00 0.40 C ATOM 1624 O SER A1991 4.691 -2.757 -6.255 1.00 0.55 O ATOM 1625 CB SER A1991 3.789 -5.498 -6.485 1.00 0.36 C ATOM 1626 OG SER A1991 2.856 -6.551 -6.306 1.00 1.09 O ATOM 0 H SER A1991 2.115 -3.898 -5.363 1.00 0.35 H new ATOM 0 HA SER A1991 4.465 -5.452 -4.470 1.00 0.36 H new ATOM 0 HB2 SER A1991 3.432 -4.807 -7.248 1.00 0.36 H new ATOM 0 HB3 SER A1991 4.741 -5.897 -6.836 1.00 0.36 H new ATOM 0 HG SER A1991 2.728 -7.023 -7.155 1.00 1.09 H new ATOM 1632 N PHE A1992 5.778 -3.366 -4.418 1.00 0.36 N ATOM 1633 CA PHE A1992 6.661 -2.235 -4.422 1.00 0.37 C ATOM 1634 C PHE A1992 7.895 -2.584 -5.219 1.00 0.39 C ATOM 1635 O PHE A1992 8.733 -3.396 -4.784 1.00 0.40 O ATOM 1636 CB PHE A1992 7.045 -1.832 -2.996 1.00 0.40 C ATOM 1637 CG PHE A1992 5.887 -1.517 -2.102 1.00 0.48 C ATOM 1638 CD1 PHE A1992 5.363 -0.242 -2.050 1.00 0.56 C ATOM 1639 CD2 PHE A1992 5.327 -2.499 -1.307 1.00 0.58 C ATOM 1640 CE1 PHE A1992 4.298 0.049 -1.227 1.00 0.68 C ATOM 1641 CE2 PHE A1992 4.269 -2.217 -0.486 1.00 0.71 C ATOM 1642 CZ PHE A1992 3.751 -0.941 -0.444 1.00 0.74 C ATOM 0 H PHE A1992 5.927 -4.007 -3.639 1.00 0.36 H new ATOM 0 HA PHE A1992 6.153 -1.386 -4.879 1.00 0.37 H new ATOM 0 HB2 PHE A1992 7.623 -2.640 -2.548 1.00 0.40 H new ATOM 0 HB3 PHE A1992 7.698 -0.961 -3.043 1.00 0.40 H new ATOM 0 HD1 PHE A1992 5.793 0.537 -2.662 1.00 0.56 H new ATOM 0 HD2 PHE A1992 5.729 -3.501 -1.334 1.00 0.58 H new ATOM 0 HE1 PHE A1992 3.894 1.050 -1.196 1.00 0.68 H new ATOM 0 HE2 PHE A1992 3.840 -2.995 0.129 1.00 0.71 H new ATOM 0 HZ PHE A1992 2.916 -0.718 0.203 1.00 0.74 H new ATOM 1652 N VAL A1993 7.994 -1.983 -6.365 1.00 0.44 N ATOM 1653 CA VAL A1993 9.043 -2.238 -7.311 1.00 0.51 C ATOM 1654 C VAL A1993 10.055 -1.086 -7.351 1.00 0.53 C ATOM 1655 O VAL A1993 9.681 0.103 -7.291 1.00 0.58 O ATOM 1656 CB VAL A1993 8.447 -2.546 -8.729 1.00 0.59 C ATOM 1657 CG1 VAL A1993 7.404 -1.521 -9.121 1.00 0.76 C ATOM 1658 CG2 VAL A1993 9.525 -2.610 -9.795 1.00 0.91 C ATOM 0 H VAL A1993 7.327 -1.279 -6.680 1.00 0.44 H new ATOM 0 HA VAL A1993 9.588 -3.123 -6.983 1.00 0.51 H new ATOM 0 HB VAL A1993 7.974 -3.526 -8.661 1.00 0.59 H new ATOM 0 HG11 VAL A1993 7.010 -1.762 -10.108 1.00 0.76 H new ATOM 0 HG12 VAL A1993 6.592 -1.532 -8.394 1.00 0.76 H new ATOM 0 HG13 VAL A1993 7.858 -0.530 -9.143 1.00 0.76 H new ATOM 0 HG21 VAL A1993 9.069 -2.825 -10.761 1.00 0.91 H new ATOM 0 HG22 VAL A1993 10.045 -1.653 -9.844 1.00 0.91 H new ATOM 0 HG23 VAL A1993 10.237 -3.397 -9.546 1.00 0.91 H new ATOM 1668 N CYS A1994 11.320 -1.474 -7.370 1.00 0.59 N ATOM 1669 CA CYS A1994 12.482 -0.607 -7.442 1.00 0.67 C ATOM 1670 C CYS A1994 12.344 0.461 -8.535 1.00 0.65 C ATOM 1671 O CYS A1994 12.338 0.140 -9.740 1.00 0.84 O ATOM 1672 CB CYS A1994 13.734 -1.451 -7.791 1.00 0.88 C ATOM 1673 SG CYS A1994 14.221 -2.810 -6.649 1.00 1.47 S ATOM 0 H CYS A1994 11.577 -2.461 -7.333 1.00 0.59 H new ATOM 0 HA CYS A1994 12.572 -0.120 -6.471 1.00 0.67 H new ATOM 0 HB2 CYS A1994 13.576 -1.887 -8.777 1.00 0.88 H new ATOM 0 HB3 CYS A1994 14.580 -0.770 -7.876 1.00 0.88 H new ATOM 1678 N LYS A1995 12.174 1.697 -8.126 1.00 0.77 N ATOM 1679 CA LYS A1995 12.224 2.809 -9.047 1.00 0.93 C ATOM 1680 C LYS A1995 12.965 3.946 -8.393 1.00 1.05 C ATOM 1681 O LYS A1995 12.378 4.715 -7.637 1.00 1.39 O ATOM 1682 CB LYS A1995 10.840 3.297 -9.496 1.00 1.37 C ATOM 1683 CG LYS A1995 10.913 4.326 -10.629 1.00 1.79 C ATOM 1684 CD LYS A1995 9.561 4.929 -10.950 1.00 2.03 C ATOM 1685 CE LYS A1995 9.633 5.832 -12.173 1.00 2.56 C ATOM 1686 NZ LYS A1995 8.351 6.511 -12.435 1.00 3.14 N ATOM 0 H LYS A1995 11.999 1.959 -7.156 1.00 0.77 H new ATOM 0 HA LYS A1995 12.736 2.460 -9.944 1.00 0.93 H new ATOM 0 HB2 LYS A1995 10.247 2.443 -9.824 1.00 1.37 H new ATOM 0 HB3 LYS A1995 10.321 3.737 -8.644 1.00 1.37 H new ATOM 0 HG2 LYS A1995 11.605 5.121 -10.350 1.00 1.79 H new ATOM 0 HG3 LYS A1995 11.317 3.850 -11.523 1.00 1.79 H new ATOM 0 HD2 LYS A1995 8.838 4.132 -11.126 1.00 2.03 H new ATOM 0 HD3 LYS A1995 9.203 5.501 -10.094 1.00 2.03 H new ATOM 0 HE2 LYS A1995 10.415 6.577 -12.028 1.00 2.56 H new ATOM 0 HE3 LYS A1995 9.915 5.241 -13.044 1.00 2.56 H new ATOM 0 HZ1 LYS A1995 8.444 7.116 -13.276 1.00 3.14 H new ATOM 0 HZ2 LYS A1995 7.609 5.801 -12.599 1.00 3.14 H new ATOM 0 HZ3 LYS A1995 8.094 7.096 -11.615 1.00 3.14 H new ATOM 1700 N SER A1996 14.236 4.058 -8.690 1.00 1.31 N ATOM 1701 CA SER A1996 15.091 5.081 -8.103 1.00 1.68 C ATOM 1702 C SER A1996 14.640 6.479 -8.557 1.00 1.67 C ATOM 1703 O SER A1996 14.815 7.479 -7.854 1.00 2.05 O ATOM 1704 CB SER A1996 16.542 4.815 -8.511 1.00 2.15 C ATOM 1705 OG SER A1996 16.939 3.500 -8.121 1.00 2.57 O ATOM 0 H SER A1996 14.716 3.444 -9.347 1.00 1.31 H new ATOM 0 HA SER A1996 15.015 5.044 -7.016 1.00 1.68 H new ATOM 0 HB2 SER A1996 16.649 4.928 -9.590 1.00 2.15 H new ATOM 0 HB3 SER A1996 17.197 5.552 -8.046 1.00 2.15 H new ATOM 0 HG SER A1996 17.868 3.345 -8.391 1.00 2.57 H new ATOM 1711 N ASP A1997 14.004 6.516 -9.713 1.00 1.56 N ATOM 1712 CA ASP A1997 13.492 7.747 -10.319 1.00 1.73 C ATOM 1713 C ASP A1997 12.327 8.342 -9.505 1.00 1.59 C ATOM 1714 O ASP A1997 12.042 9.542 -9.586 1.00 2.04 O ATOM 1715 CB ASP A1997 13.067 7.456 -11.767 1.00 1.99 C ATOM 1716 CG ASP A1997 12.416 8.626 -12.478 1.00 2.32 C ATOM 1717 OD1 ASP A1997 13.094 9.641 -12.751 1.00 2.65 O ATOM 1718 OD2 ASP A1997 11.237 8.519 -12.845 1.00 2.80 O ATOM 0 H ASP A1997 13.822 5.682 -10.272 1.00 1.56 H new ATOM 0 HA ASP A1997 14.285 8.495 -10.319 1.00 1.73 H new ATOM 0 HB2 ASP A1997 13.944 7.145 -12.334 1.00 1.99 H new ATOM 0 HB3 ASP A1997 12.373 6.615 -11.767 1.00 1.99 H new ATOM 1723 N ALA A1998 11.720 7.521 -8.656 1.00 1.32 N ATOM 1724 CA ALA A1998 10.576 7.947 -7.859 1.00 1.24 C ATOM 1725 C ALA A1998 11.007 8.749 -6.633 1.00 1.57 C ATOM 1726 O ALA A1998 10.158 9.282 -5.906 1.00 1.87 O ATOM 1727 CB ALA A1998 9.742 6.752 -7.442 1.00 1.44 C ATOM 0 H ALA A1998 12.002 6.553 -8.502 1.00 1.32 H new ATOM 0 HA ALA A1998 9.968 8.601 -8.484 1.00 1.24 H new ATOM 0 HB1 ALA A1998 8.893 7.090 -6.848 1.00 1.44 H new ATOM 0 HB2 ALA A1998 9.380 6.233 -8.330 1.00 1.44 H new ATOM 0 HB3 ALA A1998 10.352 6.072 -6.848 1.00 1.44 H new ATOM 1733 N GLY A1999 12.322 8.797 -6.393 1.00 2.05 N ATOM 1734 CA GLY A1999 12.869 9.571 -5.296 1.00 2.88 C ATOM 1735 C GLY A1999 12.318 9.144 -3.960 1.00 2.81 C ATOM 1736 O GLY A1999 12.370 7.959 -3.599 1.00 3.07 O ATOM 0 H GLY A1999 13.020 8.305 -6.950 1.00 2.05 H new ATOM 0 HA2 GLY A1999 13.954 9.468 -5.288 1.00 2.88 H new ATOM 0 HA3 GLY A1999 12.650 10.627 -5.455 1.00 2.88 H new ATOM 1740 N ASP A2000 11.789 10.085 -3.242 1.00 2.90 N ATOM 1741 CA ASP A2000 11.175 9.830 -1.950 1.00 3.13 C ATOM 1742 C ASP A2000 9.692 10.142 -2.043 1.00 2.60 C ATOM 1743 O ASP A2000 8.955 10.071 -1.051 1.00 2.99 O ATOM 1744 CB ASP A2000 11.838 10.659 -0.821 1.00 3.84 C ATOM 1745 CG ASP A2000 11.537 12.153 -0.859 1.00 3.99 C ATOM 1746 OD1 ASP A2000 12.029 12.865 -1.764 1.00 4.30 O ATOM 1747 OD2 ASP A2000 10.837 12.654 0.034 1.00 4.11 O ATOM 0 H ASP A2000 11.764 11.064 -3.527 1.00 2.90 H new ATOM 0 HA ASP A2000 11.320 8.780 -1.696 1.00 3.13 H new ATOM 0 HB2 ASP A2000 11.512 10.262 0.140 1.00 3.84 H new ATOM 0 HB3 ASP A2000 12.918 10.519 -0.874 1.00 3.84 H new ATOM 1752 N ASP A2001 9.258 10.455 -3.261 1.00 2.08 N ATOM 1753 CA ASP A2001 7.857 10.771 -3.539 1.00 1.96 C ATOM 1754 C ASP A2001 7.055 9.510 -3.439 1.00 1.77 C ATOM 1755 O ASP A2001 6.077 9.448 -2.687 1.00 2.29 O ATOM 1756 CB ASP A2001 7.698 11.353 -4.934 1.00 2.29 C ATOM 1757 CG ASP A2001 6.283 11.817 -5.230 1.00 2.96 C ATOM 1758 OD1 ASP A2001 5.619 12.394 -4.333 1.00 3.70 O ATOM 1759 OD2 ASP A2001 5.831 11.678 -6.382 1.00 3.24 O ATOM 0 H ASP A2001 9.863 10.497 -4.081 1.00 2.08 H new ATOM 0 HA ASP A2001 7.510 11.509 -2.816 1.00 1.96 H new ATOM 0 HB2 ASP A2001 8.381 12.194 -5.050 1.00 2.29 H new ATOM 0 HB3 ASP A2001 7.989 10.603 -5.669 1.00 2.29 H new ATOM 1764 N SER A2002 7.512 8.487 -4.189 1.00 1.56 N ATOM 1765 CA SER A2002 6.944 7.146 -4.157 1.00 1.44 C ATOM 1766 C SER A2002 5.501 7.142 -4.746 1.00 1.26 C ATOM 1767 O SER A2002 4.551 7.533 -4.075 1.00 1.36 O ATOM 1768 CB SER A2002 6.991 6.641 -2.678 1.00 1.64 C ATOM 1769 OG SER A2002 6.640 5.285 -2.526 1.00 1.88 O ATOM 0 H SER A2002 8.294 8.581 -4.837 1.00 1.56 H new ATOM 0 HA SER A2002 7.523 6.465 -4.782 1.00 1.44 H new ATOM 0 HB2 SER A2002 7.996 6.792 -2.285 1.00 1.64 H new ATOM 0 HB3 SER A2002 6.318 7.250 -2.075 1.00 1.64 H new ATOM 0 HG SER A2002 6.692 5.038 -1.579 1.00 1.88 H new ATOM 1775 N GLN A2003 5.331 6.666 -5.982 1.00 1.23 N ATOM 1776 CA GLN A2003 4.008 6.722 -6.630 1.00 1.09 C ATOM 1777 C GLN A2003 3.500 5.343 -7.082 1.00 0.88 C ATOM 1778 O GLN A2003 4.264 4.516 -7.610 1.00 1.00 O ATOM 1779 CB GLN A2003 3.988 7.724 -7.792 1.00 1.33 C ATOM 1780 CG GLN A2003 4.953 7.402 -8.924 1.00 1.53 C ATOM 1781 CD GLN A2003 5.012 8.500 -9.957 1.00 1.86 C ATOM 1782 OE1 GLN A2003 5.814 9.422 -9.841 1.00 2.51 O ATOM 1783 NE2 GLN A2003 4.195 8.426 -10.974 1.00 1.74 N ATOM 0 H GLN A2003 6.069 6.246 -6.547 1.00 1.23 H new ATOM 0 HA GLN A2003 3.316 7.074 -5.865 1.00 1.09 H new ATOM 0 HB2 GLN A2003 2.977 7.771 -8.197 1.00 1.33 H new ATOM 0 HB3 GLN A2003 4.222 8.715 -7.404 1.00 1.33 H new ATOM 0 HG2 GLN A2003 5.949 7.239 -8.513 1.00 1.53 H new ATOM 0 HG3 GLN A2003 4.649 6.471 -9.403 1.00 1.53 H new ATOM 0 HE21 GLN A2003 3.539 7.649 -11.045 1.00 1.74 H new ATOM 0 HE22 GLN A2003 4.214 9.146 -11.697 1.00 1.74 H new ATOM 1792 N PRO A2004 2.212 5.074 -6.847 1.00 0.72 N ATOM 1793 CA PRO A2004 1.576 3.823 -7.189 1.00 0.61 C ATOM 1794 C PRO A2004 0.831 3.849 -8.524 1.00 0.60 C ATOM 1795 O PRO A2004 0.252 4.868 -8.931 1.00 0.74 O ATOM 1796 CB PRO A2004 0.565 3.638 -6.054 1.00 0.66 C ATOM 1797 CG PRO A2004 0.476 4.977 -5.363 1.00 0.77 C ATOM 1798 CD PRO A2004 1.267 5.950 -6.184 1.00 0.83 C ATOM 0 HA PRO A2004 2.314 3.028 -7.298 1.00 0.61 H new ATOM 0 HB2 PRO A2004 -0.407 3.332 -6.441 1.00 0.66 H new ATOM 0 HB3 PRO A2004 0.891 2.861 -5.362 1.00 0.66 H new ATOM 0 HG2 PRO A2004 -0.562 5.299 -5.279 1.00 0.77 H new ATOM 0 HG3 PRO A2004 0.874 4.915 -4.350 1.00 0.77 H new ATOM 0 HD2 PRO A2004 0.641 6.490 -6.895 1.00 0.83 H new ATOM 0 HD3 PRO A2004 1.765 6.697 -5.566 1.00 0.83 H new ATOM 1806 N VAL A2005 0.857 2.733 -9.185 1.00 0.57 N ATOM 1807 CA VAL A2005 0.138 2.507 -10.407 1.00 0.59 C ATOM 1808 C VAL A2005 -0.780 1.333 -10.142 1.00 0.59 C ATOM 1809 O VAL A2005 -0.309 0.250 -9.765 1.00 0.62 O ATOM 1810 CB VAL A2005 1.103 2.138 -11.574 1.00 0.66 C ATOM 1811 CG1 VAL A2005 0.340 1.885 -12.867 1.00 0.73 C ATOM 1812 CG2 VAL A2005 2.148 3.220 -11.780 1.00 0.69 C ATOM 0 H VAL A2005 1.398 1.924 -8.880 1.00 0.57 H new ATOM 0 HA VAL A2005 -0.403 3.407 -10.699 1.00 0.59 H new ATOM 0 HB VAL A2005 1.612 1.215 -11.296 1.00 0.66 H new ATOM 0 HG11 VAL A2005 1.043 1.630 -13.660 1.00 0.73 H new ATOM 0 HG12 VAL A2005 -0.358 1.061 -12.722 1.00 0.73 H new ATOM 0 HG13 VAL A2005 -0.212 2.783 -13.146 1.00 0.73 H new ATOM 0 HG21 VAL A2005 2.808 2.937 -12.600 1.00 0.69 H new ATOM 0 HG22 VAL A2005 1.654 4.162 -12.020 1.00 0.69 H new ATOM 0 HG23 VAL A2005 2.733 3.339 -10.868 1.00 0.69 H new ATOM 1822 N PHE A2006 -2.061 1.520 -10.281 1.00 0.62 N ATOM 1823 CA PHE A2006 -2.952 0.424 -10.011 1.00 0.65 C ATOM 1824 C PHE A2006 -3.079 -0.444 -11.240 1.00 0.63 C ATOM 1825 O PHE A2006 -3.009 0.050 -12.370 1.00 0.71 O ATOM 1826 CB PHE A2006 -4.349 0.880 -9.492 1.00 0.76 C ATOM 1827 CG PHE A2006 -5.268 1.554 -10.491 1.00 0.86 C ATOM 1828 CD1 PHE A2006 -5.174 2.923 -10.720 1.00 0.91 C ATOM 1829 CD2 PHE A2006 -6.193 0.830 -11.212 1.00 1.01 C ATOM 1830 CE1 PHE A2006 -5.991 3.545 -11.640 1.00 1.08 C ATOM 1831 CE2 PHE A2006 -7.014 1.449 -12.137 1.00 1.17 C ATOM 1832 CZ PHE A2006 -6.993 2.772 -12.299 1.00 1.21 C ATOM 0 H PHE A2006 -2.504 2.392 -10.571 1.00 0.62 H new ATOM 0 HA PHE A2006 -2.514 -0.158 -9.200 1.00 0.65 H new ATOM 0 HB2 PHE A2006 -4.864 0.006 -9.094 1.00 0.76 H new ATOM 0 HB3 PHE A2006 -4.194 1.565 -8.659 1.00 0.76 H new ATOM 0 HD1 PHE A2006 -4.451 3.507 -10.169 1.00 0.91 H new ATOM 0 HD2 PHE A2006 -6.278 -0.235 -11.053 1.00 1.01 H new ATOM 0 HE1 PHE A2006 -5.875 4.596 -11.858 1.00 1.08 H new ATOM 0 HE2 PHE A2006 -7.683 0.851 -12.738 1.00 1.17 H new ATOM 0 HZ PHE A2006 -7.729 3.255 -12.924 1.00 1.21 H new ATOM 1842 N LEU A2007 -3.203 -1.720 -11.027 1.00 0.62 N ATOM 1843 CA LEU A2007 -3.460 -2.648 -12.104 1.00 0.71 C ATOM 1844 C LEU A2007 -4.931 -2.550 -12.390 1.00 0.81 C ATOM 1845 O LEU A2007 -5.368 -2.057 -13.449 1.00 0.97 O ATOM 1846 CB LEU A2007 -3.119 -4.104 -11.687 1.00 0.81 C ATOM 1847 CG LEU A2007 -1.640 -4.552 -11.618 1.00 0.85 C ATOM 1848 CD1 LEU A2007 -1.025 -4.574 -12.988 1.00 1.29 C ATOM 1849 CD2 LEU A2007 -0.809 -3.702 -10.662 1.00 1.10 C ATOM 0 H LEU A2007 -3.130 -2.153 -10.106 1.00 0.62 H new ATOM 0 HA LEU A2007 -2.847 -2.405 -12.972 1.00 0.71 H new ATOM 0 HB2 LEU A2007 -3.557 -4.273 -10.703 1.00 0.81 H new ATOM 0 HB3 LEU A2007 -3.630 -4.771 -12.382 1.00 0.81 H new ATOM 0 HG LEU A2007 -1.638 -5.565 -11.216 1.00 0.85 H new ATOM 0 HD11 LEU A2007 0.015 -4.892 -12.915 1.00 1.29 H new ATOM 0 HD12 LEU A2007 -1.574 -5.271 -13.622 1.00 1.29 H new ATOM 0 HD13 LEU A2007 -1.069 -3.575 -13.423 1.00 1.29 H new ATOM 0 HD21 LEU A2007 0.220 -4.063 -10.655 1.00 1.10 H new ATOM 0 HD22 LEU A2007 -0.827 -2.663 -10.990 1.00 1.10 H new ATOM 0 HD23 LEU A2007 -1.225 -3.772 -9.657 1.00 1.10 H new ATOM 1861 N SER A2008 -5.681 -2.943 -11.391 1.00 0.80 N ATOM 1862 CA SER A2008 -7.096 -2.919 -11.399 1.00 0.99 C ATOM 1863 C SER A2008 -7.611 -3.289 -10.024 1.00 0.80 C ATOM 1864 O SER A2008 -6.869 -3.886 -9.190 1.00 0.64 O ATOM 1865 CB SER A2008 -7.651 -3.869 -12.478 1.00 1.31 C ATOM 1866 OG SER A2008 -6.956 -5.123 -12.491 1.00 1.75 O ATOM 0 H SER A2008 -5.291 -3.301 -10.519 1.00 0.80 H new ATOM 0 HA SER A2008 -7.439 -1.914 -11.644 1.00 0.99 H new ATOM 0 HB2 SER A2008 -8.712 -4.043 -12.298 1.00 1.31 H new ATOM 0 HB3 SER A2008 -7.567 -3.396 -13.457 1.00 1.31 H new ATOM 0 HG SER A2008 -7.336 -5.700 -13.186 1.00 1.75 H new ATOM 1872 N PHE A2009 -8.803 -2.870 -9.749 1.00 0.90 N ATOM 1873 CA PHE A2009 -9.496 -3.272 -8.579 1.00 0.77 C ATOM 1874 C PHE A2009 -10.501 -4.287 -9.045 1.00 0.80 C ATOM 1875 O PHE A2009 -11.386 -3.970 -9.864 1.00 0.93 O ATOM 1876 CB PHE A2009 -10.213 -2.066 -7.942 1.00 0.85 C ATOM 1877 CG PHE A2009 -10.923 -2.366 -6.640 1.00 0.77 C ATOM 1878 CD1 PHE A2009 -12.197 -2.894 -6.649 1.00 1.14 C ATOM 1879 CD2 PHE A2009 -10.313 -2.129 -5.414 1.00 0.72 C ATOM 1880 CE1 PHE A2009 -12.854 -3.178 -5.469 1.00 1.16 C ATOM 1881 CE2 PHE A2009 -10.966 -2.410 -4.233 1.00 0.81 C ATOM 1882 CZ PHE A2009 -12.217 -2.898 -4.239 1.00 0.87 C ATOM 0 H PHE A2009 -9.327 -2.228 -10.344 1.00 0.90 H new ATOM 0 HA PHE A2009 -8.822 -3.680 -7.825 1.00 0.77 H new ATOM 0 HB2 PHE A2009 -9.482 -1.277 -7.767 1.00 0.85 H new ATOM 0 HB3 PHE A2009 -10.940 -1.675 -8.654 1.00 0.85 H new ATOM 0 HD1 PHE A2009 -12.687 -3.088 -7.592 1.00 1.14 H new ATOM 0 HD2 PHE A2009 -9.314 -1.719 -5.386 1.00 0.72 H new ATOM 0 HE1 PHE A2009 -13.844 -3.609 -5.485 1.00 1.16 H new ATOM 0 HE2 PHE A2009 -10.466 -2.236 -3.292 1.00 0.81 H new ATOM 0 HZ PHE A2009 -12.734 -3.076 -3.308 1.00 0.87 H new ATOM 1892 N ASP A2010 -10.383 -5.486 -8.587 1.00 0.74 N ATOM 1893 CA ASP A2010 -11.300 -6.503 -9.003 1.00 0.83 C ATOM 1894 C ASP A2010 -12.392 -6.583 -8.004 1.00 0.88 C ATOM 1895 O ASP A2010 -12.165 -6.964 -6.871 1.00 0.97 O ATOM 1896 CB ASP A2010 -10.629 -7.858 -9.146 1.00 0.97 C ATOM 1897 CG ASP A2010 -11.583 -8.878 -9.706 1.00 1.63 C ATOM 1898 OD1 ASP A2010 -11.671 -8.998 -10.937 1.00 2.43 O ATOM 1899 OD2 ASP A2010 -12.273 -9.567 -8.935 1.00 2.01 O ATOM 0 H ASP A2010 -9.666 -5.790 -7.928 1.00 0.74 H new ATOM 0 HA ASP A2010 -11.690 -6.237 -9.985 1.00 0.83 H new ATOM 0 HB2 ASP A2010 -9.761 -7.770 -9.799 1.00 0.97 H new ATOM 0 HB3 ASP A2010 -10.264 -8.191 -8.174 1.00 0.97 H new ATOM 1904 N GLU A2011 -13.570 -6.213 -8.403 1.00 1.03 N ATOM 1905 CA GLU A2011 -14.689 -6.184 -7.498 1.00 1.24 C ATOM 1906 C GLU A2011 -15.402 -7.530 -7.438 1.00 1.30 C ATOM 1907 O GLU A2011 -16.299 -7.725 -6.622 1.00 1.46 O ATOM 1908 CB GLU A2011 -15.652 -5.072 -7.870 1.00 1.52 C ATOM 1909 CG GLU A2011 -16.106 -5.124 -9.306 1.00 1.76 C ATOM 1910 CD GLU A2011 -17.145 -4.101 -9.611 1.00 2.09 C ATOM 1911 OE1 GLU A2011 -16.784 -2.985 -9.995 1.00 2.23 O ATOM 1912 OE2 GLU A2011 -18.360 -4.392 -9.477 1.00 2.75 O ATOM 0 H GLU A2011 -13.787 -5.924 -9.357 1.00 1.03 H new ATOM 0 HA GLU A2011 -14.300 -5.980 -6.500 1.00 1.24 H new ATOM 0 HB2 GLU A2011 -16.525 -5.126 -7.219 1.00 1.52 H new ATOM 0 HB3 GLU A2011 -15.174 -4.111 -7.683 1.00 1.52 H new ATOM 0 HG2 GLU A2011 -15.248 -4.973 -9.961 1.00 1.76 H new ATOM 0 HG3 GLU A2011 -16.502 -6.116 -9.523 1.00 1.76 H new ATOM 1919 N GLN A2012 -15.002 -8.455 -8.291 1.00 1.32 N ATOM 1920 CA GLN A2012 -15.591 -9.768 -8.282 1.00 1.52 C ATOM 1921 C GLN A2012 -15.051 -10.556 -7.096 1.00 1.49 C ATOM 1922 O GLN A2012 -15.802 -11.149 -6.351 1.00 1.71 O ATOM 1923 CB GLN A2012 -15.332 -10.518 -9.599 1.00 1.75 C ATOM 1924 CG GLN A2012 -16.002 -11.894 -9.681 1.00 2.10 C ATOM 1925 CD GLN A2012 -17.526 -11.869 -9.876 1.00 2.62 C ATOM 1926 OE1 GLN A2012 -18.090 -12.793 -10.453 1.00 3.40 O ATOM 1927 NE2 GLN A2012 -18.194 -10.831 -9.437 1.00 2.81 N ATOM 0 H GLN A2012 -14.275 -8.316 -8.993 1.00 1.32 H new ATOM 0 HA GLN A2012 -16.671 -9.660 -8.185 1.00 1.52 H new ATOM 0 HB2 GLN A2012 -15.684 -9.905 -10.428 1.00 1.75 H new ATOM 0 HB3 GLN A2012 -14.257 -10.642 -9.728 1.00 1.75 H new ATOM 0 HG2 GLN A2012 -15.555 -12.449 -10.506 1.00 2.10 H new ATOM 0 HG3 GLN A2012 -15.778 -12.445 -8.767 1.00 2.10 H new ATOM 0 HE21 GLN A2012 -17.704 -10.074 -8.960 1.00 2.81 H new ATOM 0 HE22 GLN A2012 -19.204 -10.780 -9.572 1.00 2.81 H new ATOM 1936 N THR A2013 -13.757 -10.553 -6.928 1.00 1.37 N ATOM 1937 CA THR A2013 -13.155 -11.232 -5.804 1.00 1.47 C ATOM 1938 C THR A2013 -12.685 -10.196 -4.762 1.00 1.37 C ATOM 1939 O THR A2013 -11.999 -10.528 -3.801 1.00 1.57 O ATOM 1940 CB THR A2013 -11.990 -12.186 -6.260 1.00 1.72 C ATOM 1941 OG1 THR A2013 -11.500 -12.988 -5.165 1.00 1.95 O ATOM 1942 CG2 THR A2013 -10.826 -11.412 -6.868 1.00 1.76 C ATOM 0 H THR A2013 -13.096 -10.090 -7.552 1.00 1.37 H new ATOM 0 HA THR A2013 -13.904 -11.870 -5.336 1.00 1.47 H new ATOM 0 HB THR A2013 -12.415 -12.840 -7.021 1.00 1.72 H new ATOM 0 HG1 THR A2013 -11.615 -12.498 -4.324 1.00 1.95 H new ATOM 0 HG21 THR A2013 -10.044 -12.109 -7.169 1.00 1.76 H new ATOM 0 HG22 THR A2013 -11.174 -10.858 -7.740 1.00 1.76 H new ATOM 0 HG23 THR A2013 -10.427 -10.716 -6.130 1.00 1.76 H new ATOM 1950 N CYS A2014 -13.059 -8.932 -4.990 1.00 1.20 N ATOM 1951 CA CYS A2014 -12.779 -7.803 -4.066 1.00 1.22 C ATOM 1952 C CYS A2014 -11.275 -7.662 -3.736 1.00 1.19 C ATOM 1953 O CYS A2014 -10.892 -7.158 -2.683 1.00 1.49 O ATOM 1954 CB CYS A2014 -13.636 -7.943 -2.795 1.00 1.49 C ATOM 1955 SG CYS A2014 -15.441 -7.927 -3.121 1.00 1.65 S ATOM 0 H CYS A2014 -13.570 -8.651 -5.827 1.00 1.20 H new ATOM 0 HA CYS A2014 -13.056 -6.879 -4.573 1.00 1.22 H new ATOM 0 HB2 CYS A2014 -13.374 -8.874 -2.291 1.00 1.49 H new ATOM 0 HB3 CYS A2014 -13.392 -7.130 -2.111 1.00 1.49 H new ATOM 1960 N THR A2015 -10.450 -8.044 -4.676 1.00 1.02 N ATOM 1961 CA THR A2015 -9.017 -8.038 -4.521 1.00 1.04 C ATOM 1962 C THR A2015 -8.424 -6.857 -5.302 1.00 0.96 C ATOM 1963 O THR A2015 -8.876 -6.540 -6.402 1.00 1.08 O ATOM 1964 CB THR A2015 -8.453 -9.400 -5.005 1.00 1.15 C ATOM 1965 OG1 THR A2015 -9.008 -10.457 -4.179 1.00 1.56 O ATOM 1966 CG2 THR A2015 -6.931 -9.456 -4.952 1.00 1.39 C ATOM 0 H THR A2015 -10.761 -8.375 -5.589 1.00 1.02 H new ATOM 0 HA THR A2015 -8.741 -7.911 -3.474 1.00 1.04 H new ATOM 0 HB THR A2015 -8.741 -9.529 -6.048 1.00 1.15 H new ATOM 0 HG1 THR A2015 -9.977 -10.335 -4.099 1.00 1.56 H new ATOM 0 HG21 THR A2015 -6.590 -10.431 -5.301 1.00 1.39 H new ATOM 0 HG22 THR A2015 -6.516 -8.676 -5.590 1.00 1.39 H new ATOM 0 HG23 THR A2015 -6.597 -9.301 -3.926 1.00 1.39 H new ATOM 1974 N SER A2016 -7.460 -6.190 -4.716 1.00 0.87 N ATOM 1975 CA SER A2016 -6.875 -5.017 -5.324 1.00 0.83 C ATOM 1976 C SER A2016 -5.440 -5.308 -5.759 1.00 0.71 C ATOM 1977 O SER A2016 -4.725 -6.049 -5.076 1.00 0.74 O ATOM 1978 CB SER A2016 -6.877 -3.905 -4.298 1.00 0.87 C ATOM 1979 OG SER A2016 -8.141 -3.806 -3.680 1.00 1.36 O ATOM 0 H SER A2016 -7.060 -6.441 -3.812 1.00 0.87 H new ATOM 0 HA SER A2016 -7.451 -4.728 -6.203 1.00 0.83 H new ATOM 0 HB2 SER A2016 -6.112 -4.095 -3.546 1.00 0.87 H new ATOM 0 HB3 SER A2016 -6.625 -2.959 -4.778 1.00 0.87 H new ATOM 0 HG SER A2016 -8.741 -3.276 -4.245 1.00 1.36 H new ATOM 1985 N TYR A2017 -5.030 -4.760 -6.891 1.00 0.64 N ATOM 1986 CA TYR A2017 -3.664 -4.936 -7.375 1.00 0.57 C ATOM 1987 C TYR A2017 -3.004 -3.573 -7.584 1.00 0.49 C ATOM 1988 O TYR A2017 -3.469 -2.775 -8.414 1.00 0.56 O ATOM 1989 CB TYR A2017 -3.654 -5.701 -8.700 1.00 0.71 C ATOM 1990 CG TYR A2017 -4.230 -7.093 -8.655 1.00 0.86 C ATOM 1991 CD1 TYR A2017 -3.432 -8.187 -8.344 1.00 0.92 C ATOM 1992 CD2 TYR A2017 -5.574 -7.311 -8.901 1.00 1.01 C ATOM 1993 CE1 TYR A2017 -3.960 -9.457 -8.288 1.00 1.09 C ATOM 1994 CE2 TYR A2017 -6.112 -8.576 -8.843 1.00 1.18 C ATOM 1995 CZ TYR A2017 -5.277 -9.663 -8.608 1.00 1.20 C ATOM 1996 OH TYR A2017 -5.834 -10.924 -8.488 1.00 1.38 O ATOM 0 H TYR A2017 -5.621 -4.189 -7.495 1.00 0.64 H new ATOM 0 HA TYR A2017 -3.111 -5.506 -6.628 1.00 0.57 H new ATOM 0 HB2 TYR A2017 -4.209 -5.121 -9.437 1.00 0.71 H new ATOM 0 HB3 TYR A2017 -2.625 -5.765 -9.054 1.00 0.71 H new ATOM 0 HD1 TYR A2017 -2.381 -8.039 -8.143 1.00 0.92 H new ATOM 0 HD2 TYR A2017 -6.212 -6.474 -9.143 1.00 1.01 H new ATOM 0 HE1 TYR A2017 -3.338 -10.289 -7.993 1.00 1.09 H new ATOM 0 HE2 TYR A2017 -7.173 -8.723 -8.979 1.00 1.18 H new ATOM 0 HH TYR A2017 -6.776 -10.892 -8.755 1.00 1.38 H new ATOM 2006 N PHE A2018 -1.947 -3.293 -6.843 1.00 0.39 N ATOM 2007 CA PHE A2018 -1.241 -2.026 -6.956 1.00 0.39 C ATOM 2008 C PHE A2018 0.263 -2.260 -7.123 1.00 0.36 C ATOM 2009 O PHE A2018 0.879 -2.990 -6.338 1.00 0.40 O ATOM 2010 CB PHE A2018 -1.468 -1.149 -5.705 1.00 0.47 C ATOM 2011 CG PHE A2018 -2.909 -0.862 -5.374 1.00 0.57 C ATOM 2012 CD1 PHE A2018 -3.672 -0.034 -6.178 1.00 0.74 C ATOM 2013 CD2 PHE A2018 -3.497 -1.425 -4.255 1.00 0.74 C ATOM 2014 CE1 PHE A2018 -4.995 0.228 -5.873 1.00 0.89 C ATOM 2015 CE2 PHE A2018 -4.816 -1.166 -3.943 1.00 0.87 C ATOM 2016 CZ PHE A2018 -5.567 -0.339 -4.752 1.00 0.87 C ATOM 0 H PHE A2018 -1.555 -3.931 -6.150 1.00 0.39 H new ATOM 0 HA PHE A2018 -1.635 -1.512 -7.833 1.00 0.39 H new ATOM 0 HB2 PHE A2018 -1.006 -1.640 -4.848 1.00 0.47 H new ATOM 0 HB3 PHE A2018 -0.949 -0.201 -5.847 1.00 0.47 H new ATOM 0 HD1 PHE A2018 -3.229 0.414 -7.055 1.00 0.74 H new ATOM 0 HD2 PHE A2018 -2.916 -2.075 -3.618 1.00 0.74 H new ATOM 0 HE1 PHE A2018 -5.579 0.875 -6.510 1.00 0.89 H new ATOM 0 HE2 PHE A2018 -5.260 -1.611 -3.065 1.00 0.87 H new ATOM 0 HZ PHE A2018 -6.600 -0.136 -4.509 1.00 0.87 H new ATOM 2026 N SER A2019 0.836 -1.657 -8.126 1.00 0.45 N ATOM 2027 CA SER A2019 2.256 -1.716 -8.352 1.00 0.47 C ATOM 2028 C SER A2019 2.817 -0.363 -7.945 1.00 0.45 C ATOM 2029 O SER A2019 2.439 0.669 -8.496 1.00 0.49 O ATOM 2030 CB SER A2019 2.552 -2.021 -9.832 1.00 0.51 C ATOM 2031 OG SER A2019 3.951 -2.114 -10.090 1.00 1.24 O ATOM 0 H SER A2019 0.328 -1.105 -8.817 1.00 0.45 H new ATOM 0 HA SER A2019 2.718 -2.513 -7.769 1.00 0.47 H new ATOM 0 HB2 SER A2019 2.069 -2.957 -10.113 1.00 0.51 H new ATOM 0 HB3 SER A2019 2.120 -1.239 -10.457 1.00 0.51 H new ATOM 0 HG SER A2019 4.096 -2.310 -11.039 1.00 1.24 H new ATOM 2037 N TRP A2020 3.668 -0.348 -6.978 1.00 0.52 N ATOM 2038 CA TRP A2020 4.146 0.884 -6.452 1.00 0.57 C ATOM 2039 C TRP A2020 5.601 1.055 -6.814 1.00 0.49 C ATOM 2040 O TRP A2020 6.443 0.262 -6.422 1.00 0.43 O ATOM 2041 CB TRP A2020 3.957 0.899 -4.945 1.00 0.69 C ATOM 2042 CG TRP A2020 3.873 2.257 -4.349 1.00 0.88 C ATOM 2043 CD1 TRP A2020 4.732 3.299 -4.506 1.00 0.81 C ATOM 2044 CD2 TRP A2020 2.858 2.701 -3.465 1.00 1.75 C ATOM 2045 NE1 TRP A2020 4.273 4.385 -3.808 1.00 1.00 N ATOM 2046 CE2 TRP A2020 3.133 4.035 -3.148 1.00 1.65 C ATOM 2047 CE3 TRP A2020 1.729 2.095 -2.918 1.00 2.75 C ATOM 2048 CZ2 TRP A2020 2.321 4.775 -2.313 1.00 2.41 C ATOM 2049 CZ3 TRP A2020 0.928 2.831 -2.084 1.00 3.55 C ATOM 2050 CH2 TRP A2020 1.225 4.159 -1.790 1.00 3.35 C ATOM 0 H TRP A2020 4.050 -1.182 -6.532 1.00 0.52 H new ATOM 0 HA TRP A2020 3.583 1.714 -6.879 1.00 0.57 H new ATOM 0 HB2 TRP A2020 3.047 0.351 -4.700 1.00 0.69 H new ATOM 0 HB3 TRP A2020 4.786 0.363 -4.482 1.00 0.69 H new ATOM 0 HD1 TRP A2020 5.639 3.274 -5.092 1.00 0.81 H new ATOM 0 HE1 TRP A2020 4.713 5.305 -3.786 1.00 1.00 H new ATOM 0 HE3 TRP A2020 1.490 1.067 -3.146 1.00 2.75 H new ATOM 0 HZ2 TRP A2020 2.547 5.806 -2.083 1.00 2.41 H new ATOM 0 HZ3 TRP A2020 0.052 2.373 -1.648 1.00 3.55 H new ATOM 0 HH2 TRP A2020 0.572 4.713 -1.132 1.00 3.35 H new ATOM 2061 N HIS A2021 5.881 2.073 -7.564 1.00 0.61 N ATOM 2062 CA HIS A2021 7.220 2.353 -8.005 1.00 0.66 C ATOM 2063 C HIS A2021 7.870 3.294 -7.024 1.00 0.64 C ATOM 2064 O HIS A2021 7.498 4.471 -6.935 1.00 0.81 O ATOM 2065 CB HIS A2021 7.215 2.963 -9.405 1.00 0.86 C ATOM 2066 CG HIS A2021 6.669 2.064 -10.468 1.00 0.93 C ATOM 2067 ND1 HIS A2021 7.454 1.293 -11.279 1.00 1.53 N ATOM 2068 CD2 HIS A2021 5.396 1.825 -10.850 1.00 1.33 C ATOM 2069 CE1 HIS A2021 6.696 0.626 -12.113 1.00 1.61 C ATOM 2070 NE2 HIS A2021 5.444 0.928 -11.871 1.00 1.43 N ATOM 0 H HIS A2021 5.185 2.742 -7.893 1.00 0.61 H new ATOM 0 HA HIS A2021 7.785 1.422 -8.051 1.00 0.66 H new ATOM 0 HB2 HIS A2021 6.628 3.881 -9.386 1.00 0.86 H new ATOM 0 HB3 HIS A2021 8.235 3.242 -9.670 1.00 0.86 H new ATOM 0 HD2 HIS A2021 4.506 2.264 -10.424 1.00 1.33 H new ATOM 0 HE1 HIS A2021 7.044 -0.058 -12.873 1.00 1.61 H new ATOM 0 HE2 HIS A2021 4.637 0.551 -12.368 1.00 1.43 H new ATOM 2079 N THR A2022 8.777 2.775 -6.249 1.00 0.51 N ATOM 2080 CA THR A2022 9.436 3.547 -5.240 1.00 0.50 C ATOM 2081 C THR A2022 10.891 3.112 -5.057 1.00 0.48 C ATOM 2082 O THR A2022 11.249 1.969 -5.362 1.00 0.50 O ATOM 2083 CB THR A2022 8.645 3.528 -3.901 1.00 0.53 C ATOM 2084 OG1 THR A2022 9.307 4.286 -2.882 1.00 0.63 O ATOM 2085 CG2 THR A2022 8.363 2.124 -3.406 1.00 0.56 C ATOM 0 H THR A2022 9.080 1.802 -6.300 1.00 0.51 H new ATOM 0 HA THR A2022 9.458 4.582 -5.581 1.00 0.50 H new ATOM 0 HB THR A2022 7.686 3.999 -4.118 1.00 0.53 H new ATOM 0 HG1 THR A2022 8.640 4.741 -2.327 1.00 0.63 H new ATOM 0 HG21 THR A2022 7.809 2.173 -2.469 1.00 0.56 H new ATOM 0 HG22 THR A2022 7.772 1.588 -4.149 1.00 0.56 H new ATOM 0 HG23 THR A2022 9.305 1.599 -3.244 1.00 0.56 H new ATOM 2093 N SER A2023 11.728 4.033 -4.626 1.00 0.55 N ATOM 2094 CA SER A2023 13.127 3.753 -4.353 1.00 0.60 C ATOM 2095 C SER A2023 13.243 2.952 -3.045 1.00 0.59 C ATOM 2096 O SER A2023 14.147 2.156 -2.863 1.00 0.75 O ATOM 2097 CB SER A2023 13.869 5.076 -4.188 1.00 0.85 C ATOM 2098 OG SER A2023 13.501 6.003 -5.201 1.00 1.21 O ATOM 0 H SER A2023 11.458 5.001 -4.454 1.00 0.55 H new ATOM 0 HA SER A2023 13.555 3.178 -5.174 1.00 0.60 H new ATOM 0 HB2 SER A2023 13.650 5.499 -3.208 1.00 0.85 H new ATOM 0 HB3 SER A2023 14.944 4.900 -4.226 1.00 0.85 H new ATOM 0 HG SER A2023 13.071 6.782 -4.791 1.00 1.21 H new ATOM 2104 N LEU A2024 12.257 3.142 -2.177 1.00 0.61 N ATOM 2105 CA LEU A2024 12.237 2.554 -0.833 1.00 0.74 C ATOM 2106 C LEU A2024 11.721 1.114 -0.878 1.00 0.76 C ATOM 2107 O LEU A2024 11.560 0.469 0.156 1.00 0.93 O ATOM 2108 CB LEU A2024 11.304 3.368 0.098 1.00 0.91 C ATOM 2109 CG LEU A2024 11.678 4.818 0.507 1.00 0.78 C ATOM 2110 CD1 LEU A2024 11.797 5.763 -0.681 1.00 1.53 C ATOM 2111 CD2 LEU A2024 10.622 5.336 1.449 1.00 1.11 C ATOM 0 H LEU A2024 11.438 3.714 -2.383 1.00 0.61 H new ATOM 0 HA LEU A2024 13.258 2.570 -0.453 1.00 0.74 H new ATOM 0 HB2 LEU A2024 10.326 3.410 -0.382 1.00 0.91 H new ATOM 0 HB3 LEU A2024 11.184 2.794 1.017 1.00 0.91 H new ATOM 0 HG LEU A2024 12.658 4.784 0.982 1.00 0.78 H new ATOM 0 HD11 LEU A2024 12.060 6.760 -0.328 1.00 1.53 H new ATOM 0 HD12 LEU A2024 12.571 5.401 -1.357 1.00 1.53 H new ATOM 0 HD13 LEU A2024 10.845 5.805 -1.209 1.00 1.53 H new ATOM 0 HD21 LEU A2024 10.869 6.355 1.747 1.00 1.11 H new ATOM 0 HD22 LEU A2024 9.653 5.329 0.949 1.00 1.11 H new ATOM 0 HD23 LEU A2024 10.579 4.700 2.333 1.00 1.11 H new ATOM 2123 N ALA A2025 11.462 0.642 -2.070 1.00 0.66 N ATOM 2124 CA ALA A2025 10.878 -0.655 -2.299 1.00 0.72 C ATOM 2125 C ALA A2025 11.879 -1.773 -2.183 1.00 0.85 C ATOM 2126 O ALA A2025 11.802 -2.605 -1.302 1.00 1.20 O ATOM 2127 CB ALA A2025 10.266 -0.686 -3.672 1.00 0.64 C ATOM 0 H ALA A2025 11.655 1.160 -2.927 1.00 0.66 H new ATOM 0 HA ALA A2025 10.123 -0.811 -1.528 1.00 0.72 H new ATOM 0 HB1 ALA A2025 9.822 -1.666 -3.851 1.00 0.64 H new ATOM 0 HB2 ALA A2025 9.494 0.080 -3.744 1.00 0.64 H new ATOM 0 HB3 ALA A2025 11.037 -0.495 -4.418 1.00 0.64 H new ATOM 2133 N CYS A2026 12.807 -1.790 -3.072 1.00 0.90 N ATOM 2134 CA CYS A2026 13.730 -2.854 -3.145 1.00 1.05 C ATOM 2135 C CYS A2026 15.057 -2.348 -3.631 1.00 1.23 C ATOM 2136 O CYS A2026 15.220 -1.150 -3.843 1.00 1.55 O ATOM 2137 CB CYS A2026 13.169 -3.978 -4.034 1.00 1.61 C ATOM 2138 SG CYS A2026 12.558 -3.435 -5.663 1.00 2.15 S ATOM 0 H CYS A2026 12.944 -1.060 -3.771 1.00 0.90 H new ATOM 0 HA CYS A2026 13.888 -3.276 -2.152 1.00 1.05 H new ATOM 0 HB2 CYS A2026 13.948 -4.725 -4.185 1.00 1.61 H new ATOM 0 HB3 CYS A2026 12.355 -4.470 -3.502 1.00 1.61 H new