USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=44 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: A1984 MET CE :methyl -158:sc= -0.175 (180deg=-0.808) USER MOD Set 1.2: A2013 THR OG1 : rot -40:sc= 0.519 USER MOD Set 2.1: A1995 LYS NZ :NH3+ -163:sc= 1.3 (180deg=0) USER MOD Set 2.2: A2003 GLN : amide:sc= -0.781! C(o=0.52!,f=-6.7!) USER MOD Set 3.1: A2002 SER OG : rot 180:sc= 0.577 USER MOD Set 3.2: A2022 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A1988 SER OG : rot 145:sc= 1.2 USER MOD Set 4.2: A2015 THR OG1 : rot 117:sc= -0.0112 USER MOD Set 4.3: A2016 SER OG : rot -73:sc= 0.573 USER MOD Set 5.1: A1969 LYS NZ :NH3+ -159:sc= 1.12 (180deg=-0.159) USER MOD Set 5.2: A1991 SER OG : rot 28:sc= 0.983 USER MOD Set 6.1: A1958 SER OG : rot 180:sc= 0.784 USER MOD Set 6.2: A1960 THR OG1 : rot 118:sc= 0.895 USER MOD Set 7.1: A1916 THR OG1 : rot 70:sc= 1.72 USER MOD Set 7.2: A1924 LYS NZ :NH3+ -123:sc= 0.569 (180deg=0) USER MOD Set 8.1: A1891 ASN : amide:sc= -6.16! C(o=-4.5!,f=-9.3!) USER MOD Set 8.2: A1910 LYS NZ :NH3+ -149:sc= 1.61! (180deg=-0.273) USER MOD Set 9.1: A1897 ASN : amide:sc= -0.635 X(o=-0.72,f=-0.51) USER MOD Set 9.2: A1900 THR OG1 : rot 180:sc= -0.0853 USER MOD Single : A1887 SER OG : rot 180:sc= 0 USER MOD Single : A1888 ASN : amide:sc= -1.12! X(o=-1.1!,f=-1.3) USER MOD Single : A1890 GLN : amide:sc= 0.408 K(o=0.41,f=-1.9!) USER MOD Single : A1896 THR OG1 : rot 180:sc= -0.721 USER MOD Single : A1902 HIS : no HD1:sc= 0.849 K(o=0.85,f=-3.4!) USER MOD Single : A1907 THR OG1 : rot 133:sc= 1.49 USER MOD Single : A1908 SER OG : rot 82:sc= 1.28 USER MOD Single : A1913 SER OG : rot 180:sc= 0.0212 USER MOD Single : A1915 TYR OH : rot 180:sc= 0 USER MOD Single : A1918 THR OG1 : rot 180:sc= 0 USER MOD Single : A1920 SER OG : rot 180:sc= 0 USER MOD Single : A1921 HIS : no HD1:sc= -0.651 X(o=-0.65,f=-0.65) USER MOD Single : A1922 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1928 ASN : amide:sc= -0.62 K(o=-0.62,f=-8.5!) USER MOD Single : A1934 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0532) USER MOD Single : A1935 SER OG : rot 150:sc= 0.00698 USER MOD Single : A1936 SER OG : rot 0:sc= 0.436 USER MOD Single : A1939 ASN : amide:sc= -0.131 X(o=-0.13,f=0) USER MOD Single : A1946 THR OG1 : rot 180:sc= 0 USER MOD Single : A1950 LYS NZ :NH3+ 154:sc= 1.16 (180deg=-0.59) USER MOD Single : A1951 THR OG1 : rot 35:sc= 0.0475 USER MOD Single : A1953 ASN : amide:sc= -0.243 K(o=-0.24,f=-4.7!) USER MOD Single : A1956 LYS NZ :NH3+ -167:sc= 1.23 (180deg=0.945) USER MOD Single : A1959 LYS NZ :NH3+ -165:sc= 1.18 (180deg=1.09) USER MOD Single : A1962 THR OG1 : rot 180:sc= 0 USER MOD Single : A1963 TYR OH : rot 180:sc= 0 USER MOD Single : A1966 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A1972 TYR OH : rot -150:sc= 1.01 USER MOD Single : A1980 THR OG1 : rot 180:sc= 0 USER MOD Single : A1983 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1985 LYS NZ :NH3+ -176:sc= 1.14 (180deg=1.06) USER MOD Single : A1986 HIS : no HE2:sc= -3.01! C(o=-3!,f=-8.4!) USER MOD Single : A1987 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1989 TYR OH : rot 180:sc= 0 USER MOD Single : A1996 SER OG : rot 180:sc= 0 USER MOD Single : A2008 SER OG : rot 180:sc= 0 USER MOD Single : A2012 GLN : amide:sc= -1.08 K(o=-1.1,f=0) USER MOD Single : A2017 TYR OH : rot 180:sc= 0 USER MOD Single : A2019 SER OG : rot 180:sc= -0.888 USER MOD Single : A2021 HIS : no HD1:sc= -0.0668 X(o=-0.067,f=0) USER MOD Single : A2023 SER OG : rot 180:sc= 0.0292 USER MOD ----------------------------------------------------------------- ATOM 42 N SER A1887 11.385 9.766 6.333 1.00 1.11 N ATOM 43 CA SER A1887 11.194 8.850 7.454 1.00 1.23 C ATOM 44 C SER A1887 10.242 9.392 8.522 1.00 1.05 C ATOM 45 O SER A1887 10.420 10.487 9.076 1.00 1.33 O ATOM 46 CB SER A1887 12.541 8.382 8.044 1.00 1.99 C ATOM 47 OG SER A1887 12.372 7.354 9.012 1.00 2.83 O ATOM 0 HA SER A1887 10.698 7.968 7.048 1.00 1.23 H new ATOM 0 HB2 SER A1887 13.183 8.021 7.240 1.00 1.99 H new ATOM 0 HB3 SER A1887 13.050 9.230 8.502 1.00 1.99 H new ATOM 0 HG SER A1887 13.248 7.085 9.360 1.00 2.83 H new ATOM 53 N ASN A1888 9.223 8.630 8.769 1.00 0.86 N ATOM 54 CA ASN A1888 8.234 8.938 9.751 1.00 0.91 C ATOM 55 C ASN A1888 8.097 7.751 10.650 1.00 0.87 C ATOM 56 O ASN A1888 7.550 6.718 10.264 1.00 1.23 O ATOM 57 CB ASN A1888 6.922 9.211 9.070 1.00 1.19 C ATOM 58 CG ASN A1888 5.800 9.629 9.998 1.00 1.37 C ATOM 59 OD1 ASN A1888 6.017 10.243 11.040 1.00 1.91 O ATOM 60 ND2 ASN A1888 4.593 9.318 9.604 1.00 1.53 N ATOM 0 H ASN A1888 9.052 7.752 8.279 1.00 0.86 H new ATOM 0 HA ASN A1888 8.523 9.818 10.325 1.00 0.91 H new ATOM 0 HB2 ASN A1888 7.071 9.994 8.326 1.00 1.19 H new ATOM 0 HB3 ASN A1888 6.615 8.314 8.532 1.00 1.19 H new ATOM 0 HD21 ASN A1888 3.787 9.586 10.169 1.00 1.53 H new ATOM 0 HD22 ASN A1888 4.457 8.807 8.732 1.00 1.53 H new ATOM 67 N VAL A1889 8.599 7.864 11.815 1.00 0.91 N ATOM 68 CA VAL A1889 8.551 6.772 12.728 1.00 1.02 C ATOM 69 C VAL A1889 7.320 6.877 13.614 1.00 1.13 C ATOM 70 O VAL A1889 7.349 7.366 14.747 1.00 1.41 O ATOM 71 CB VAL A1889 9.895 6.527 13.515 1.00 1.34 C ATOM 72 CG1 VAL A1889 10.350 7.743 14.314 1.00 1.98 C ATOM 73 CG2 VAL A1889 9.804 5.283 14.398 1.00 2.12 C ATOM 0 H VAL A1889 9.054 8.705 12.171 1.00 0.91 H new ATOM 0 HA VAL A1889 8.449 5.861 12.138 1.00 1.02 H new ATOM 0 HB VAL A1889 10.663 6.353 12.761 1.00 1.34 H new ATOM 0 HG11 VAL A1889 11.280 7.510 14.833 1.00 1.98 H new ATOM 0 HG12 VAL A1889 10.512 8.583 13.638 1.00 1.98 H new ATOM 0 HG13 VAL A1889 9.584 8.007 15.043 1.00 1.98 H new ATOM 0 HG21 VAL A1889 10.747 5.142 14.927 1.00 2.12 H new ATOM 0 HG22 VAL A1889 8.998 5.408 15.121 1.00 2.12 H new ATOM 0 HG23 VAL A1889 9.603 4.410 13.777 1.00 2.12 H new ATOM 83 N GLN A1890 6.204 6.536 13.016 1.00 1.17 N ATOM 84 CA GLN A1890 4.939 6.517 13.719 1.00 1.48 C ATOM 85 C GLN A1890 4.638 5.061 14.056 1.00 1.69 C ATOM 86 O GLN A1890 3.799 4.739 14.889 1.00 2.49 O ATOM 87 CB GLN A1890 3.842 7.150 12.815 1.00 1.71 C ATOM 88 CG GLN A1890 3.204 6.234 11.768 1.00 1.52 C ATOM 89 CD GLN A1890 1.929 5.574 12.294 1.00 2.03 C ATOM 90 OE1 GLN A1890 1.226 6.136 13.139 1.00 2.63 O ATOM 91 NE2 GLN A1890 1.626 4.403 11.812 1.00 2.40 N ATOM 0 H GLN A1890 6.144 6.265 12.034 1.00 1.17 H new ATOM 0 HA GLN A1890 4.970 7.100 14.640 1.00 1.48 H new ATOM 0 HB2 GLN A1890 3.051 7.535 13.458 1.00 1.71 H new ATOM 0 HB3 GLN A1890 4.278 8.006 12.299 1.00 1.71 H new ATOM 0 HG2 GLN A1890 2.972 6.811 10.873 1.00 1.52 H new ATOM 0 HG3 GLN A1890 3.918 5.464 11.475 1.00 1.52 H new ATOM 0 HE21 GLN A1890 2.229 3.967 11.115 1.00 2.40 H new ATOM 0 HE22 GLN A1890 0.785 3.922 12.132 1.00 2.40 H new ATOM 100 N ASN A1891 5.427 4.214 13.428 1.00 1.59 N ATOM 101 CA ASN A1891 5.322 2.780 13.462 1.00 1.88 C ATOM 102 C ASN A1891 6.546 2.234 12.742 1.00 1.48 C ATOM 103 O ASN A1891 7.158 2.988 11.969 1.00 1.86 O ATOM 104 CB ASN A1891 4.015 2.348 12.759 1.00 2.50 C ATOM 105 CG ASN A1891 3.998 0.899 12.395 1.00 3.17 C ATOM 106 OD1 ASN A1891 4.327 0.539 11.256 1.00 3.82 O ATOM 107 ND2 ASN A1891 3.696 0.070 13.337 1.00 3.53 N ATOM 0 H ASN A1891 6.203 4.533 12.847 1.00 1.59 H new ATOM 0 HA ASN A1891 5.288 2.396 14.481 1.00 1.88 H new ATOM 0 HB2 ASN A1891 3.170 2.562 13.413 1.00 2.50 H new ATOM 0 HB3 ASN A1891 3.880 2.945 11.857 1.00 2.50 H new ATOM 0 HD21 ASN A1891 3.722 -0.934 13.160 1.00 3.53 H new ATOM 0 HD22 ASN A1891 3.431 0.419 14.258 1.00 3.53 H new ATOM 114 N ASP A1892 6.874 0.964 12.932 1.00 1.00 N ATOM 115 CA ASP A1892 8.075 0.364 12.344 1.00 1.01 C ATOM 116 C ASP A1892 7.826 -0.119 10.906 1.00 1.00 C ATOM 117 O ASP A1892 7.998 0.656 9.976 1.00 1.59 O ATOM 118 CB ASP A1892 8.623 -0.759 13.239 1.00 1.40 C ATOM 119 CG ASP A1892 9.879 -1.405 12.700 1.00 2.05 C ATOM 120 OD1 ASP A1892 10.975 -0.818 12.838 1.00 2.61 O ATOM 121 OD2 ASP A1892 9.801 -2.541 12.179 1.00 2.66 O ATOM 0 H ASP A1892 6.321 0.318 13.495 1.00 1.00 H new ATOM 0 HA ASP A1892 8.838 1.140 12.285 1.00 1.01 H new ATOM 0 HB2 ASP A1892 8.829 -0.354 14.230 1.00 1.40 H new ATOM 0 HB3 ASP A1892 7.855 -1.523 13.360 1.00 1.40 H new ATOM 126 N CYS A1893 7.338 -1.349 10.741 1.00 0.74 N ATOM 127 CA CYS A1893 7.053 -1.950 9.414 1.00 0.87 C ATOM 128 C CYS A1893 8.257 -1.836 8.454 1.00 0.75 C ATOM 129 O CYS A1893 8.314 -0.937 7.597 1.00 0.80 O ATOM 130 CB CYS A1893 5.781 -1.334 8.793 1.00 1.17 C ATOM 131 SG CYS A1893 5.196 -2.072 7.216 1.00 1.58 S ATOM 0 H CYS A1893 7.124 -1.969 11.522 1.00 0.74 H new ATOM 0 HA CYS A1893 6.874 -3.014 9.572 1.00 0.87 H new ATOM 0 HB2 CYS A1893 4.975 -1.408 9.523 1.00 1.17 H new ATOM 0 HB3 CYS A1893 5.963 -0.272 8.626 1.00 1.17 H new ATOM 136 N ARG A1894 9.247 -2.690 8.658 1.00 0.73 N ATOM 137 CA ARG A1894 10.437 -2.715 7.824 1.00 0.73 C ATOM 138 C ARG A1894 11.143 -4.059 7.955 1.00 0.72 C ATOM 139 O ARG A1894 11.136 -4.675 9.035 1.00 0.92 O ATOM 140 CB ARG A1894 11.388 -1.529 8.137 1.00 0.85 C ATOM 141 CG ARG A1894 11.801 -1.419 9.580 1.00 1.21 C ATOM 142 CD ARG A1894 12.713 -0.234 9.818 1.00 1.35 C ATOM 143 NE ARG A1894 13.071 -0.132 11.231 1.00 1.45 N ATOM 144 CZ ARG A1894 14.246 0.306 11.709 1.00 1.80 C ATOM 145 NH1 ARG A1894 15.162 0.820 10.889 1.00 2.09 N ATOM 146 NH2 ARG A1894 14.491 0.249 13.013 1.00 2.57 N ATOM 0 H ARG A1894 9.248 -3.384 9.405 1.00 0.73 H new ATOM 0 HA ARG A1894 10.127 -2.594 6.786 1.00 0.73 H new ATOM 0 HB2 ARG A1894 12.283 -1.627 7.523 1.00 0.85 H new ATOM 0 HB3 ARG A1894 10.899 -0.601 7.841 1.00 0.85 H new ATOM 0 HG2 ARG A1894 10.913 -1.325 10.205 1.00 1.21 H new ATOM 0 HG3 ARG A1894 12.309 -2.335 9.883 1.00 1.21 H new ATOM 0 HD2 ARG A1894 13.616 -0.337 9.216 1.00 1.35 H new ATOM 0 HD3 ARG A1894 12.218 0.682 9.496 1.00 1.35 H new ATOM 0 HE ARG A1894 12.368 -0.418 11.912 1.00 1.45 H new ATOM 0 HH11 ARG A1894 14.973 0.883 9.889 1.00 2.09 H new ATOM 0 HH12 ARG A1894 16.052 1.150 11.262 1.00 2.09 H new ATOM 0 HH21 ARG A1894 13.787 -0.127 13.648 1.00 2.57 H new ATOM 0 HH22 ARG A1894 15.383 0.581 13.379 1.00 2.57 H new ATOM 160 N VAL A1895 11.731 -4.526 6.881 1.00 0.58 N ATOM 161 CA VAL A1895 12.369 -5.837 6.861 1.00 0.60 C ATOM 162 C VAL A1895 13.625 -5.809 5.986 1.00 0.52 C ATOM 163 O VAL A1895 13.635 -5.195 4.933 1.00 0.47 O ATOM 164 CB VAL A1895 11.362 -6.952 6.379 1.00 0.63 C ATOM 165 CG1 VAL A1895 10.778 -6.636 5.011 1.00 0.57 C ATOM 166 CG2 VAL A1895 12.009 -8.332 6.368 1.00 0.72 C ATOM 0 H VAL A1895 11.786 -4.019 5.998 1.00 0.58 H new ATOM 0 HA VAL A1895 12.670 -6.085 7.879 1.00 0.60 H new ATOM 0 HB VAL A1895 10.546 -6.963 7.102 1.00 0.63 H new ATOM 0 HG11 VAL A1895 10.090 -7.429 4.717 1.00 0.57 H new ATOM 0 HG12 VAL A1895 10.242 -5.688 5.054 1.00 0.57 H new ATOM 0 HG13 VAL A1895 11.583 -6.564 4.280 1.00 0.57 H new ATOM 0 HG21 VAL A1895 11.283 -9.072 6.030 1.00 0.72 H new ATOM 0 HG22 VAL A1895 12.864 -8.328 5.692 1.00 0.72 H new ATOM 0 HG23 VAL A1895 12.344 -8.585 7.374 1.00 0.72 H new ATOM 176 N THR A1896 14.683 -6.410 6.454 1.00 0.63 N ATOM 177 CA THR A1896 15.914 -6.462 5.701 1.00 0.69 C ATOM 178 C THR A1896 15.915 -7.715 4.821 1.00 0.69 C ATOM 179 O THR A1896 15.529 -8.792 5.282 1.00 0.76 O ATOM 180 CB THR A1896 17.131 -6.524 6.659 1.00 0.89 C ATOM 181 OG1 THR A1896 16.964 -5.561 7.713 1.00 0.98 O ATOM 182 CG2 THR A1896 18.424 -6.216 5.911 1.00 1.02 C ATOM 0 H THR A1896 14.721 -6.876 7.361 1.00 0.63 H new ATOM 0 HA THR A1896 15.987 -5.566 5.085 1.00 0.69 H new ATOM 0 HB THR A1896 17.190 -7.531 7.073 1.00 0.89 H new ATOM 0 HG1 THR A1896 17.733 -5.602 8.319 1.00 0.98 H new ATOM 0 HG21 THR A1896 19.265 -6.265 6.603 1.00 1.02 H new ATOM 0 HG22 THR A1896 18.566 -6.946 5.114 1.00 1.02 H new ATOM 0 HG23 THR A1896 18.366 -5.216 5.481 1.00 1.02 H new ATOM 190 N ASN A1897 16.291 -7.575 3.570 1.00 0.75 N ATOM 191 CA ASN A1897 16.438 -8.730 2.706 1.00 0.88 C ATOM 192 C ASN A1897 17.908 -9.031 2.523 1.00 1.04 C ATOM 193 O ASN A1897 18.614 -8.289 1.822 1.00 1.06 O ATOM 194 CB ASN A1897 15.778 -8.519 1.342 1.00 0.95 C ATOM 195 CG ASN A1897 15.957 -9.716 0.412 1.00 1.17 C ATOM 196 OD1 ASN A1897 16.086 -10.848 0.854 1.00 1.65 O ATOM 197 ND2 ASN A1897 15.980 -9.473 -0.869 1.00 1.21 N ATOM 0 H ASN A1897 16.500 -6.680 3.128 1.00 0.75 H new ATOM 0 HA ASN A1897 15.935 -9.571 3.183 1.00 0.88 H new ATOM 0 HB2 ASN A1897 14.714 -8.329 1.483 1.00 0.95 H new ATOM 0 HB3 ASN A1897 16.201 -7.631 0.871 1.00 0.95 H new ATOM 0 HD21 ASN A1897 16.108 -10.238 -1.531 1.00 1.21 H new ATOM 0 HD22 ASN A1897 15.870 -8.518 -1.209 1.00 1.21 H new ATOM 204 N PRO A1898 18.397 -10.117 3.149 1.00 1.26 N ATOM 205 CA PRO A1898 19.813 -10.510 3.102 1.00 1.47 C ATOM 206 C PRO A1898 20.296 -10.780 1.682 1.00 1.54 C ATOM 207 O PRO A1898 21.454 -10.541 1.367 1.00 1.71 O ATOM 208 CB PRO A1898 19.867 -11.801 3.937 1.00 1.73 C ATOM 209 CG PRO A1898 18.460 -12.286 3.989 1.00 1.69 C ATOM 210 CD PRO A1898 17.605 -11.059 3.970 1.00 1.40 C ATOM 0 HA PRO A1898 20.459 -9.718 3.480 1.00 1.47 H new ATOM 0 HB2 PRO A1898 20.523 -12.541 3.478 1.00 1.73 H new ATOM 0 HB3 PRO A1898 20.255 -11.608 4.937 1.00 1.73 H new ATOM 0 HG2 PRO A1898 18.237 -12.931 3.139 1.00 1.69 H new ATOM 0 HG3 PRO A1898 18.282 -12.873 4.890 1.00 1.69 H new ATOM 0 HD2 PRO A1898 16.627 -11.255 3.530 1.00 1.40 H new ATOM 0 HD3 PRO A1898 17.431 -10.672 4.974 1.00 1.40 H new ATOM 218 N ALA A1899 19.377 -11.226 0.821 1.00 1.48 N ATOM 219 CA ALA A1899 19.686 -11.557 -0.570 1.00 1.62 C ATOM 220 C ALA A1899 20.215 -10.349 -1.329 1.00 1.54 C ATOM 221 O ALA A1899 21.159 -10.454 -2.117 1.00 1.69 O ATOM 222 CB ALA A1899 18.453 -12.098 -1.261 1.00 1.72 C ATOM 0 H ALA A1899 18.398 -11.367 1.070 1.00 1.48 H new ATOM 0 HA ALA A1899 20.466 -12.319 -0.565 1.00 1.62 H new ATOM 0 HB1 ALA A1899 18.693 -12.341 -2.296 1.00 1.72 H new ATOM 0 HB2 ALA A1899 18.112 -12.997 -0.747 1.00 1.72 H new ATOM 0 HB3 ALA A1899 17.664 -11.346 -1.239 1.00 1.72 H new ATOM 228 N THR A1900 19.618 -9.217 -1.083 1.00 1.37 N ATOM 229 CA THR A1900 20.011 -8.003 -1.743 1.00 1.38 C ATOM 230 C THR A1900 20.951 -7.191 -0.845 1.00 1.36 C ATOM 231 O THR A1900 21.772 -6.397 -1.317 1.00 1.53 O ATOM 232 CB THR A1900 18.765 -7.166 -2.033 1.00 1.31 C ATOM 233 OG1 THR A1900 17.752 -8.014 -2.574 1.00 1.45 O ATOM 234 CG2 THR A1900 19.081 -6.082 -3.033 1.00 1.46 C ATOM 0 H THR A1900 18.848 -9.109 -0.422 1.00 1.37 H new ATOM 0 HA THR A1900 20.526 -8.255 -2.670 1.00 1.38 H new ATOM 0 HB THR A1900 18.422 -6.706 -1.106 1.00 1.31 H new ATOM 0 HG1 THR A1900 16.948 -7.485 -2.761 1.00 1.45 H new ATOM 0 HG21 THR A1900 18.184 -5.495 -3.229 1.00 1.46 H new ATOM 0 HG22 THR A1900 19.859 -5.433 -2.632 1.00 1.46 H new ATOM 0 HG23 THR A1900 19.429 -6.534 -3.962 1.00 1.46 H new ATOM 242 N GLY A1901 20.816 -7.393 0.454 1.00 1.23 N ATOM 243 CA GLY A1901 21.568 -6.621 1.412 1.00 1.29 C ATOM 244 C GLY A1901 20.928 -5.265 1.590 1.00 1.27 C ATOM 245 O GLY A1901 21.548 -4.323 2.081 1.00 1.46 O ATOM 0 H GLY A1901 20.191 -8.087 0.864 1.00 1.23 H new ATOM 0 HA2 GLY A1901 21.604 -7.145 2.367 1.00 1.29 H new ATOM 0 HA3 GLY A1901 22.597 -6.506 1.073 1.00 1.29 H new ATOM 249 N HIS A1902 19.679 -5.170 1.163 1.00 1.12 N ATOM 250 CA HIS A1902 18.937 -3.938 1.215 1.00 1.15 C ATOM 251 C HIS A1902 17.827 -4.043 2.239 1.00 0.91 C ATOM 252 O HIS A1902 16.985 -4.953 2.175 1.00 0.84 O ATOM 253 CB HIS A1902 18.371 -3.570 -0.181 1.00 1.34 C ATOM 254 CG HIS A1902 17.672 -2.219 -0.269 1.00 2.00 C ATOM 255 ND1 HIS A1902 18.330 -1.050 -0.580 1.00 2.46 N ATOM 256 CD2 HIS A1902 16.368 -1.874 -0.118 1.00 2.87 C ATOM 257 CE1 HIS A1902 17.466 -0.052 -0.611 1.00 3.18 C ATOM 258 NE2 HIS A1902 16.274 -0.528 -0.337 1.00 3.41 N ATOM 0 H HIS A1902 19.157 -5.953 0.770 1.00 1.12 H new ATOM 0 HA HIS A1902 19.614 -3.139 1.517 1.00 1.15 H new ATOM 0 HB2 HIS A1902 19.189 -3.584 -0.901 1.00 1.34 H new ATOM 0 HB3 HIS A1902 17.667 -4.345 -0.484 1.00 1.34 H new ATOM 0 HD2 HIS A1902 15.555 -2.540 0.130 1.00 2.87 H new ATOM 0 HE1 HIS A1902 17.700 0.980 -0.825 1.00 3.18 H new ATOM 0 HE2 HIS A1902 15.414 0.019 -0.294 1.00 3.41 H new ATOM 267 N LEU A1903 17.876 -3.167 3.189 1.00 0.87 N ATOM 268 CA LEU A1903 16.838 -3.009 4.164 1.00 0.75 C ATOM 269 C LEU A1903 15.650 -2.376 3.491 1.00 0.70 C ATOM 270 O LEU A1903 15.780 -1.339 2.846 1.00 0.88 O ATOM 271 CB LEU A1903 17.331 -2.116 5.327 1.00 0.94 C ATOM 272 CG LEU A1903 16.271 -1.627 6.344 1.00 0.99 C ATOM 273 CD1 LEU A1903 15.578 -2.780 7.046 1.00 1.34 C ATOM 274 CD2 LEU A1903 16.901 -0.690 7.357 1.00 1.48 C ATOM 0 H LEU A1903 18.657 -2.524 3.315 1.00 0.87 H new ATOM 0 HA LEU A1903 16.561 -3.980 4.575 1.00 0.75 H new ATOM 0 HB2 LEU A1903 18.095 -2.667 5.875 1.00 0.94 H new ATOM 0 HB3 LEU A1903 17.816 -1.240 4.897 1.00 0.94 H new ATOM 0 HG LEU A1903 15.510 -1.085 5.783 1.00 0.99 H new ATOM 0 HD11 LEU A1903 14.843 -2.389 7.750 1.00 1.34 H new ATOM 0 HD12 LEU A1903 15.076 -3.406 6.308 1.00 1.34 H new ATOM 0 HD13 LEU A1903 16.316 -3.374 7.585 1.00 1.34 H new ATOM 0 HD21 LEU A1903 16.142 -0.356 8.064 1.00 1.48 H new ATOM 0 HD22 LEU A1903 17.692 -1.213 7.894 1.00 1.48 H new ATOM 0 HD23 LEU A1903 17.322 0.173 6.842 1.00 1.48 H new ATOM 286 N PHE A1904 14.511 -2.983 3.621 1.00 0.53 N ATOM 287 CA PHE A1904 13.340 -2.413 3.059 1.00 0.51 C ATOM 288 C PHE A1904 12.721 -1.587 4.133 1.00 0.48 C ATOM 289 O PHE A1904 12.143 -2.108 5.100 1.00 0.49 O ATOM 290 CB PHE A1904 12.350 -3.479 2.580 1.00 0.51 C ATOM 291 CG PHE A1904 12.849 -4.387 1.484 1.00 0.58 C ATOM 292 CD1 PHE A1904 13.361 -3.868 0.316 1.00 1.01 C ATOM 293 CD2 PHE A1904 12.780 -5.758 1.619 1.00 0.71 C ATOM 294 CE1 PHE A1904 13.800 -4.697 -0.699 1.00 1.17 C ATOM 295 CE2 PHE A1904 13.207 -6.590 0.611 1.00 0.79 C ATOM 296 CZ PHE A1904 13.720 -6.060 -0.552 1.00 0.86 C ATOM 0 H PHE A1904 14.374 -3.868 4.110 1.00 0.53 H new ATOM 0 HA PHE A1904 13.598 -1.820 2.181 1.00 0.51 H new ATOM 0 HB2 PHE A1904 12.064 -4.093 3.434 1.00 0.51 H new ATOM 0 HB3 PHE A1904 11.447 -2.979 2.230 1.00 0.51 H new ATOM 0 HD1 PHE A1904 13.420 -2.797 0.191 1.00 1.01 H new ATOM 0 HD2 PHE A1904 12.385 -6.184 2.529 1.00 0.71 H new ATOM 0 HE1 PHE A1904 14.205 -4.274 -1.606 1.00 1.17 H new ATOM 0 HE2 PHE A1904 13.140 -7.661 0.732 1.00 0.79 H new ATOM 0 HZ PHE A1904 14.057 -6.712 -1.344 1.00 0.86 H new ATOM 306 N ASP A1905 12.920 -0.316 3.998 1.00 0.57 N ATOM 307 CA ASP A1905 12.470 0.666 4.938 1.00 0.61 C ATOM 308 C ASP A1905 11.367 1.474 4.330 1.00 0.55 C ATOM 309 O ASP A1905 11.597 2.265 3.408 1.00 0.71 O ATOM 310 CB ASP A1905 13.632 1.592 5.327 1.00 0.88 C ATOM 311 CG ASP A1905 13.209 2.751 6.209 1.00 1.37 C ATOM 312 OD1 ASP A1905 12.800 3.797 5.683 1.00 1.95 O ATOM 313 OD2 ASP A1905 13.253 2.630 7.452 1.00 1.97 O ATOM 0 H ASP A1905 13.418 0.084 3.203 1.00 0.57 H new ATOM 0 HA ASP A1905 12.102 0.162 5.831 1.00 0.61 H new ATOM 0 HB2 ASP A1905 14.393 1.009 5.846 1.00 0.88 H new ATOM 0 HB3 ASP A1905 14.093 1.984 4.421 1.00 0.88 H new ATOM 318 N LEU A1906 10.173 1.258 4.792 1.00 0.48 N ATOM 319 CA LEU A1906 9.066 2.033 4.316 1.00 0.48 C ATOM 320 C LEU A1906 8.602 3.003 5.371 1.00 0.52 C ATOM 321 O LEU A1906 7.596 3.707 5.212 1.00 0.71 O ATOM 322 CB LEU A1906 7.953 1.164 3.756 1.00 0.50 C ATOM 323 CG LEU A1906 8.332 0.392 2.484 1.00 0.47 C ATOM 324 CD1 LEU A1906 7.167 -0.404 1.973 1.00 0.53 C ATOM 325 CD2 LEU A1906 8.835 1.337 1.397 1.00 0.54 C ATOM 0 H LEU A1906 9.940 0.556 5.494 1.00 0.48 H new ATOM 0 HA LEU A1906 9.407 2.630 3.471 1.00 0.48 H new ATOM 0 HB2 LEU A1906 7.645 0.451 4.521 1.00 0.50 H new ATOM 0 HB3 LEU A1906 7.090 1.794 3.541 1.00 0.50 H new ATOM 0 HG LEU A1906 9.137 -0.295 2.745 1.00 0.47 H new ATOM 0 HD11 LEU A1906 7.461 -0.942 1.072 1.00 0.53 H new ATOM 0 HD12 LEU A1906 6.852 -1.117 2.734 1.00 0.53 H new ATOM 0 HD13 LEU A1906 6.341 0.268 1.741 1.00 0.53 H new ATOM 0 HD21 LEU A1906 9.096 0.763 0.508 1.00 0.54 H new ATOM 0 HD22 LEU A1906 8.053 2.055 1.149 1.00 0.54 H new ATOM 0 HD23 LEU A1906 9.716 1.869 1.757 1.00 0.54 H new ATOM 337 N THR A1907 9.357 3.054 6.450 1.00 0.66 N ATOM 338 CA THR A1907 9.228 4.009 7.466 1.00 0.74 C ATOM 339 C THR A1907 9.421 5.412 6.874 1.00 0.69 C ATOM 340 O THR A1907 8.775 6.363 7.288 1.00 0.70 O ATOM 341 CB THR A1907 10.319 3.706 8.473 1.00 1.11 C ATOM 342 OG1 THR A1907 10.809 2.376 8.173 1.00 1.59 O ATOM 343 CG2 THR A1907 9.725 3.654 9.825 1.00 1.13 C ATOM 0 H THR A1907 10.107 2.385 6.625 1.00 0.66 H new ATOM 0 HA THR A1907 8.244 3.975 7.934 1.00 0.74 H new ATOM 0 HB THR A1907 11.104 4.461 8.430 1.00 1.11 H new ATOM 0 HG1 THR A1907 11.789 2.385 8.156 1.00 1.59 H new ATOM 0 HG21 THR A1907 10.503 3.436 10.556 1.00 1.13 H new ATOM 0 HG22 THR A1907 9.267 4.615 10.058 1.00 1.13 H new ATOM 0 HG23 THR A1907 8.966 2.872 9.859 1.00 1.13 H new ATOM 351 N SER A1908 10.271 5.503 5.865 1.00 0.83 N ATOM 352 CA SER A1908 10.520 6.748 5.177 1.00 1.00 C ATOM 353 C SER A1908 9.389 7.132 4.215 1.00 0.94 C ATOM 354 O SER A1908 9.342 8.260 3.749 1.00 1.16 O ATOM 355 CB SER A1908 11.851 6.677 4.433 1.00 1.28 C ATOM 356 OG SER A1908 12.912 6.397 5.339 1.00 1.36 O ATOM 0 H SER A1908 10.805 4.713 5.504 1.00 0.83 H new ATOM 0 HA SER A1908 10.565 7.530 5.935 1.00 1.00 H new ATOM 0 HB2 SER A1908 11.805 5.904 3.666 1.00 1.28 H new ATOM 0 HB3 SER A1908 12.040 7.621 3.922 1.00 1.28 H new ATOM 0 HG SER A1908 12.949 5.433 5.511 1.00 1.36 H new ATOM 362 N LEU A1909 8.478 6.214 3.959 1.00 0.76 N ATOM 363 CA LEU A1909 7.431 6.446 2.974 1.00 0.87 C ATOM 364 C LEU A1909 6.073 6.628 3.654 1.00 0.82 C ATOM 365 O LEU A1909 5.114 7.096 3.047 1.00 1.00 O ATOM 366 CB LEU A1909 7.368 5.250 2.027 1.00 0.89 C ATOM 367 CG LEU A1909 6.604 5.447 0.716 1.00 1.28 C ATOM 368 CD1 LEU A1909 7.223 6.579 -0.096 1.00 2.03 C ATOM 369 CD2 LEU A1909 6.610 4.158 -0.090 1.00 1.67 C ATOM 0 H LEU A1909 8.438 5.303 4.415 1.00 0.76 H new ATOM 0 HA LEU A1909 7.663 7.356 2.421 1.00 0.87 H new ATOM 0 HB2 LEU A1909 8.389 4.955 1.784 1.00 0.89 H new ATOM 0 HB3 LEU A1909 6.914 4.416 2.563 1.00 0.89 H new ATOM 0 HG LEU A1909 5.573 5.712 0.950 1.00 1.28 H new ATOM 0 HD11 LEU A1909 6.668 6.706 -1.025 1.00 2.03 H new ATOM 0 HD12 LEU A1909 7.183 7.504 0.480 1.00 2.03 H new ATOM 0 HD13 LEU A1909 8.261 6.338 -0.324 1.00 2.03 H new ATOM 0 HD21 LEU A1909 6.064 4.309 -1.021 1.00 1.67 H new ATOM 0 HD22 LEU A1909 7.638 3.874 -0.314 1.00 1.67 H new ATOM 0 HD23 LEU A1909 6.132 3.366 0.487 1.00 1.67 H new ATOM 381 N LYS A1910 5.992 6.256 4.912 1.00 0.69 N ATOM 382 CA LYS A1910 4.731 6.318 5.623 1.00 0.78 C ATOM 383 C LYS A1910 4.463 7.715 6.146 1.00 0.81 C ATOM 384 O LYS A1910 5.378 8.469 6.454 1.00 0.92 O ATOM 385 CB LYS A1910 4.687 5.333 6.806 1.00 0.85 C ATOM 386 CG LYS A1910 5.617 5.698 7.947 1.00 1.10 C ATOM 387 CD LYS A1910 5.565 4.683 9.063 1.00 1.40 C ATOM 388 CE LYS A1910 6.068 3.333 8.585 1.00 2.20 C ATOM 389 NZ LYS A1910 5.995 2.307 9.624 1.00 2.72 N ATOM 0 H LYS A1910 6.778 5.909 5.462 1.00 0.69 H new ATOM 0 HA LYS A1910 3.961 6.041 4.902 1.00 0.78 H new ATOM 0 HB2 LYS A1910 3.666 5.282 7.185 1.00 0.85 H new ATOM 0 HB3 LYS A1910 4.944 4.337 6.446 1.00 0.85 H new ATOM 0 HG2 LYS A1910 6.638 5.774 7.573 1.00 1.10 H new ATOM 0 HG3 LYS A1910 5.346 6.679 8.336 1.00 1.10 H new ATOM 0 HD2 LYS A1910 6.171 5.026 9.902 1.00 1.40 H new ATOM 0 HD3 LYS A1910 4.542 4.587 9.427 1.00 1.40 H new ATOM 0 HE2 LYS A1910 5.481 3.015 7.723 1.00 2.20 H new ATOM 0 HE3 LYS A1910 7.100 3.432 8.249 1.00 2.20 H new ATOM 0 HZ1 LYS A1910 6.763 1.619 9.487 1.00 2.72 H new ATOM 0 HZ2 LYS A1910 6.091 2.752 10.559 1.00 2.72 H new ATOM 0 HZ3 LYS A1910 5.079 1.819 9.566 1.00 2.72 H new ATOM 403 N ARG A1911 3.213 8.024 6.254 1.00 0.82 N ATOM 404 CA ARG A1911 2.730 9.232 6.848 1.00 0.91 C ATOM 405 C ARG A1911 1.310 8.934 7.227 1.00 0.98 C ATOM 406 O ARG A1911 0.747 7.996 6.679 1.00 1.03 O ATOM 407 CB ARG A1911 2.851 10.437 5.890 1.00 0.99 C ATOM 408 CG ARG A1911 2.062 10.351 4.595 1.00 1.05 C ATOM 409 CD ARG A1911 2.413 11.524 3.702 1.00 1.26 C ATOM 410 NE ARG A1911 1.600 11.580 2.481 1.00 1.50 N ATOM 411 CZ ARG A1911 1.891 12.323 1.404 1.00 1.86 C ATOM 412 NH1 ARG A1911 3.032 13.013 1.350 1.00 1.90 N ATOM 413 NH2 ARG A1911 1.044 12.376 0.387 1.00 2.60 N ATOM 0 H ARG A1911 2.466 7.417 5.917 1.00 0.82 H new ATOM 0 HA ARG A1911 3.319 9.524 7.717 1.00 0.91 H new ATOM 0 HB2 ARG A1911 2.534 11.332 6.425 1.00 0.99 H new ATOM 0 HB3 ARG A1911 3.904 10.571 5.641 1.00 0.99 H new ATOM 0 HG2 ARG A1911 2.284 9.414 4.084 1.00 1.05 H new ATOM 0 HG3 ARG A1911 0.993 10.352 4.809 1.00 1.05 H new ATOM 0 HD2 ARG A1911 2.283 12.451 4.261 1.00 1.26 H new ATOM 0 HD3 ARG A1911 3.466 11.462 3.428 1.00 1.26 H new ATOM 0 HE ARG A1911 0.753 11.013 2.450 1.00 1.50 H new ATOM 0 HH11 ARG A1911 3.687 12.977 2.131 1.00 1.90 H new ATOM 0 HH12 ARG A1911 3.249 13.577 0.528 1.00 1.90 H new ATOM 0 HH21 ARG A1911 0.170 11.851 0.423 1.00 2.60 H new ATOM 0 HH22 ARG A1911 1.266 12.942 -0.432 1.00 2.60 H new ATOM 427 N GLU A1912 0.737 9.668 8.132 1.00 1.18 N ATOM 428 CA GLU A1912 -0.606 9.359 8.618 1.00 1.43 C ATOM 429 C GLU A1912 -1.619 9.617 7.527 1.00 1.27 C ATOM 430 O GLU A1912 -2.519 8.814 7.290 1.00 1.48 O ATOM 431 CB GLU A1912 -0.994 10.181 9.866 1.00 1.83 C ATOM 432 CG GLU A1912 -0.029 10.107 11.048 1.00 2.47 C ATOM 433 CD GLU A1912 1.238 10.884 10.818 1.00 2.80 C ATOM 434 OE1 GLU A1912 1.169 12.127 10.749 1.00 3.25 O ATOM 435 OE2 GLU A1912 2.308 10.279 10.656 1.00 3.16 O ATOM 0 H GLU A1912 1.165 10.489 8.559 1.00 1.18 H new ATOM 0 HA GLU A1912 -0.603 8.307 8.901 1.00 1.43 H new ATOM 0 HB2 GLU A1912 -1.095 11.225 9.571 1.00 1.83 H new ATOM 0 HB3 GLU A1912 -1.976 9.849 10.204 1.00 1.83 H new ATOM 0 HG2 GLU A1912 -0.526 10.487 11.941 1.00 2.47 H new ATOM 0 HG3 GLU A1912 0.221 9.064 11.242 1.00 2.47 H new ATOM 442 N SER A1913 -1.424 10.723 6.838 1.00 1.09 N ATOM 443 CA SER A1913 -2.297 11.184 5.777 1.00 1.05 C ATOM 444 C SER A1913 -2.463 10.148 4.649 1.00 0.93 C ATOM 445 O SER A1913 -3.499 10.101 3.991 1.00 1.08 O ATOM 446 CB SER A1913 -1.701 12.454 5.222 1.00 1.25 C ATOM 447 OG SER A1913 -1.347 13.326 6.279 1.00 1.86 O ATOM 0 H SER A1913 -0.632 11.343 7.005 1.00 1.09 H new ATOM 0 HA SER A1913 -3.292 11.350 6.189 1.00 1.05 H new ATOM 0 HB2 SER A1913 -0.821 12.221 4.622 1.00 1.25 H new ATOM 0 HB3 SER A1913 -2.417 12.943 4.561 1.00 1.25 H new ATOM 0 HG SER A1913 -0.959 14.147 5.910 1.00 1.86 H new ATOM 453 N GLY A1914 -1.458 9.313 4.455 1.00 0.88 N ATOM 454 CA GLY A1914 -1.497 8.348 3.385 1.00 0.88 C ATOM 455 C GLY A1914 -1.187 8.993 2.063 1.00 0.86 C ATOM 456 O GLY A1914 -0.647 10.110 2.028 1.00 1.14 O ATOM 0 H GLY A1914 -0.612 9.288 5.024 1.00 0.88 H new ATOM 0 HA2 GLY A1914 -0.779 7.552 3.582 1.00 0.88 H new ATOM 0 HA3 GLY A1914 -2.483 7.885 3.345 1.00 0.88 H new ATOM 460 N TYR A1915 -1.516 8.337 0.993 1.00 0.70 N ATOM 461 CA TYR A1915 -1.284 8.867 -0.305 1.00 0.82 C ATOM 462 C TYR A1915 -2.510 8.608 -1.174 1.00 0.65 C ATOM 463 O TYR A1915 -3.009 7.490 -1.233 1.00 0.66 O ATOM 464 CB TYR A1915 -0.025 8.274 -0.940 1.00 1.06 C ATOM 465 CG TYR A1915 0.551 9.166 -2.011 1.00 1.50 C ATOM 466 CD1 TYR A1915 0.030 9.143 -3.292 1.00 1.97 C ATOM 467 CD2 TYR A1915 1.625 9.997 -1.759 1.00 2.32 C ATOM 468 CE1 TYR A1915 0.560 9.926 -4.293 1.00 2.95 C ATOM 469 CE2 TYR A1915 2.167 10.777 -2.752 1.00 3.26 C ATOM 470 CZ TYR A1915 1.582 10.867 -3.935 1.00 3.50 C ATOM 471 OH TYR A1915 2.182 11.499 -5.012 1.00 4.60 O ATOM 0 H TYR A1915 -1.954 7.416 1.001 1.00 0.70 H new ATOM 0 HA TYR A1915 -1.118 9.941 -0.222 1.00 0.82 H new ATOM 0 HB2 TYR A1915 0.725 8.107 -0.167 1.00 1.06 H new ATOM 0 HB3 TYR A1915 -0.262 7.301 -1.370 1.00 1.06 H new ATOM 0 HD1 TYR A1915 -0.808 8.499 -3.511 1.00 1.97 H new ATOM 0 HD2 TYR A1915 2.046 10.034 -0.765 1.00 2.32 H new ATOM 0 HE1 TYR A1915 0.218 9.835 -5.313 1.00 2.95 H new ATOM 0 HE2 TYR A1915 3.080 11.322 -2.565 1.00 3.26 H new ATOM 0 HH TYR A1915 2.864 12.123 -4.687 1.00 4.60 H new ATOM 481 N THR A1916 -2.985 9.631 -1.812 1.00 0.65 N ATOM 482 CA THR A1916 -4.181 9.548 -2.619 1.00 0.60 C ATOM 483 C THR A1916 -3.883 9.487 -4.070 1.00 0.60 C ATOM 484 O THR A1916 -2.985 10.168 -4.595 1.00 0.76 O ATOM 485 CB THR A1916 -5.178 10.696 -2.288 1.00 0.79 C ATOM 486 OG1 THR A1916 -6.305 10.676 -3.175 1.00 1.21 O ATOM 487 CG2 THR A1916 -4.492 12.055 -2.365 1.00 1.26 C ATOM 0 H THR A1916 -2.558 10.557 -1.793 1.00 0.65 H new ATOM 0 HA THR A1916 -4.665 8.607 -2.360 1.00 0.60 H new ATOM 0 HB THR A1916 -5.530 10.534 -1.269 1.00 0.79 H new ATOM 0 HG1 THR A1916 -6.860 9.892 -2.981 1.00 1.21 H new ATOM 0 HG21 THR A1916 -5.211 12.839 -2.129 1.00 1.26 H new ATOM 0 HG22 THR A1916 -3.670 12.089 -1.649 1.00 1.26 H new ATOM 0 HG23 THR A1916 -4.103 12.210 -3.371 1.00 1.26 H new ATOM 495 N ILE A1917 -4.615 8.621 -4.686 1.00 0.52 N ATOM 496 CA ILE A1917 -4.610 8.403 -6.072 1.00 0.56 C ATOM 497 C ILE A1917 -6.055 8.168 -6.497 1.00 0.57 C ATOM 498 O ILE A1917 -6.941 8.061 -5.644 1.00 0.59 O ATOM 499 CB ILE A1917 -3.762 7.184 -6.465 1.00 0.59 C ATOM 500 CG1 ILE A1917 -4.167 5.913 -5.706 1.00 0.69 C ATOM 501 CG2 ILE A1917 -2.265 7.458 -6.367 1.00 0.74 C ATOM 502 CD1 ILE A1917 -3.448 4.664 -6.174 1.00 0.74 C ATOM 0 H ILE A1917 -5.270 8.014 -4.193 1.00 0.52 H new ATOM 0 HA ILE A1917 -4.173 9.270 -6.568 1.00 0.56 H new ATOM 0 HB ILE A1917 -3.976 6.997 -7.517 1.00 0.59 H new ATOM 0 HG12 ILE A1917 -3.970 6.057 -4.644 1.00 0.69 H new ATOM 0 HG13 ILE A1917 -5.241 5.764 -5.814 1.00 0.69 H new ATOM 0 HG21 ILE A1917 -1.712 6.564 -6.656 1.00 0.74 H new ATOM 0 HG22 ILE A1917 -2.001 8.279 -7.034 1.00 0.74 H new ATOM 0 HG23 ILE A1917 -2.011 7.727 -5.342 1.00 0.74 H new ATOM 0 HD11 ILE A1917 -3.788 3.808 -5.590 1.00 0.74 H new ATOM 0 HD12 ILE A1917 -3.665 4.493 -7.228 1.00 0.74 H new ATOM 0 HD13 ILE A1917 -2.374 4.791 -6.040 1.00 0.74 H new ATOM 514 N THR A1918 -6.311 8.125 -7.762 1.00 0.65 N ATOM 515 CA THR A1918 -7.648 7.867 -8.239 1.00 0.72 C ATOM 516 C THR A1918 -7.783 6.358 -8.472 1.00 0.68 C ATOM 517 O THR A1918 -6.773 5.657 -8.568 1.00 0.76 O ATOM 518 CB THR A1918 -7.895 8.617 -9.582 1.00 0.94 C ATOM 519 OG1 THR A1918 -7.476 9.984 -9.458 1.00 1.07 O ATOM 520 CG2 THR A1918 -9.373 8.613 -9.957 1.00 1.06 C ATOM 0 H THR A1918 -5.615 8.265 -8.495 1.00 0.65 H new ATOM 0 HA THR A1918 -8.377 8.214 -7.507 1.00 0.72 H new ATOM 0 HB THR A1918 -7.324 8.102 -10.355 1.00 0.94 H new ATOM 0 HG1 THR A1918 -7.631 10.452 -10.305 1.00 1.07 H new ATOM 0 HG21 THR A1918 -9.511 9.144 -10.899 1.00 1.06 H new ATOM 0 HG22 THR A1918 -9.718 7.585 -10.067 1.00 1.06 H new ATOM 0 HG23 THR A1918 -9.948 9.107 -9.174 1.00 1.06 H new ATOM 528 N ASP A1919 -9.002 5.858 -8.514 1.00 0.69 N ATOM 529 CA ASP A1919 -9.227 4.481 -8.894 1.00 0.74 C ATOM 530 C ASP A1919 -9.337 4.491 -10.444 1.00 0.99 C ATOM 531 O ASP A1919 -8.776 5.405 -11.070 1.00 1.30 O ATOM 532 CB ASP A1919 -10.509 3.935 -8.191 1.00 0.76 C ATOM 533 CG ASP A1919 -11.804 4.165 -8.966 1.00 0.99 C ATOM 534 OD1 ASP A1919 -12.085 5.309 -9.323 1.00 1.62 O ATOM 535 OD2 ASP A1919 -12.559 3.222 -9.200 1.00 1.28 O ATOM 0 H ASP A1919 -9.847 6.383 -8.290 1.00 0.69 H new ATOM 0 HA ASP A1919 -8.422 3.815 -8.583 1.00 0.74 H new ATOM 0 HB2 ASP A1919 -10.387 2.865 -8.022 1.00 0.76 H new ATOM 0 HB3 ASP A1919 -10.599 4.405 -7.211 1.00 0.76 H new ATOM 540 N SER A1920 -9.994 3.520 -11.064 1.00 1.06 N ATOM 541 CA SER A1920 -10.133 3.516 -12.502 1.00 1.32 C ATOM 542 C SER A1920 -10.768 4.840 -13.027 1.00 1.30 C ATOM 543 O SER A1920 -10.148 5.520 -13.841 1.00 1.75 O ATOM 544 CB SER A1920 -10.976 2.319 -12.930 1.00 1.64 C ATOM 545 OG SER A1920 -10.416 1.097 -12.451 1.00 2.13 O ATOM 0 H SER A1920 -10.435 2.731 -10.591 1.00 1.06 H new ATOM 0 HA SER A1920 -9.137 3.439 -12.938 1.00 1.32 H new ATOM 0 HB2 SER A1920 -11.991 2.431 -12.549 1.00 1.64 H new ATOM 0 HB3 SER A1920 -11.045 2.289 -14.017 1.00 1.64 H new ATOM 0 HG SER A1920 -10.976 0.346 -12.738 1.00 2.13 H new ATOM 551 N HIS A1921 -11.948 5.249 -12.480 1.00 1.22 N ATOM 552 CA HIS A1921 -12.665 6.497 -12.940 1.00 1.77 C ATOM 553 C HIS A1921 -13.852 6.864 -12.043 1.00 1.73 C ATOM 554 O HIS A1921 -14.598 7.801 -12.362 1.00 2.31 O ATOM 555 CB HIS A1921 -13.265 6.370 -14.382 1.00 2.44 C ATOM 556 CG HIS A1921 -12.307 6.363 -15.534 1.00 3.25 C ATOM 557 ND1 HIS A1921 -12.079 5.253 -16.300 1.00 4.13 N ATOM 558 CD2 HIS A1921 -11.530 7.340 -16.058 1.00 3.75 C ATOM 559 CE1 HIS A1921 -11.210 5.536 -17.235 1.00 4.85 C ATOM 560 NE2 HIS A1921 -10.857 6.791 -17.115 1.00 4.66 N ATOM 0 H HIS A1921 -12.425 4.748 -11.731 1.00 1.22 H new ATOM 0 HA HIS A1921 -11.886 7.258 -12.905 1.00 1.77 H new ATOM 0 HB2 HIS A1921 -13.847 5.449 -14.424 1.00 2.44 H new ATOM 0 HB3 HIS A1921 -13.962 7.195 -14.530 1.00 2.44 H new ATOM 0 HD2 HIS A1921 -11.456 8.359 -15.708 1.00 3.75 H new ATOM 0 HE1 HIS A1921 -10.844 4.848 -17.983 1.00 4.85 H new ATOM 0 HE2 HIS A1921 -10.189 7.279 -17.712 1.00 4.66 H new ATOM 569 N ASN A1922 -14.036 6.201 -10.935 1.00 1.59 N ATOM 570 CA ASN A1922 -15.287 6.395 -10.191 1.00 1.80 C ATOM 571 C ASN A1922 -15.097 6.948 -8.809 1.00 1.38 C ATOM 572 O ASN A1922 -15.868 7.792 -8.364 1.00 1.72 O ATOM 573 CB ASN A1922 -16.122 5.100 -10.107 1.00 2.28 C ATOM 574 CG ASN A1922 -16.678 4.642 -11.440 1.00 3.05 C ATOM 575 OD1 ASN A1922 -17.744 5.087 -11.868 1.00 3.29 O ATOM 576 ND2 ASN A1922 -16.013 3.719 -12.087 1.00 3.89 N ATOM 0 H ASN A1922 -13.375 5.542 -10.525 1.00 1.59 H new ATOM 0 HA ASN A1922 -15.829 7.142 -10.772 1.00 1.80 H new ATOM 0 HB2 ASN A1922 -15.502 4.306 -9.690 1.00 2.28 H new ATOM 0 HB3 ASN A1922 -16.949 5.256 -9.414 1.00 2.28 H new ATOM 0 HD21 ASN A1922 -16.375 3.352 -12.967 1.00 3.89 H new ATOM 0 HD22 ASN A1922 -15.132 3.367 -11.711 1.00 3.89 H new ATOM 583 N ARG A1923 -14.073 6.526 -8.154 1.00 0.98 N ATOM 584 CA ARG A1923 -13.863 6.825 -6.762 1.00 0.97 C ATOM 585 C ARG A1923 -12.396 7.157 -6.501 1.00 0.83 C ATOM 586 O ARG A1923 -11.605 7.286 -7.442 1.00 0.99 O ATOM 587 CB ARG A1923 -14.377 5.630 -5.923 1.00 1.46 C ATOM 588 CG ARG A1923 -13.916 4.272 -6.450 1.00 1.89 C ATOM 589 CD ARG A1923 -14.652 3.103 -5.820 1.00 2.66 C ATOM 590 NE ARG A1923 -16.099 3.159 -6.034 1.00 2.93 N ATOM 591 CZ ARG A1923 -16.977 2.229 -5.640 1.00 3.73 C ATOM 592 NH1 ARG A1923 -16.566 1.041 -5.192 1.00 4.35 N ATOM 593 NH2 ARG A1923 -18.261 2.475 -5.752 1.00 4.26 N ATOM 0 H ARG A1923 -13.339 5.952 -8.569 1.00 0.98 H new ATOM 0 HA ARG A1923 -14.425 7.711 -6.466 1.00 0.97 H new ATOM 0 HB2 ARG A1923 -14.037 5.746 -4.894 1.00 1.46 H new ATOM 0 HB3 ARG A1923 -15.467 5.652 -5.903 1.00 1.46 H new ATOM 0 HG2 ARG A1923 -14.058 4.242 -7.530 1.00 1.89 H new ATOM 0 HG3 ARG A1923 -12.847 4.162 -6.265 1.00 1.89 H new ATOM 0 HD2 ARG A1923 -14.265 2.171 -6.232 1.00 2.66 H new ATOM 0 HD3 ARG A1923 -14.448 3.087 -4.749 1.00 2.66 H new ATOM 0 HE ARG A1923 -16.469 3.974 -6.524 1.00 2.93 H new ATOM 0 HH11 ARG A1923 -15.569 0.830 -5.146 1.00 4.35 H new ATOM 0 HH12 ARG A1923 -17.249 0.344 -4.896 1.00 4.35 H new ATOM 0 HH21 ARG A1923 -18.578 3.365 -6.135 1.00 4.26 H new ATOM 0 HH22 ARG A1923 -18.942 1.776 -5.456 1.00 4.26 H new ATOM 607 N LYS A1924 -12.040 7.345 -5.268 1.00 0.68 N ATOM 608 CA LYS A1924 -10.676 7.691 -4.924 1.00 0.67 C ATOM 609 C LYS A1924 -10.028 6.601 -4.116 1.00 0.53 C ATOM 610 O LYS A1924 -10.654 6.030 -3.206 1.00 0.55 O ATOM 611 CB LYS A1924 -10.637 9.015 -4.167 1.00 0.87 C ATOM 612 CG LYS A1924 -10.883 10.237 -5.040 1.00 1.32 C ATOM 613 CD LYS A1924 -11.152 11.482 -4.208 1.00 1.59 C ATOM 614 CE LYS A1924 -10.030 11.812 -3.231 1.00 2.07 C ATOM 615 NZ LYS A1924 -8.779 12.249 -3.884 1.00 2.72 N ATOM 0 H LYS A1924 -12.672 7.266 -4.471 1.00 0.68 H new ATOM 0 HA LYS A1924 -10.112 7.803 -5.850 1.00 0.67 H new ATOM 0 HB2 LYS A1924 -11.386 8.991 -3.375 1.00 0.87 H new ATOM 0 HB3 LYS A1924 -9.665 9.117 -3.684 1.00 0.87 H new ATOM 0 HG2 LYS A1924 -10.017 10.407 -5.679 1.00 1.32 H new ATOM 0 HG3 LYS A1924 -11.732 10.049 -5.697 1.00 1.32 H new ATOM 0 HD2 LYS A1924 -11.303 12.330 -4.876 1.00 1.59 H new ATOM 0 HD3 LYS A1924 -12.079 11.345 -3.652 1.00 1.59 H new ATOM 0 HE2 LYS A1924 -10.369 12.597 -2.555 1.00 2.07 H new ATOM 0 HE3 LYS A1924 -9.822 10.933 -2.621 1.00 2.07 H new ATOM 0 HZ1 LYS A1924 -7.999 11.628 -3.590 1.00 2.72 H new ATOM 0 HZ2 LYS A1924 -8.891 12.199 -4.917 1.00 2.72 H new ATOM 0 HZ3 LYS A1924 -8.566 13.228 -3.606 1.00 2.72 H new ATOM 629 N ILE A1925 -8.797 6.296 -4.446 1.00 0.49 N ATOM 630 CA ILE A1925 -8.057 5.313 -3.728 1.00 0.44 C ATOM 631 C ILE A1925 -7.124 6.014 -2.790 1.00 0.44 C ATOM 632 O ILE A1925 -6.038 6.475 -3.163 1.00 0.51 O ATOM 633 CB ILE A1925 -7.271 4.320 -4.631 1.00 0.51 C ATOM 634 CG1 ILE A1925 -8.237 3.577 -5.560 1.00 0.53 C ATOM 635 CG2 ILE A1925 -6.487 3.321 -3.767 1.00 0.56 C ATOM 636 CD1 ILE A1925 -7.570 2.538 -6.460 1.00 0.64 C ATOM 0 H ILE A1925 -8.290 6.726 -5.219 1.00 0.49 H new ATOM 0 HA ILE A1925 -8.777 4.699 -3.187 1.00 0.44 H new ATOM 0 HB ILE A1925 -6.563 4.883 -5.239 1.00 0.51 H new ATOM 0 HG12 ILE A1925 -8.996 3.082 -4.955 1.00 0.53 H new ATOM 0 HG13 ILE A1925 -8.753 4.305 -6.186 1.00 0.53 H new ATOM 0 HG21 ILE A1925 -5.942 2.632 -4.412 1.00 0.56 H new ATOM 0 HG22 ILE A1925 -5.782 3.861 -3.135 1.00 0.56 H new ATOM 0 HG23 ILE A1925 -7.180 2.760 -3.140 1.00 0.56 H new ATOM 0 HD11 ILE A1925 -8.324 2.060 -7.084 1.00 0.64 H new ATOM 0 HD12 ILE A1925 -6.831 3.027 -7.094 1.00 0.64 H new ATOM 0 HD13 ILE A1925 -7.078 1.785 -5.844 1.00 0.64 H new ATOM 648 N GLU A1926 -7.592 6.180 -1.625 1.00 0.43 N ATOM 649 CA GLU A1926 -6.798 6.774 -0.571 1.00 0.48 C ATOM 650 C GLU A1926 -6.028 5.624 0.081 1.00 0.46 C ATOM 651 O GLU A1926 -6.606 4.845 0.809 1.00 0.56 O ATOM 652 CB GLU A1926 -7.707 7.440 0.490 1.00 0.67 C ATOM 653 CG GLU A1926 -8.870 8.283 -0.059 1.00 1.40 C ATOM 654 CD GLU A1926 -8.451 9.488 -0.853 1.00 1.65 C ATOM 655 OE1 GLU A1926 -8.126 9.343 -2.059 1.00 2.28 O ATOM 656 OE2 GLU A1926 -8.399 10.583 -0.304 1.00 1.95 O ATOM 0 H GLU A1926 -8.537 5.916 -1.346 1.00 0.43 H new ATOM 0 HA GLU A1926 -6.135 7.541 -0.973 1.00 0.48 H new ATOM 0 HB2 GLU A1926 -8.119 6.659 1.129 1.00 0.67 H new ATOM 0 HB3 GLU A1926 -7.089 8.077 1.123 1.00 0.67 H new ATOM 0 HG2 GLU A1926 -9.495 7.649 -0.688 1.00 1.40 H new ATOM 0 HG3 GLU A1926 -9.488 8.612 0.776 1.00 1.40 H new ATOM 663 N LEU A1927 -4.770 5.474 -0.213 1.00 0.44 N ATOM 664 CA LEU A1927 -4.020 4.346 0.326 1.00 0.51 C ATOM 665 C LEU A1927 -2.920 4.803 1.277 1.00 0.46 C ATOM 666 O LEU A1927 -2.669 5.990 1.399 1.00 0.61 O ATOM 667 CB LEU A1927 -3.490 3.420 -0.820 1.00 0.68 C ATOM 668 CG LEU A1927 -2.670 4.060 -1.970 1.00 0.87 C ATOM 669 CD1 LEU A1927 -1.300 4.547 -1.517 1.00 1.54 C ATOM 670 CD2 LEU A1927 -2.526 3.074 -3.113 1.00 1.48 C ATOM 0 H LEU A1927 -4.235 6.102 -0.813 1.00 0.44 H new ATOM 0 HA LEU A1927 -4.703 3.743 0.924 1.00 0.51 H new ATOM 0 HB2 LEU A1927 -2.872 2.647 -0.363 1.00 0.68 H new ATOM 0 HB3 LEU A1927 -4.349 2.919 -1.265 1.00 0.68 H new ATOM 0 HG LEU A1927 -3.220 4.938 -2.307 1.00 0.87 H new ATOM 0 HD11 LEU A1927 -0.771 4.985 -2.364 1.00 1.54 H new ATOM 0 HD12 LEU A1927 -1.421 5.298 -0.736 1.00 1.54 H new ATOM 0 HD13 LEU A1927 -0.726 3.707 -1.127 1.00 1.54 H new ATOM 0 HD21 LEU A1927 -1.949 3.531 -3.917 1.00 1.48 H new ATOM 0 HD22 LEU A1927 -2.012 2.180 -2.760 1.00 1.48 H new ATOM 0 HD23 LEU A1927 -3.514 2.801 -3.485 1.00 1.48 H new ATOM 682 N ASN A1928 -2.294 3.877 1.962 1.00 0.51 N ATOM 683 CA ASN A1928 -1.176 4.195 2.837 1.00 0.51 C ATOM 684 C ASN A1928 -0.302 2.967 2.920 1.00 0.64 C ATOM 685 O ASN A1928 -0.798 1.867 2.758 1.00 0.81 O ATOM 686 CB ASN A1928 -1.651 4.595 4.235 1.00 0.55 C ATOM 687 CG ASN A1928 -0.609 5.413 5.003 1.00 0.54 C ATOM 688 OD1 ASN A1928 0.610 5.315 4.789 1.00 0.88 O ATOM 689 ND2 ASN A1928 -1.072 6.204 5.913 1.00 0.80 N ATOM 0 H ASN A1928 -2.538 2.887 1.934 1.00 0.51 H new ATOM 0 HA ASN A1928 -0.625 5.044 2.432 1.00 0.51 H new ATOM 0 HB2 ASN A1928 -2.570 5.174 4.150 1.00 0.55 H new ATOM 0 HB3 ASN A1928 -1.892 3.696 4.803 1.00 0.55 H new ATOM 0 HD21 ASN A1928 -0.432 6.766 6.474 1.00 0.80 H new ATOM 0 HD22 ASN A1928 -2.078 6.267 6.070 1.00 0.80 H new ATOM 696 N VAL A1929 0.981 3.170 3.155 1.00 0.65 N ATOM 697 CA VAL A1929 1.969 2.101 3.164 1.00 0.82 C ATOM 698 C VAL A1929 1.997 1.326 4.508 1.00 0.87 C ATOM 699 O VAL A1929 1.365 0.307 4.671 1.00 1.69 O ATOM 700 CB VAL A1929 3.382 2.684 2.876 1.00 0.99 C ATOM 701 CG1 VAL A1929 4.433 1.601 2.791 1.00 1.51 C ATOM 702 CG2 VAL A1929 3.376 3.523 1.614 1.00 1.73 C ATOM 0 H VAL A1929 1.373 4.092 3.348 1.00 0.65 H new ATOM 0 HA VAL A1929 1.683 1.396 2.384 1.00 0.82 H new ATOM 0 HB VAL A1929 3.641 3.327 3.717 1.00 0.99 H new ATOM 0 HG11 VAL A1929 5.405 2.052 2.589 1.00 1.51 H new ATOM 0 HG12 VAL A1929 4.474 1.059 3.736 1.00 1.51 H new ATOM 0 HG13 VAL A1929 4.179 0.910 1.987 1.00 1.51 H new ATOM 0 HG21 VAL A1929 4.376 3.919 1.435 1.00 1.73 H new ATOM 0 HG22 VAL A1929 3.074 2.906 0.768 1.00 1.73 H new ATOM 0 HG23 VAL A1929 2.674 4.349 1.730 1.00 1.73 H new ATOM 712 N CYS A1930 2.703 1.852 5.456 1.00 0.74 N ATOM 713 CA CYS A1930 2.891 1.192 6.740 1.00 0.83 C ATOM 714 C CYS A1930 2.410 2.072 7.869 1.00 0.74 C ATOM 715 O CYS A1930 2.999 2.092 8.968 1.00 0.97 O ATOM 716 CB CYS A1930 4.359 0.832 6.965 1.00 1.01 C ATOM 717 SG CYS A1930 5.050 -0.487 5.929 1.00 1.20 S ATOM 0 H CYS A1930 3.173 2.754 5.377 1.00 0.74 H new ATOM 0 HA CYS A1930 2.303 0.274 6.725 1.00 0.83 H new ATOM 0 HB2 CYS A1930 4.956 1.731 6.812 1.00 1.01 H new ATOM 0 HB3 CYS A1930 4.481 0.542 8.009 1.00 1.01 H new ATOM 722 N ALA A1931 1.379 2.804 7.609 1.00 0.63 N ATOM 723 CA ALA A1931 0.741 3.600 8.597 1.00 0.65 C ATOM 724 C ALA A1931 -0.719 3.553 8.288 1.00 0.75 C ATOM 725 O ALA A1931 -1.081 3.410 7.134 1.00 1.31 O ATOM 726 CB ALA A1931 1.252 5.034 8.545 1.00 0.62 C ATOM 0 H ALA A1931 0.950 2.865 6.686 1.00 0.63 H new ATOM 0 HA ALA A1931 0.948 3.226 9.600 1.00 0.65 H new ATOM 0 HB1 ALA A1931 0.751 5.627 9.310 1.00 0.62 H new ATOM 0 HB2 ALA A1931 2.327 5.044 8.725 1.00 0.62 H new ATOM 0 HB3 ALA A1931 1.045 5.459 7.563 1.00 0.62 H new ATOM 732 N GLU A1932 -1.539 3.582 9.272 1.00 0.53 N ATOM 733 CA GLU A1932 -2.958 3.588 9.036 1.00 0.58 C ATOM 734 C GLU A1932 -3.404 4.955 8.551 1.00 0.48 C ATOM 735 O GLU A1932 -2.909 5.989 9.032 1.00 0.49 O ATOM 736 CB GLU A1932 -3.788 3.027 10.227 1.00 0.84 C ATOM 737 CG GLU A1932 -3.404 3.503 11.632 1.00 0.82 C ATOM 738 CD GLU A1932 -2.030 3.027 12.074 1.00 1.32 C ATOM 739 OE1 GLU A1932 -1.888 1.832 12.409 1.00 1.72 O ATOM 740 OE2 GLU A1932 -1.085 3.839 12.150 1.00 2.07 O ATOM 0 H GLU A1932 -1.265 3.602 10.254 1.00 0.53 H new ATOM 0 HA GLU A1932 -3.168 2.882 8.233 1.00 0.58 H new ATOM 0 HB2 GLU A1932 -4.835 3.280 10.059 1.00 0.84 H new ATOM 0 HB3 GLU A1932 -3.716 1.940 10.207 1.00 0.84 H new ATOM 0 HG2 GLU A1932 -3.429 4.592 11.658 1.00 0.82 H new ATOM 0 HG3 GLU A1932 -4.150 3.150 12.344 1.00 0.82 H new ATOM 747 N ALA A1933 -4.297 4.960 7.580 1.00 0.51 N ATOM 748 CA ALA A1933 -4.690 6.171 6.903 1.00 0.57 C ATOM 749 C ALA A1933 -5.539 7.068 7.755 1.00 0.59 C ATOM 750 O ALA A1933 -6.484 6.623 8.428 1.00 0.77 O ATOM 751 CB ALA A1933 -5.377 5.865 5.577 1.00 0.74 C ATOM 0 H ALA A1933 -4.768 4.121 7.241 1.00 0.51 H new ATOM 0 HA ALA A1933 -3.770 6.718 6.696 1.00 0.57 H new ATOM 0 HB1 ALA A1933 -5.661 6.798 5.091 1.00 0.74 H new ATOM 0 HB2 ALA A1933 -4.693 5.313 4.932 1.00 0.74 H new ATOM 0 HB3 ALA A1933 -6.268 5.265 5.759 1.00 0.74 H new ATOM 757 N LYS A1934 -5.167 8.332 7.751 1.00 0.62 N ATOM 758 CA LYS A1934 -5.905 9.381 8.405 1.00 0.76 C ATOM 759 C LYS A1934 -7.184 9.646 7.595 1.00 0.88 C ATOM 760 O LYS A1934 -8.143 10.255 8.092 1.00 1.28 O ATOM 761 CB LYS A1934 -5.014 10.633 8.530 1.00 0.98 C ATOM 762 CG LYS A1934 -5.585 11.775 9.357 1.00 1.65 C ATOM 763 CD LYS A1934 -5.989 11.319 10.752 1.00 2.13 C ATOM 764 CE LYS A1934 -6.425 12.494 11.612 1.00 2.78 C ATOM 765 NZ LYS A1934 -5.289 13.325 12.031 1.00 3.10 N ATOM 0 H LYS A1934 -4.323 8.661 7.281 1.00 0.62 H new ATOM 0 HA LYS A1934 -6.195 9.094 9.416 1.00 0.76 H new ATOM 0 HB2 LYS A1934 -4.061 10.335 8.967 1.00 0.98 H new ATOM 0 HB3 LYS A1934 -4.802 11.006 7.528 1.00 0.98 H new ATOM 0 HG2 LYS A1934 -4.845 12.572 9.436 1.00 1.65 H new ATOM 0 HG3 LYS A1934 -6.452 12.194 8.847 1.00 1.65 H new ATOM 0 HD2 LYS A1934 -6.802 10.597 10.680 1.00 2.13 H new ATOM 0 HD3 LYS A1934 -5.151 10.809 11.227 1.00 2.13 H new ATOM 0 HE2 LYS A1934 -7.135 13.106 11.056 1.00 2.78 H new ATOM 0 HE3 LYS A1934 -6.947 12.123 12.494 1.00 2.78 H new ATOM 0 HZ1 LYS A1934 -5.612 14.032 12.722 1.00 3.10 H new ATOM 0 HZ2 LYS A1934 -4.560 12.723 12.465 1.00 3.10 H new ATOM 0 HZ3 LYS A1934 -4.889 13.809 11.202 1.00 3.10 H new ATOM 779 N SER A1935 -7.174 9.174 6.334 1.00 0.93 N ATOM 780 CA SER A1935 -8.351 9.137 5.504 1.00 1.23 C ATOM 781 C SER A1935 -9.348 8.283 6.278 1.00 1.17 C ATOM 782 O SER A1935 -9.132 7.079 6.499 1.00 2.00 O ATOM 783 CB SER A1935 -7.977 8.507 4.168 1.00 1.67 C ATOM 784 OG SER A1935 -6.830 9.171 3.634 1.00 2.17 O ATOM 0 H SER A1935 -6.337 8.811 5.878 1.00 0.93 H new ATOM 0 HA SER A1935 -8.774 10.119 5.290 1.00 1.23 H new ATOM 0 HB2 SER A1935 -7.768 7.445 4.300 1.00 1.67 H new ATOM 0 HB3 SER A1935 -8.812 8.583 3.471 1.00 1.67 H new ATOM 0 HG SER A1935 -6.309 8.541 3.093 1.00 2.17 H new ATOM 790 N SER A1936 -10.386 8.903 6.720 1.00 0.99 N ATOM 791 CA SER A1936 -11.263 8.319 7.661 1.00 1.20 C ATOM 792 C SER A1936 -12.319 7.366 7.088 1.00 0.95 C ATOM 793 O SER A1936 -13.469 7.746 6.873 1.00 1.08 O ATOM 794 CB SER A1936 -11.871 9.429 8.505 1.00 1.80 C ATOM 795 OG SER A1936 -10.835 10.315 8.969 1.00 2.28 O ATOM 0 H SER A1936 -10.650 9.845 6.430 1.00 0.99 H new ATOM 0 HA SER A1936 -10.665 7.652 8.281 1.00 1.20 H new ATOM 0 HB2 SER A1936 -12.602 9.986 7.918 1.00 1.80 H new ATOM 0 HB3 SER A1936 -12.404 9.002 9.355 1.00 1.80 H new ATOM 0 HG SER A1936 -9.967 10.008 8.633 1.00 2.28 H new ATOM 801 N CYS A1937 -11.894 6.151 6.792 1.00 0.87 N ATOM 802 CA CYS A1937 -12.818 5.094 6.464 1.00 0.93 C ATOM 803 C CYS A1937 -13.361 4.534 7.764 1.00 1.22 C ATOM 804 O CYS A1937 -14.562 4.257 7.876 1.00 1.98 O ATOM 805 CB CYS A1937 -12.183 3.977 5.608 1.00 1.06 C ATOM 806 SG CYS A1937 -12.183 4.270 3.798 1.00 1.44 S ATOM 0 H CYS A1937 -10.912 5.877 6.774 1.00 0.87 H new ATOM 0 HA CYS A1937 -13.619 5.509 5.852 1.00 0.93 H new ATOM 0 HB2 CYS A1937 -11.153 3.834 5.935 1.00 1.06 H new ATOM 0 HB3 CYS A1937 -12.713 3.045 5.807 1.00 1.06 H new ATOM 811 N ALA A1938 -12.468 4.403 8.764 1.00 0.97 N ATOM 812 CA ALA A1938 -12.845 3.991 10.112 1.00 1.24 C ATOM 813 C ALA A1938 -11.707 4.223 11.105 1.00 1.13 C ATOM 814 O ALA A1938 -11.539 5.324 11.622 1.00 1.32 O ATOM 815 CB ALA A1938 -13.283 2.521 10.173 1.00 1.48 C ATOM 0 H ALA A1938 -11.470 4.581 8.651 1.00 0.97 H new ATOM 0 HA ALA A1938 -13.697 4.612 10.390 1.00 1.24 H new ATOM 0 HB1 ALA A1938 -13.553 2.264 11.197 1.00 1.48 H new ATOM 0 HB2 ALA A1938 -14.144 2.371 9.522 1.00 1.48 H new ATOM 0 HB3 ALA A1938 -12.463 1.883 9.843 1.00 1.48 H new ATOM 821 N ASN A1939 -10.888 3.214 11.301 1.00 0.94 N ATOM 822 CA ASN A1939 -9.842 3.257 12.267 1.00 0.94 C ATOM 823 C ASN A1939 -8.468 3.012 11.651 1.00 0.69 C ATOM 824 O ASN A1939 -7.695 3.946 11.429 1.00 0.89 O ATOM 825 CB ASN A1939 -10.157 2.302 13.445 1.00 1.19 C ATOM 826 CG ASN A1939 -9.008 2.092 14.412 1.00 1.51 C ATOM 827 OD1 ASN A1939 -8.817 2.853 15.373 1.00 2.13 O ATOM 828 ND2 ASN A1939 -8.284 1.028 14.214 1.00 2.10 N ATOM 0 H ASN A1939 -10.940 2.337 10.783 1.00 0.94 H new ATOM 0 HA ASN A1939 -9.796 4.269 12.670 1.00 0.94 H new ATOM 0 HB2 ASN A1939 -11.011 2.696 13.996 1.00 1.19 H new ATOM 0 HB3 ASN A1939 -10.456 1.335 13.041 1.00 1.19 H new ATOM 0 HD21 ASN A1939 -7.530 0.797 14.861 1.00 2.10 H new ATOM 0 HD22 ASN A1939 -8.471 0.426 13.412 1.00 2.10 H new ATOM 835 N GLY A1940 -8.219 1.769 11.307 1.00 0.57 N ATOM 836 CA GLY A1940 -6.925 1.338 10.842 1.00 0.70 C ATOM 837 C GLY A1940 -6.907 1.081 9.377 1.00 0.61 C ATOM 838 O GLY A1940 -5.990 0.451 8.876 1.00 0.79 O ATOM 0 H GLY A1940 -8.916 1.025 11.343 1.00 0.57 H new ATOM 0 HA2 GLY A1940 -6.183 2.099 11.084 1.00 0.70 H new ATOM 0 HA3 GLY A1940 -6.635 0.430 11.371 1.00 0.70 H new ATOM 842 N ALA A1941 -7.961 1.496 8.709 1.00 0.47 N ATOM 843 CA ALA A1941 -8.064 1.385 7.265 1.00 0.46 C ATOM 844 C ALA A1941 -6.859 2.046 6.601 1.00 0.42 C ATOM 845 O ALA A1941 -6.534 3.195 6.903 1.00 0.62 O ATOM 846 CB ALA A1941 -9.342 2.058 6.794 1.00 0.52 C ATOM 0 H ALA A1941 -8.775 1.922 9.151 1.00 0.47 H new ATOM 0 HA ALA A1941 -8.085 0.331 6.989 1.00 0.46 H new ATOM 0 HB1 ALA A1941 -9.419 1.974 5.710 1.00 0.52 H new ATOM 0 HB2 ALA A1941 -10.201 1.572 7.257 1.00 0.52 H new ATOM 0 HB3 ALA A1941 -9.324 3.111 7.076 1.00 0.52 H new ATOM 852 N ALA A1942 -6.182 1.316 5.747 1.00 0.36 N ATOM 853 CA ALA A1942 -5.026 1.848 5.053 1.00 0.38 C ATOM 854 C ALA A1942 -5.413 2.179 3.658 1.00 0.40 C ATOM 855 O ALA A1942 -5.048 3.220 3.127 1.00 0.49 O ATOM 856 CB ALA A1942 -3.900 0.864 5.044 1.00 0.44 C ATOM 0 H ALA A1942 -6.410 0.350 5.513 1.00 0.36 H new ATOM 0 HA ALA A1942 -4.686 2.743 5.574 1.00 0.38 H new ATOM 0 HB1 ALA A1942 -3.047 1.292 4.516 1.00 0.44 H new ATOM 0 HB2 ALA A1942 -3.613 0.631 6.069 1.00 0.44 H new ATOM 0 HB3 ALA A1942 -4.218 -0.048 4.540 1.00 0.44 H new ATOM 862 N VAL A1943 -6.134 1.273 3.042 1.00 0.41 N ATOM 863 CA VAL A1943 -6.673 1.544 1.770 1.00 0.42 C ATOM 864 C VAL A1943 -8.108 1.932 2.016 1.00 0.39 C ATOM 865 O VAL A1943 -8.948 1.107 2.436 1.00 0.43 O ATOM 866 CB VAL A1943 -6.607 0.310 0.830 1.00 0.52 C ATOM 867 CG1 VAL A1943 -7.098 0.669 -0.563 1.00 0.73 C ATOM 868 CG2 VAL A1943 -5.190 -0.254 0.769 1.00 0.75 C ATOM 0 H VAL A1943 -6.350 0.349 3.416 1.00 0.41 H new ATOM 0 HA VAL A1943 -6.105 2.330 1.273 1.00 0.42 H new ATOM 0 HB VAL A1943 -7.262 -0.460 1.238 1.00 0.52 H new ATOM 0 HG11 VAL A1943 -7.043 -0.210 -1.206 1.00 0.73 H new ATOM 0 HG12 VAL A1943 -8.130 1.014 -0.507 1.00 0.73 H new ATOM 0 HG13 VAL A1943 -6.473 1.460 -0.976 1.00 0.73 H new ATOM 0 HG21 VAL A1943 -5.170 -1.118 0.104 1.00 0.75 H new ATOM 0 HG22 VAL A1943 -4.510 0.510 0.392 1.00 0.75 H new ATOM 0 HG23 VAL A1943 -4.876 -0.558 1.768 1.00 0.75 H new ATOM 878 N CYS A1944 -8.379 3.138 1.726 1.00 0.41 N ATOM 879 CA CYS A1944 -9.619 3.746 1.974 1.00 0.49 C ATOM 880 C CYS A1944 -10.200 4.149 0.648 1.00 0.47 C ATOM 881 O CYS A1944 -9.775 5.112 0.025 1.00 0.54 O ATOM 882 CB CYS A1944 -9.394 4.970 2.890 1.00 0.70 C ATOM 883 SG CYS A1944 -10.905 5.799 3.487 1.00 1.15 S ATOM 0 H CYS A1944 -7.705 3.763 1.285 1.00 0.41 H new ATOM 0 HA CYS A1944 -10.311 3.071 2.476 1.00 0.49 H new ATOM 0 HB2 CYS A1944 -8.811 4.652 3.754 1.00 0.70 H new ATOM 0 HB3 CYS A1944 -8.791 5.699 2.349 1.00 0.70 H new ATOM 888 N ILE A1945 -11.100 3.374 0.178 1.00 0.46 N ATOM 889 CA ILE A1945 -11.721 3.642 -1.063 1.00 0.49 C ATOM 890 C ILE A1945 -12.881 4.549 -0.784 1.00 0.49 C ATOM 891 O ILE A1945 -13.903 4.118 -0.285 1.00 0.54 O ATOM 892 CB ILE A1945 -12.214 2.341 -1.743 1.00 0.56 C ATOM 893 CG1 ILE A1945 -11.060 1.344 -1.931 1.00 0.54 C ATOM 894 CG2 ILE A1945 -12.859 2.647 -3.071 1.00 0.68 C ATOM 895 CD1 ILE A1945 -9.925 1.846 -2.803 1.00 0.56 C ATOM 0 H ILE A1945 -11.430 2.530 0.645 1.00 0.46 H new ATOM 0 HA ILE A1945 -11.008 4.105 -1.745 1.00 0.49 H new ATOM 0 HB ILE A1945 -12.957 1.884 -1.090 1.00 0.56 H new ATOM 0 HG12 ILE A1945 -10.660 1.084 -0.951 1.00 0.54 H new ATOM 0 HG13 ILE A1945 -11.457 0.427 -2.367 1.00 0.54 H new ATOM 0 HG21 ILE A1945 -13.199 1.720 -3.533 1.00 0.68 H new ATOM 0 HG22 ILE A1945 -13.711 3.309 -2.918 1.00 0.68 H new ATOM 0 HG23 ILE A1945 -12.134 3.133 -3.724 1.00 0.68 H new ATOM 0 HD11 ILE A1945 -9.157 1.076 -2.879 1.00 0.56 H new ATOM 0 HD12 ILE A1945 -10.306 2.078 -3.798 1.00 0.56 H new ATOM 0 HD13 ILE A1945 -9.496 2.745 -2.360 1.00 0.56 H new ATOM 907 N THR A1946 -12.705 5.797 -1.014 1.00 0.48 N ATOM 908 CA THR A1946 -13.747 6.708 -0.731 1.00 0.51 C ATOM 909 C THR A1946 -14.576 6.912 -1.989 1.00 0.53 C ATOM 910 O THR A1946 -14.107 7.503 -2.978 1.00 0.61 O ATOM 911 CB THR A1946 -13.182 8.036 -0.202 1.00 0.61 C ATOM 912 OG1 THR A1946 -12.164 7.730 0.772 1.00 0.91 O ATOM 913 CG2 THR A1946 -14.273 8.834 0.497 1.00 0.79 C ATOM 0 H THR A1946 -11.853 6.209 -1.396 1.00 0.48 H new ATOM 0 HA THR A1946 -14.388 6.303 0.052 1.00 0.51 H new ATOM 0 HB THR A1946 -12.784 8.617 -1.034 1.00 0.61 H new ATOM 0 HG1 THR A1946 -11.787 8.563 1.124 1.00 0.91 H new ATOM 0 HG21 THR A1946 -13.858 9.772 0.866 1.00 0.79 H new ATOM 0 HG22 THR A1946 -15.077 9.046 -0.208 1.00 0.79 H new ATOM 0 HG23 THR A1946 -14.666 8.257 1.334 1.00 0.79 H new ATOM 921 N ASP A1947 -15.751 6.333 -1.985 1.00 0.58 N ATOM 922 CA ASP A1947 -16.672 6.456 -3.072 1.00 0.74 C ATOM 923 C ASP A1947 -17.699 7.503 -2.716 1.00 0.78 C ATOM 924 O ASP A1947 -18.639 7.273 -1.936 1.00 0.77 O ATOM 925 CB ASP A1947 -17.312 5.095 -3.480 1.00 0.91 C ATOM 926 CG ASP A1947 -18.211 4.435 -2.438 1.00 1.21 C ATOM 927 OD1 ASP A1947 -17.704 3.948 -1.404 1.00 1.94 O ATOM 928 OD2 ASP A1947 -19.448 4.350 -2.671 1.00 1.24 O ATOM 0 H ASP A1947 -16.093 5.758 -1.215 1.00 0.58 H new ATOM 0 HA ASP A1947 -16.130 6.778 -3.961 1.00 0.74 H new ATOM 0 HB2 ASP A1947 -17.895 5.249 -4.388 1.00 0.91 H new ATOM 0 HB3 ASP A1947 -16.510 4.400 -3.730 1.00 0.91 H new ATOM 933 N GLY A1948 -17.468 8.687 -3.214 1.00 0.91 N ATOM 934 CA GLY A1948 -18.309 9.794 -2.900 1.00 1.03 C ATOM 935 C GLY A1948 -18.191 10.115 -1.433 1.00 1.03 C ATOM 936 O GLY A1948 -17.071 10.292 -0.930 1.00 1.07 O ATOM 0 H GLY A1948 -16.696 8.904 -3.844 1.00 0.91 H new ATOM 0 HA2 GLY A1948 -18.025 10.661 -3.497 1.00 1.03 H new ATOM 0 HA3 GLY A1948 -19.344 9.560 -3.150 1.00 1.03 H new ATOM 940 N PRO A1949 -19.303 10.149 -0.701 1.00 1.06 N ATOM 941 CA PRO A1949 -19.287 10.395 0.723 1.00 1.15 C ATOM 942 C PRO A1949 -19.157 9.095 1.551 1.00 1.00 C ATOM 943 O PRO A1949 -19.123 9.143 2.787 1.00 1.12 O ATOM 944 CB PRO A1949 -20.650 11.042 0.961 1.00 1.37 C ATOM 945 CG PRO A1949 -21.555 10.406 -0.049 1.00 1.27 C ATOM 946 CD PRO A1949 -20.687 9.995 -1.215 1.00 1.09 C ATOM 0 HA PRO A1949 -18.436 11.004 1.028 1.00 1.15 H new ATOM 0 HB2 PRO A1949 -21.002 10.862 1.977 1.00 1.37 H new ATOM 0 HB3 PRO A1949 -20.604 12.123 0.827 1.00 1.37 H new ATOM 0 HG2 PRO A1949 -22.064 9.542 0.378 1.00 1.27 H new ATOM 0 HG3 PRO A1949 -22.328 11.105 -0.370 1.00 1.27 H new ATOM 0 HD2 PRO A1949 -20.888 8.968 -1.520 1.00 1.09 H new ATOM 0 HD3 PRO A1949 -20.862 10.627 -2.086 1.00 1.09 H new ATOM 954 N LYS A1950 -19.074 7.954 0.888 1.00 0.86 N ATOM 955 CA LYS A1950 -18.996 6.684 1.583 1.00 0.83 C ATOM 956 C LYS A1950 -17.555 6.190 1.587 1.00 0.66 C ATOM 957 O LYS A1950 -16.825 6.404 0.630 1.00 0.71 O ATOM 958 CB LYS A1950 -19.942 5.641 0.945 1.00 0.95 C ATOM 959 CG LYS A1950 -20.039 4.344 1.745 1.00 1.31 C ATOM 960 CD LYS A1950 -21.030 3.339 1.159 1.00 1.91 C ATOM 961 CE LYS A1950 -20.605 2.796 -0.202 1.00 2.18 C ATOM 962 NZ LYS A1950 -19.240 2.220 -0.179 1.00 2.52 N ATOM 0 H LYS A1950 -19.059 7.883 -0.129 1.00 0.86 H new ATOM 0 HA LYS A1950 -19.321 6.827 2.614 1.00 0.83 H new ATOM 0 HB2 LYS A1950 -20.937 6.075 0.848 1.00 0.95 H new ATOM 0 HB3 LYS A1950 -19.594 5.413 -0.062 1.00 0.95 H new ATOM 0 HG2 LYS A1950 -19.053 3.883 1.795 1.00 1.31 H new ATOM 0 HG3 LYS A1950 -20.334 4.579 2.768 1.00 1.31 H new ATOM 0 HD2 LYS A1950 -21.147 2.507 1.854 1.00 1.91 H new ATOM 0 HD3 LYS A1950 -22.006 3.815 1.064 1.00 1.91 H new ATOM 0 HE2 LYS A1950 -21.313 2.032 -0.523 1.00 2.18 H new ATOM 0 HE3 LYS A1950 -20.646 3.598 -0.939 1.00 2.18 H new ATOM 0 HZ1 LYS A1950 -19.153 1.503 -0.927 1.00 2.52 H new ATOM 0 HZ2 LYS A1950 -18.542 2.974 -0.339 1.00 2.52 H new ATOM 0 HZ3 LYS A1950 -19.065 1.778 0.746 1.00 2.52 H new ATOM 976 N THR A1951 -17.142 5.590 2.670 1.00 0.68 N ATOM 977 CA THR A1951 -15.801 5.107 2.799 1.00 0.60 C ATOM 978 C THR A1951 -15.758 3.569 2.833 1.00 0.57 C ATOM 979 O THR A1951 -16.379 2.922 3.698 1.00 0.72 O ATOM 980 CB THR A1951 -15.147 5.708 4.054 1.00 0.73 C ATOM 981 OG1 THR A1951 -16.016 5.544 5.191 1.00 1.05 O ATOM 982 CG2 THR A1951 -14.837 7.185 3.852 1.00 1.07 C ATOM 0 H THR A1951 -17.729 5.424 3.487 1.00 0.68 H new ATOM 0 HA THR A1951 -15.235 5.424 1.923 1.00 0.60 H new ATOM 0 HB THR A1951 -14.211 5.180 4.235 1.00 0.73 H new ATOM 0 HG1 THR A1951 -16.500 4.695 5.113 1.00 1.05 H new ATOM 0 HG21 THR A1951 -14.375 7.586 4.754 1.00 1.07 H new ATOM 0 HG22 THR A1951 -14.153 7.302 3.011 1.00 1.07 H new ATOM 0 HG23 THR A1951 -15.761 7.726 3.646 1.00 1.07 H new ATOM 990 N LEU A1952 -15.073 2.995 1.884 1.00 0.52 N ATOM 991 CA LEU A1952 -14.952 1.564 1.753 1.00 0.52 C ATOM 992 C LEU A1952 -13.534 1.114 2.116 1.00 0.47 C ATOM 993 O LEU A1952 -12.566 1.540 1.492 1.00 0.52 O ATOM 994 CB LEU A1952 -15.249 1.179 0.297 1.00 0.57 C ATOM 995 CG LEU A1952 -15.191 -0.303 -0.042 1.00 0.63 C ATOM 996 CD1 LEU A1952 -16.289 -1.050 0.675 1.00 1.14 C ATOM 997 CD2 LEU A1952 -15.281 -0.512 -1.543 1.00 1.15 C ATOM 0 H LEU A1952 -14.572 3.516 1.164 1.00 0.52 H new ATOM 0 HA LEU A1952 -15.657 1.078 2.427 1.00 0.52 H new ATOM 0 HB2 LEU A1952 -16.243 1.548 0.043 1.00 0.57 H new ATOM 0 HB3 LEU A1952 -14.541 1.703 -0.345 1.00 0.57 H new ATOM 0 HG LEU A1952 -14.233 -0.699 0.296 1.00 0.63 H new ATOM 0 HD11 LEU A1952 -16.234 -2.109 0.422 1.00 1.14 H new ATOM 0 HD12 LEU A1952 -16.170 -0.927 1.751 1.00 1.14 H new ATOM 0 HD13 LEU A1952 -17.258 -0.654 0.370 1.00 1.14 H new ATOM 0 HD21 LEU A1952 -15.238 -1.578 -1.765 1.00 1.15 H new ATOM 0 HD22 LEU A1952 -16.221 -0.102 -1.912 1.00 1.15 H new ATOM 0 HD23 LEU A1952 -14.448 -0.006 -2.031 1.00 1.15 H new ATOM 1009 N ASN A1953 -13.402 0.286 3.120 1.00 0.48 N ATOM 1010 CA ASN A1953 -12.095 -0.248 3.473 1.00 0.45 C ATOM 1011 C ASN A1953 -11.757 -1.402 2.559 1.00 0.46 C ATOM 1012 O ASN A1953 -12.417 -2.436 2.586 1.00 0.64 O ATOM 1013 CB ASN A1953 -12.028 -0.687 4.954 1.00 0.59 C ATOM 1014 CG ASN A1953 -10.722 -1.409 5.305 1.00 1.20 C ATOM 1015 OD1 ASN A1953 -9.726 -0.787 5.608 1.00 1.86 O ATOM 1016 ND2 ASN A1953 -10.739 -2.716 5.313 1.00 1.93 N ATOM 0 H ASN A1953 -14.171 -0.036 3.708 1.00 0.48 H new ATOM 0 HA ASN A1953 -11.359 0.546 3.345 1.00 0.45 H new ATOM 0 HB2 ASN A1953 -12.135 0.190 5.593 1.00 0.59 H new ATOM 0 HB3 ASN A1953 -12.870 -1.344 5.171 1.00 0.59 H new ATOM 0 HD21 ASN A1953 -9.902 -3.235 5.578 1.00 1.93 H new ATOM 0 HD22 ASN A1953 -11.589 -3.217 5.054 1.00 1.93 H new ATOM 1023 N ALA A1954 -10.762 -1.211 1.726 1.00 0.43 N ATOM 1024 CA ALA A1954 -10.346 -2.264 0.817 1.00 0.58 C ATOM 1025 C ALA A1954 -9.168 -3.004 1.399 1.00 0.70 C ATOM 1026 O ALA A1954 -8.755 -4.054 0.894 1.00 1.17 O ATOM 1027 CB ALA A1954 -9.998 -1.701 -0.546 1.00 0.69 C ATOM 0 H ALA A1954 -10.226 -0.346 1.655 1.00 0.43 H new ATOM 0 HA ALA A1954 -11.176 -2.959 0.688 1.00 0.58 H new ATOM 0 HB1 ALA A1954 -9.690 -2.511 -1.207 1.00 0.69 H new ATOM 0 HB2 ALA A1954 -10.871 -1.202 -0.967 1.00 0.69 H new ATOM 0 HB3 ALA A1954 -9.183 -0.984 -0.446 1.00 0.69 H new ATOM 1033 N GLY A1955 -8.630 -2.450 2.453 1.00 0.42 N ATOM 1034 CA GLY A1955 -7.525 -3.043 3.101 1.00 0.51 C ATOM 1035 C GLY A1955 -7.130 -2.276 4.324 1.00 0.43 C ATOM 1036 O GLY A1955 -6.776 -1.096 4.242 1.00 0.47 O ATOM 0 H GLY A1955 -8.954 -1.579 2.873 1.00 0.42 H new ATOM 0 HA2 GLY A1955 -7.771 -4.068 3.377 1.00 0.51 H new ATOM 0 HA3 GLY A1955 -6.681 -3.092 2.413 1.00 0.51 H new ATOM 1040 N LYS A1956 -7.210 -2.918 5.452 1.00 0.43 N ATOM 1041 CA LYS A1956 -6.804 -2.325 6.696 1.00 0.45 C ATOM 1042 C LYS A1956 -5.303 -2.353 6.740 1.00 0.38 C ATOM 1043 O LYS A1956 -4.670 -3.167 6.049 1.00 0.40 O ATOM 1044 CB LYS A1956 -7.353 -3.101 7.909 1.00 0.61 C ATOM 1045 CG LYS A1956 -6.811 -4.529 8.033 1.00 0.70 C ATOM 1046 CD LYS A1956 -7.319 -5.242 9.275 1.00 0.97 C ATOM 1047 CE LYS A1956 -6.798 -4.618 10.569 1.00 1.54 C ATOM 1048 NZ LYS A1956 -5.322 -4.732 10.721 1.00 2.43 N ATOM 0 H LYS A1956 -7.560 -3.872 5.538 1.00 0.43 H new ATOM 0 HA LYS A1956 -7.196 -1.309 6.750 1.00 0.45 H new ATOM 0 HB2 LYS A1956 -7.111 -2.551 8.819 1.00 0.61 H new ATOM 0 HB3 LYS A1956 -8.440 -3.141 7.840 1.00 0.61 H new ATOM 0 HG2 LYS A1956 -7.096 -5.100 7.149 1.00 0.70 H new ATOM 0 HG3 LYS A1956 -5.722 -4.499 8.056 1.00 0.70 H new ATOM 0 HD2 LYS A1956 -8.409 -5.222 9.280 1.00 0.97 H new ATOM 0 HD3 LYS A1956 -7.020 -6.289 9.235 1.00 0.97 H new ATOM 0 HE2 LYS A1956 -7.080 -3.565 10.596 1.00 1.54 H new ATOM 0 HE3 LYS A1956 -7.283 -5.100 11.418 1.00 1.54 H new ATOM 0 HZ1 LYS A1956 -5.054 -4.496 11.698 1.00 2.43 H new ATOM 0 HZ2 LYS A1956 -5.025 -5.705 10.506 1.00 2.43 H new ATOM 0 HZ3 LYS A1956 -4.854 -4.074 10.065 1.00 2.43 H new ATOM 1062 N LEU A1957 -4.737 -1.508 7.521 1.00 0.42 N ATOM 1063 CA LEU A1957 -3.334 -1.464 7.649 1.00 0.45 C ATOM 1064 C LEU A1957 -2.902 -2.670 8.439 1.00 0.45 C ATOM 1065 O LEU A1957 -3.542 -3.050 9.422 1.00 0.53 O ATOM 1066 CB LEU A1957 -2.901 -0.147 8.337 1.00 0.57 C ATOM 1067 CG LEU A1957 -1.412 0.275 8.242 1.00 0.77 C ATOM 1068 CD1 LEU A1957 -0.501 -0.574 9.056 1.00 1.24 C ATOM 1069 CD2 LEU A1957 -0.947 0.239 6.830 1.00 1.30 C ATOM 0 H LEU A1957 -5.239 -0.826 8.090 1.00 0.42 H new ATOM 0 HA LEU A1957 -2.856 -1.485 6.670 1.00 0.45 H new ATOM 0 HB2 LEU A1957 -3.503 0.660 7.919 1.00 0.57 H new ATOM 0 HB3 LEU A1957 -3.159 -0.223 9.393 1.00 0.57 H new ATOM 0 HG LEU A1957 -1.371 1.289 8.641 1.00 0.77 H new ATOM 0 HD11 LEU A1957 0.524 -0.221 8.942 1.00 1.24 H new ATOM 0 HD12 LEU A1957 -0.790 -0.515 10.105 1.00 1.24 H new ATOM 0 HD13 LEU A1957 -0.569 -1.608 8.718 1.00 1.24 H new ATOM 0 HD21 LEU A1957 0.100 0.538 6.784 1.00 1.30 H new ATOM 0 HD22 LEU A1957 -1.053 -0.772 6.438 1.00 1.30 H new ATOM 0 HD23 LEU A1957 -1.547 0.925 6.232 1.00 1.30 H new ATOM 1081 N SER A1958 -1.916 -3.306 7.952 1.00 0.56 N ATOM 1082 CA SER A1958 -1.278 -4.352 8.630 1.00 0.67 C ATOM 1083 C SER A1958 0.172 -4.050 8.450 1.00 0.65 C ATOM 1084 O SER A1958 0.664 -4.077 7.334 1.00 0.84 O ATOM 1085 CB SER A1958 -1.647 -5.717 8.012 1.00 0.96 C ATOM 1086 OG SER A1958 -1.172 -6.802 8.809 1.00 1.62 O ATOM 0 H SER A1958 -1.516 -3.104 7.035 1.00 0.56 H new ATOM 0 HA SER A1958 -1.567 -4.420 9.679 1.00 0.67 H new ATOM 0 HB2 SER A1958 -2.730 -5.789 7.907 1.00 0.96 H new ATOM 0 HB3 SER A1958 -1.225 -5.789 7.010 1.00 0.96 H new ATOM 0 HG SER A1958 -1.424 -7.651 8.390 1.00 1.62 H new ATOM 1092 N LYS A1959 0.839 -3.657 9.503 1.00 0.59 N ATOM 1093 CA LYS A1959 2.240 -3.317 9.390 1.00 0.71 C ATOM 1094 C LYS A1959 3.098 -4.579 9.333 1.00 0.76 C ATOM 1095 O LYS A1959 3.797 -4.948 10.280 1.00 1.04 O ATOM 1096 CB LYS A1959 2.746 -2.248 10.428 1.00 0.86 C ATOM 1097 CG LYS A1959 2.507 -2.503 11.924 1.00 0.96 C ATOM 1098 CD LYS A1959 1.063 -2.287 12.401 1.00 1.10 C ATOM 1099 CE LYS A1959 0.585 -0.850 12.164 1.00 0.98 C ATOM 1100 NZ LYS A1959 -0.784 -0.630 12.680 1.00 1.48 N ATOM 0 H LYS A1959 0.445 -3.564 10.439 1.00 0.59 H new ATOM 0 HA LYS A1959 2.356 -2.798 8.439 1.00 0.71 H new ATOM 0 HB2 LYS A1959 3.819 -2.126 10.281 1.00 0.86 H new ATOM 0 HB3 LYS A1959 2.279 -1.296 10.176 1.00 0.86 H new ATOM 0 HG2 LYS A1959 2.799 -3.528 12.153 1.00 0.96 H new ATOM 0 HG3 LYS A1959 3.164 -1.849 12.497 1.00 0.96 H new ATOM 0 HD2 LYS A1959 0.402 -2.979 11.879 1.00 1.10 H new ATOM 0 HD3 LYS A1959 0.994 -2.521 13.463 1.00 1.10 H new ATOM 0 HE2 LYS A1959 1.271 -0.155 12.648 1.00 0.98 H new ATOM 0 HE3 LYS A1959 0.610 -0.631 11.097 1.00 0.98 H new ATOM 0 HZ1 LYS A1959 -1.166 0.253 12.285 1.00 1.48 H new ATOM 0 HZ2 LYS A1959 -1.392 -1.426 12.401 1.00 1.48 H new ATOM 0 HZ3 LYS A1959 -0.757 -0.562 13.717 1.00 1.48 H new ATOM 1114 N THR A1960 2.946 -5.257 8.232 1.00 0.74 N ATOM 1115 CA THR A1960 3.548 -6.509 7.961 1.00 0.81 C ATOM 1116 C THR A1960 4.235 -6.411 6.609 1.00 0.77 C ATOM 1117 O THR A1960 3.593 -6.543 5.561 1.00 1.05 O ATOM 1118 CB THR A1960 2.439 -7.580 7.888 1.00 0.92 C ATOM 1119 OG1 THR A1960 1.562 -7.436 9.030 1.00 1.63 O ATOM 1120 CG2 THR A1960 3.027 -8.984 7.874 1.00 1.27 C ATOM 0 H THR A1960 2.364 -4.923 7.464 1.00 0.74 H new ATOM 0 HA THR A1960 4.267 -6.774 8.736 1.00 0.81 H new ATOM 0 HB THR A1960 1.881 -7.436 6.963 1.00 0.92 H new ATOM 0 HG1 THR A1960 0.659 -7.213 8.723 1.00 1.63 H new ATOM 0 HG21 THR A1960 2.221 -9.716 7.822 1.00 1.27 H new ATOM 0 HG22 THR A1960 3.677 -9.098 7.006 1.00 1.27 H new ATOM 0 HG23 THR A1960 3.605 -9.145 8.784 1.00 1.27 H new ATOM 1128 N LEU A1961 5.502 -6.137 6.629 1.00 0.55 N ATOM 1129 CA LEU A1961 6.232 -5.958 5.423 1.00 0.51 C ATOM 1130 C LEU A1961 6.954 -7.249 5.115 1.00 0.51 C ATOM 1131 O LEU A1961 7.549 -7.867 6.008 1.00 0.58 O ATOM 1132 CB LEU A1961 7.208 -4.792 5.561 1.00 0.62 C ATOM 1133 CG LEU A1961 7.772 -4.272 4.254 1.00 0.71 C ATOM 1134 CD1 LEU A1961 6.647 -3.745 3.372 1.00 1.35 C ATOM 1135 CD2 LEU A1961 8.812 -3.196 4.500 1.00 1.32 C ATOM 0 H LEU A1961 6.054 -6.032 7.481 1.00 0.55 H new ATOM 0 HA LEU A1961 5.558 -5.716 4.601 1.00 0.51 H new ATOM 0 HB2 LEU A1961 6.703 -3.973 6.073 1.00 0.62 H new ATOM 0 HB3 LEU A1961 8.036 -5.104 6.198 1.00 0.62 H new ATOM 0 HG LEU A1961 8.264 -5.097 3.738 1.00 0.71 H new ATOM 0 HD11 LEU A1961 7.063 -3.374 2.435 1.00 1.35 H new ATOM 0 HD12 LEU A1961 5.942 -4.549 3.162 1.00 1.35 H new ATOM 0 HD13 LEU A1961 6.131 -2.935 3.886 1.00 1.35 H new ATOM 0 HD21 LEU A1961 9.200 -2.840 3.546 1.00 1.32 H new ATOM 0 HD22 LEU A1961 8.356 -2.365 5.038 1.00 1.32 H new ATOM 0 HD23 LEU A1961 9.628 -3.608 5.093 1.00 1.32 H new ATOM 1147 N THR A1962 6.886 -7.670 3.894 1.00 0.51 N ATOM 1148 CA THR A1962 7.403 -8.946 3.502 1.00 0.58 C ATOM 1149 C THR A1962 7.907 -8.873 2.055 1.00 0.51 C ATOM 1150 O THR A1962 7.536 -7.969 1.320 1.00 0.72 O ATOM 1151 CB THR A1962 6.270 -10.021 3.711 1.00 0.72 C ATOM 1152 OG1 THR A1962 6.563 -11.292 3.116 1.00 1.19 O ATOM 1153 CG2 THR A1962 4.908 -9.506 3.254 1.00 0.61 C ATOM 0 H THR A1962 6.467 -7.136 3.133 1.00 0.51 H new ATOM 0 HA THR A1962 8.258 -9.238 4.112 1.00 0.58 H new ATOM 0 HB THR A1962 6.231 -10.190 4.787 1.00 0.72 H new ATOM 0 HG1 THR A1962 5.822 -11.911 3.284 1.00 1.19 H new ATOM 0 HG21 THR A1962 4.155 -10.277 3.415 1.00 0.61 H new ATOM 0 HG22 THR A1962 4.645 -8.616 3.826 1.00 0.61 H new ATOM 0 HG23 THR A1962 4.951 -9.256 2.194 1.00 0.61 H new ATOM 1161 N TYR A1963 8.782 -9.765 1.671 1.00 0.47 N ATOM 1162 CA TYR A1963 9.308 -9.758 0.335 1.00 0.48 C ATOM 1163 C TYR A1963 8.945 -11.031 -0.412 1.00 0.55 C ATOM 1164 O TYR A1963 9.354 -12.124 -0.042 1.00 0.75 O ATOM 1165 CB TYR A1963 10.834 -9.444 0.303 1.00 0.62 C ATOM 1166 CG TYR A1963 11.747 -10.351 1.134 1.00 0.78 C ATOM 1167 CD1 TYR A1963 12.259 -11.532 0.603 1.00 1.03 C ATOM 1168 CD2 TYR A1963 12.066 -10.039 2.452 1.00 0.78 C ATOM 1169 CE1 TYR A1963 13.058 -12.374 1.362 1.00 1.27 C ATOM 1170 CE2 TYR A1963 12.868 -10.867 3.210 1.00 1.01 C ATOM 1171 CZ TYR A1963 13.458 -11.967 2.629 1.00 1.25 C ATOM 1172 OH TYR A1963 14.150 -12.877 3.437 1.00 1.52 O ATOM 0 H TYR A1963 9.145 -10.508 2.268 1.00 0.47 H new ATOM 0 HA TYR A1963 8.829 -8.938 -0.200 1.00 0.48 H new ATOM 0 HB2 TYR A1963 11.167 -9.486 -0.734 1.00 0.62 H new ATOM 0 HB3 TYR A1963 10.976 -8.418 0.642 1.00 0.62 H new ATOM 0 HD1 TYR A1963 12.030 -11.797 -0.419 1.00 1.03 H new ATOM 0 HD2 TYR A1963 11.678 -9.131 2.890 1.00 0.78 H new ATOM 0 HE1 TYR A1963 13.365 -13.334 0.973 1.00 1.27 H new ATOM 0 HE2 TYR A1963 13.032 -10.653 4.256 1.00 1.01 H new ATOM 0 HH TYR A1963 14.367 -12.454 4.294 1.00 1.52 H new ATOM 1182 N GLU A1964 8.166 -10.869 -1.450 1.00 0.54 N ATOM 1183 CA GLU A1964 7.700 -11.956 -2.298 1.00 0.70 C ATOM 1184 C GLU A1964 8.019 -11.578 -3.723 1.00 0.80 C ATOM 1185 O GLU A1964 7.855 -10.413 -4.092 1.00 0.78 O ATOM 1186 CB GLU A1964 6.190 -12.160 -2.136 1.00 0.87 C ATOM 1187 CG GLU A1964 5.756 -12.700 -0.783 1.00 1.25 C ATOM 1188 CD GLU A1964 6.123 -14.153 -0.600 1.00 1.87 C ATOM 1189 OE1 GLU A1964 5.350 -15.029 -1.045 1.00 2.22 O ATOM 1190 OE2 GLU A1964 7.163 -14.458 -0.016 1.00 2.75 O ATOM 0 H GLU A1964 7.824 -9.954 -1.744 1.00 0.54 H new ATOM 0 HA GLU A1964 8.190 -12.889 -2.021 1.00 0.70 H new ATOM 0 HB2 GLU A1964 5.689 -11.207 -2.308 1.00 0.87 H new ATOM 0 HB3 GLU A1964 5.846 -12.845 -2.911 1.00 0.87 H new ATOM 0 HG2 GLU A1964 6.219 -12.109 0.007 1.00 1.25 H new ATOM 0 HG3 GLU A1964 4.677 -12.584 -0.677 1.00 1.25 H new ATOM 1197 N ASP A1965 8.556 -12.533 -4.492 1.00 1.04 N ATOM 1198 CA ASP A1965 8.993 -12.330 -5.903 1.00 1.25 C ATOM 1199 C ASP A1965 10.283 -11.512 -5.882 1.00 1.07 C ATOM 1200 O ASP A1965 10.802 -11.068 -6.903 1.00 1.08 O ATOM 1201 CB ASP A1965 7.878 -11.642 -6.756 1.00 1.46 C ATOM 1202 CG ASP A1965 8.188 -11.541 -8.241 1.00 2.18 C ATOM 1203 OD1 ASP A1965 8.311 -12.592 -8.897 1.00 2.64 O ATOM 1204 OD2 ASP A1965 8.234 -10.414 -8.791 1.00 2.74 O ATOM 0 H ASP A1965 8.707 -13.485 -4.159 1.00 1.04 H new ATOM 0 HA ASP A1965 9.179 -13.293 -6.379 1.00 1.25 H new ATOM 0 HB2 ASP A1965 6.948 -12.196 -6.629 1.00 1.46 H new ATOM 0 HB3 ASP A1965 7.707 -10.639 -6.365 1.00 1.46 H new ATOM 1209 N GLN A1966 10.810 -11.365 -4.653 1.00 1.03 N ATOM 1210 CA GLN A1966 11.988 -10.568 -4.333 1.00 1.04 C ATOM 1211 C GLN A1966 11.733 -9.075 -4.564 1.00 0.84 C ATOM 1212 O GLN A1966 12.650 -8.247 -4.596 1.00 1.05 O ATOM 1213 CB GLN A1966 13.251 -11.123 -4.998 1.00 1.33 C ATOM 1214 CG GLN A1966 13.627 -12.490 -4.422 1.00 1.71 C ATOM 1215 CD GLN A1966 14.848 -13.117 -5.052 1.00 2.12 C ATOM 1216 OE1 GLN A1966 15.747 -12.433 -5.526 1.00 2.66 O ATOM 1217 NE2 GLN A1966 14.904 -14.418 -5.035 1.00 2.40 N ATOM 0 H GLN A1966 10.406 -11.817 -3.833 1.00 1.03 H new ATOM 0 HA GLN A1966 12.187 -10.655 -3.265 1.00 1.04 H new ATOM 0 HB2 GLN A1966 13.091 -11.210 -6.073 1.00 1.33 H new ATOM 0 HB3 GLN A1966 14.077 -10.426 -4.855 1.00 1.33 H new ATOM 0 HG2 GLN A1966 13.799 -12.385 -3.351 1.00 1.71 H new ATOM 0 HG3 GLN A1966 12.782 -13.167 -4.544 1.00 1.71 H new ATOM 0 HE21 GLN A1966 14.137 -14.956 -4.632 1.00 2.40 H new ATOM 0 HE22 GLN A1966 15.715 -14.899 -5.425 1.00 2.40 H new ATOM 1226 N VAL A1967 10.455 -8.757 -4.655 1.00 0.60 N ATOM 1227 CA VAL A1967 9.953 -7.413 -4.723 1.00 0.49 C ATOM 1228 C VAL A1967 9.308 -7.189 -3.358 1.00 0.41 C ATOM 1229 O VAL A1967 9.033 -8.174 -2.643 1.00 0.41 O ATOM 1230 CB VAL A1967 8.880 -7.258 -5.863 1.00 0.52 C ATOM 1231 CG1 VAL A1967 8.439 -5.815 -6.047 1.00 1.01 C ATOM 1232 CG2 VAL A1967 9.404 -7.802 -7.171 1.00 1.06 C ATOM 0 H VAL A1967 9.717 -9.460 -4.684 1.00 0.60 H new ATOM 0 HA VAL A1967 10.740 -6.693 -4.949 1.00 0.49 H new ATOM 0 HB VAL A1967 8.009 -7.836 -5.554 1.00 0.52 H new ATOM 0 HG11 VAL A1967 7.698 -5.760 -6.845 1.00 1.01 H new ATOM 0 HG12 VAL A1967 8.001 -5.447 -5.119 1.00 1.01 H new ATOM 0 HG13 VAL A1967 9.301 -5.202 -6.309 1.00 1.01 H new ATOM 0 HG21 VAL A1967 8.645 -7.684 -7.944 1.00 1.06 H new ATOM 0 HG22 VAL A1967 10.303 -7.256 -7.458 1.00 1.06 H new ATOM 0 HG23 VAL A1967 9.643 -8.859 -7.056 1.00 1.06 H new ATOM 1242 N LEU A1968 9.075 -5.974 -2.971 1.00 0.41 N ATOM 1243 CA LEU A1968 8.546 -5.741 -1.664 1.00 0.38 C ATOM 1244 C LEU A1968 7.024 -5.881 -1.700 1.00 0.37 C ATOM 1245 O LEU A1968 6.390 -5.444 -2.645 1.00 0.49 O ATOM 1246 CB LEU A1968 9.001 -4.376 -1.187 1.00 0.42 C ATOM 1247 CG LEU A1968 8.741 -4.042 0.257 1.00 0.43 C ATOM 1248 CD1 LEU A1968 9.343 -5.113 1.149 1.00 0.47 C ATOM 1249 CD2 LEU A1968 9.352 -2.698 0.572 1.00 0.50 C ATOM 0 H LEU A1968 9.240 -5.138 -3.532 1.00 0.41 H new ATOM 0 HA LEU A1968 8.917 -6.478 -0.952 1.00 0.38 H new ATOM 0 HB2 LEU A1968 10.073 -4.293 -1.368 1.00 0.42 H new ATOM 0 HB3 LEU A1968 8.514 -3.621 -1.804 1.00 0.42 H new ATOM 0 HG LEU A1968 7.667 -4.001 0.437 1.00 0.43 H new ATOM 0 HD11 LEU A1968 9.152 -4.866 2.193 1.00 0.47 H new ATOM 0 HD12 LEU A1968 8.891 -6.077 0.915 1.00 0.47 H new ATOM 0 HD13 LEU A1968 10.418 -5.165 0.979 1.00 0.47 H new ATOM 0 HD21 LEU A1968 9.167 -2.450 1.617 1.00 0.50 H new ATOM 0 HD22 LEU A1968 10.426 -2.736 0.393 1.00 0.50 H new ATOM 0 HD23 LEU A1968 8.904 -1.936 -0.066 1.00 0.50 H new ATOM 1261 N LYS A1969 6.455 -6.533 -0.710 1.00 0.33 N ATOM 1262 CA LYS A1969 5.022 -6.810 -0.678 1.00 0.36 C ATOM 1263 C LYS A1969 4.442 -6.498 0.693 1.00 0.34 C ATOM 1264 O LYS A1969 5.160 -6.510 1.705 1.00 0.36 O ATOM 1265 CB LYS A1969 4.767 -8.297 -0.969 1.00 0.47 C ATOM 1266 CG LYS A1969 5.290 -8.804 -2.298 1.00 0.73 C ATOM 1267 CD LYS A1969 4.578 -8.182 -3.475 1.00 1.19 C ATOM 1268 CE LYS A1969 5.112 -8.745 -4.775 1.00 1.19 C ATOM 1269 NZ LYS A1969 4.385 -8.225 -5.938 1.00 1.29 N ATOM 0 H LYS A1969 6.966 -6.889 0.098 1.00 0.33 H new ATOM 0 HA LYS A1969 4.547 -6.183 -1.433 1.00 0.36 H new ATOM 0 HB2 LYS A1969 5.219 -8.887 -0.172 1.00 0.47 H new ATOM 0 HB3 LYS A1969 3.693 -8.477 -0.929 1.00 0.47 H new ATOM 0 HG2 LYS A1969 6.357 -8.592 -2.370 1.00 0.73 H new ATOM 0 HG3 LYS A1969 5.177 -9.887 -2.340 1.00 0.73 H new ATOM 0 HD2 LYS A1969 3.507 -8.372 -3.402 1.00 1.19 H new ATOM 0 HD3 LYS A1969 4.711 -7.100 -3.458 1.00 1.19 H new ATOM 0 HE2 LYS A1969 6.170 -8.500 -4.869 1.00 1.19 H new ATOM 0 HE3 LYS A1969 5.037 -9.832 -4.757 1.00 1.19 H new ATOM 0 HZ1 LYS A1969 4.517 -8.867 -6.745 1.00 1.29 H new ATOM 0 HZ2 LYS A1969 3.372 -8.156 -5.712 1.00 1.29 H new ATOM 0 HZ3 LYS A1969 4.750 -7.282 -6.182 1.00 1.29 H new ATOM 1283 N LEU A1970 3.158 -6.236 0.723 1.00 0.42 N ATOM 1284 CA LEU A1970 2.434 -6.003 1.949 1.00 0.49 C ATOM 1285 C LEU A1970 0.969 -6.402 1.679 1.00 0.46 C ATOM 1286 O LEU A1970 0.462 -6.179 0.573 1.00 0.57 O ATOM 1287 CB LEU A1970 2.575 -4.508 2.347 1.00 0.60 C ATOM 1288 CG LEU A1970 2.326 -4.120 3.822 1.00 0.91 C ATOM 1289 CD1 LEU A1970 2.767 -2.693 4.061 1.00 1.11 C ATOM 1290 CD2 LEU A1970 0.869 -4.266 4.209 1.00 1.75 C ATOM 0 H LEU A1970 2.579 -6.178 -0.115 1.00 0.42 H new ATOM 0 HA LEU A1970 2.821 -6.590 2.782 1.00 0.49 H new ATOM 0 HB2 LEU A1970 3.583 -4.187 2.083 1.00 0.60 H new ATOM 0 HB3 LEU A1970 1.885 -3.932 1.730 1.00 0.60 H new ATOM 0 HG LEU A1970 2.909 -4.802 4.441 1.00 0.91 H new ATOM 0 HD11 LEU A1970 2.588 -2.427 5.103 1.00 1.11 H new ATOM 0 HD12 LEU A1970 3.830 -2.599 3.839 1.00 1.11 H new ATOM 0 HD13 LEU A1970 2.201 -2.024 3.413 1.00 1.11 H new ATOM 0 HD21 LEU A1970 0.740 -3.983 5.254 1.00 1.75 H new ATOM 0 HD22 LEU A1970 0.259 -3.619 3.579 1.00 1.75 H new ATOM 0 HD23 LEU A1970 0.558 -5.302 4.073 1.00 1.75 H new ATOM 1302 N VAL A1971 0.327 -7.035 2.647 1.00 0.46 N ATOM 1303 CA VAL A1971 -1.059 -7.484 2.511 1.00 0.48 C ATOM 1304 C VAL A1971 -1.992 -6.677 3.422 1.00 0.45 C ATOM 1305 O VAL A1971 -1.772 -6.559 4.632 1.00 0.60 O ATOM 1306 CB VAL A1971 -1.215 -9.020 2.790 1.00 0.64 C ATOM 1307 CG1 VAL A1971 -0.493 -9.828 1.725 1.00 0.73 C ATOM 1308 CG2 VAL A1971 -0.687 -9.403 4.175 1.00 0.74 C ATOM 0 H VAL A1971 0.747 -7.254 3.550 1.00 0.46 H new ATOM 0 HA VAL A1971 -1.346 -7.309 1.474 1.00 0.48 H new ATOM 0 HB VAL A1971 -2.280 -9.248 2.760 1.00 0.64 H new ATOM 0 HG11 VAL A1971 -0.611 -10.891 1.933 1.00 0.73 H new ATOM 0 HG12 VAL A1971 -0.916 -9.601 0.747 1.00 0.73 H new ATOM 0 HG13 VAL A1971 0.567 -9.572 1.730 1.00 0.73 H new ATOM 0 HG21 VAL A1971 -0.813 -10.475 4.329 1.00 0.74 H new ATOM 0 HG22 VAL A1971 0.371 -9.149 4.244 1.00 0.74 H new ATOM 0 HG23 VAL A1971 -1.242 -8.859 4.939 1.00 0.74 H new ATOM 1318 N TYR A1972 -2.989 -6.093 2.828 1.00 0.38 N ATOM 1319 CA TYR A1972 -3.967 -5.304 3.542 1.00 0.39 C ATOM 1320 C TYR A1972 -5.250 -6.107 3.684 1.00 0.45 C ATOM 1321 O TYR A1972 -5.903 -6.422 2.700 1.00 0.55 O ATOM 1322 CB TYR A1972 -4.211 -3.976 2.812 1.00 0.43 C ATOM 1323 CG TYR A1972 -2.977 -3.104 2.716 1.00 0.56 C ATOM 1324 CD1 TYR A1972 -2.082 -3.243 1.669 1.00 0.79 C ATOM 1325 CD2 TYR A1972 -2.715 -2.133 3.668 1.00 0.75 C ATOM 1326 CE1 TYR A1972 -0.959 -2.442 1.576 1.00 0.98 C ATOM 1327 CE2 TYR A1972 -1.600 -1.334 3.578 1.00 0.97 C ATOM 1328 CZ TYR A1972 -0.703 -1.519 2.548 1.00 1.04 C ATOM 1329 OH TYR A1972 0.386 -0.682 2.450 1.00 1.27 O ATOM 0 H TYR A1972 -3.155 -6.147 1.823 1.00 0.38 H new ATOM 0 HA TYR A1972 -3.596 -5.066 4.539 1.00 0.39 H new ATOM 0 HB2 TYR A1972 -4.578 -4.185 1.807 1.00 0.43 H new ATOM 0 HB3 TYR A1972 -4.996 -3.425 3.330 1.00 0.43 H new ATOM 0 HD1 TYR A1972 -2.264 -3.991 0.911 1.00 0.79 H new ATOM 0 HD2 TYR A1972 -3.398 -2.001 4.494 1.00 0.75 H new ATOM 0 HE1 TYR A1972 -0.287 -2.546 0.737 1.00 0.98 H new ATOM 0 HE2 TYR A1972 -1.427 -0.562 4.313 1.00 0.97 H new ATOM 0 HH TYR A1972 0.703 -0.451 3.348 1.00 1.27 H new ATOM 1339 N GLU A1973 -5.583 -6.437 4.900 1.00 0.57 N ATOM 1340 CA GLU A1973 -6.702 -7.332 5.210 1.00 0.73 C ATOM 1341 C GLU A1973 -8.038 -6.615 5.193 1.00 0.58 C ATOM 1342 O GLU A1973 -8.094 -5.393 5.119 1.00 0.57 O ATOM 1343 CB GLU A1973 -6.523 -7.862 6.615 1.00 1.09 C ATOM 1344 CG GLU A1973 -5.187 -8.517 6.888 1.00 1.33 C ATOM 1345 CD GLU A1973 -4.993 -8.799 8.353 1.00 1.89 C ATOM 1346 OE1 GLU A1973 -5.223 -7.887 9.180 1.00 2.75 O ATOM 1347 OE2 GLU A1973 -4.577 -9.927 8.712 1.00 2.17 O ATOM 0 H GLU A1973 -5.090 -6.097 5.725 1.00 0.57 H new ATOM 0 HA GLU A1973 -6.703 -8.117 4.454 1.00 0.73 H new ATOM 0 HB2 GLU A1973 -6.657 -7.039 7.317 1.00 1.09 H new ATOM 0 HB3 GLU A1973 -7.313 -8.585 6.817 1.00 1.09 H new ATOM 0 HG2 GLU A1973 -5.117 -9.448 6.326 1.00 1.33 H new ATOM 0 HG3 GLU A1973 -4.385 -7.869 6.533 1.00 1.33 H new ATOM 1354 N ASP A1974 -9.094 -7.404 5.310 1.00 0.73 N ATOM 1355 CA ASP A1974 -10.475 -6.932 5.504 1.00 0.79 C ATOM 1356 C ASP A1974 -11.070 -6.208 4.284 1.00 0.83 C ATOM 1357 O ASP A1974 -10.373 -5.799 3.346 1.00 1.13 O ATOM 1358 CB ASP A1974 -10.581 -6.068 6.802 1.00 1.03 C ATOM 1359 CG ASP A1974 -11.997 -5.643 7.162 1.00 1.29 C ATOM 1360 OD1 ASP A1974 -12.738 -6.447 7.779 1.00 1.56 O ATOM 1361 OD2 ASP A1974 -12.395 -4.510 6.842 1.00 1.57 O ATOM 0 H ASP A1974 -9.023 -8.421 5.273 1.00 0.73 H new ATOM 0 HA ASP A1974 -11.089 -7.825 5.624 1.00 0.79 H new ATOM 0 HB2 ASP A1974 -10.162 -6.633 7.635 1.00 1.03 H new ATOM 0 HB3 ASP A1974 -9.967 -5.176 6.681 1.00 1.03 H new ATOM 1366 N GLY A1975 -12.354 -6.119 4.290 1.00 1.18 N ATOM 1367 CA GLY A1975 -13.097 -5.434 3.285 1.00 1.43 C ATOM 1368 C GLY A1975 -14.538 -5.340 3.692 1.00 1.27 C ATOM 1369 O GLY A1975 -14.860 -5.502 4.873 1.00 1.57 O ATOM 0 H GLY A1975 -12.937 -6.534 5.017 1.00 1.18 H new ATOM 0 HA2 GLY A1975 -12.687 -4.436 3.134 1.00 1.43 H new ATOM 0 HA3 GLY A1975 -13.012 -5.961 2.335 1.00 1.43 H new ATOM 1373 N ASP A1976 -15.401 -5.110 2.754 1.00 0.96 N ATOM 1374 CA ASP A1976 -16.818 -5.017 3.036 1.00 0.90 C ATOM 1375 C ASP A1976 -17.446 -6.401 2.821 1.00 0.95 C ATOM 1376 O ASP A1976 -16.724 -7.349 2.434 1.00 1.08 O ATOM 1377 CB ASP A1976 -17.468 -3.975 2.110 1.00 0.95 C ATOM 1378 CG ASP A1976 -17.601 -4.431 0.674 1.00 1.57 C ATOM 1379 OD1 ASP A1976 -16.553 -4.622 0.010 1.00 2.24 O ATOM 1380 OD2 ASP A1976 -18.726 -4.661 0.208 1.00 2.08 O ATOM 0 H ASP A1976 -15.156 -4.980 1.772 1.00 0.96 H new ATOM 0 HA ASP A1976 -16.980 -4.700 4.066 1.00 0.90 H new ATOM 0 HB2 ASP A1976 -18.457 -3.727 2.496 1.00 0.95 H new ATOM 0 HB3 ASP A1976 -16.877 -3.060 2.137 1.00 0.95 H new ATOM 1385 N PRO A1977 -18.757 -6.594 3.120 1.00 1.16 N ATOM 1386 CA PRO A1977 -19.432 -7.860 2.860 1.00 1.39 C ATOM 1387 C PRO A1977 -19.579 -8.139 1.360 1.00 1.45 C ATOM 1388 O PRO A1977 -20.624 -7.882 0.755 1.00 1.66 O ATOM 1389 CB PRO A1977 -20.810 -7.705 3.519 1.00 1.68 C ATOM 1390 CG PRO A1977 -20.683 -6.525 4.411 1.00 1.68 C ATOM 1391 CD PRO A1977 -19.665 -5.635 3.775 1.00 1.41 C ATOM 0 HA PRO A1977 -18.865 -8.702 3.257 1.00 1.39 H new ATOM 0 HB2 PRO A1977 -21.589 -7.552 2.772 1.00 1.68 H new ATOM 0 HB3 PRO A1977 -21.080 -8.598 4.083 1.00 1.68 H new ATOM 0 HG2 PRO A1977 -21.639 -6.011 4.517 1.00 1.68 H new ATOM 0 HG3 PRO A1977 -20.369 -6.824 5.411 1.00 1.68 H new ATOM 0 HD2 PRO A1977 -20.118 -4.951 3.057 1.00 1.41 H new ATOM 0 HD3 PRO A1977 -19.145 -5.024 4.513 1.00 1.41 H new ATOM 1399 N CYS A1978 -18.509 -8.564 0.769 1.00 1.46 N ATOM 1400 CA CYS A1978 -18.479 -8.929 -0.607 1.00 1.62 C ATOM 1401 C CYS A1978 -19.020 -10.343 -0.737 1.00 1.87 C ATOM 1402 O CYS A1978 -18.763 -11.182 0.124 1.00 1.90 O ATOM 1403 CB CYS A1978 -17.024 -8.835 -1.148 1.00 1.58 C ATOM 1404 SG CYS A1978 -16.788 -9.473 -2.856 1.00 1.81 S ATOM 0 H CYS A1978 -17.612 -8.669 1.243 1.00 1.46 H new ATOM 0 HA CYS A1978 -19.096 -8.251 -1.196 1.00 1.62 H new ATOM 0 HB2 CYS A1978 -16.708 -7.792 -1.119 1.00 1.58 H new ATOM 0 HB3 CYS A1978 -16.366 -9.386 -0.476 1.00 1.58 H new ATOM 1409 N PRO A1979 -19.806 -10.634 -1.786 1.00 2.20 N ATOM 1410 CA PRO A1979 -20.337 -11.988 -2.040 1.00 2.55 C ATOM 1411 C PRO A1979 -19.220 -13.024 -2.273 1.00 2.56 C ATOM 1412 O PRO A1979 -19.472 -14.231 -2.330 1.00 2.76 O ATOM 1413 CB PRO A1979 -21.158 -11.810 -3.323 1.00 2.93 C ATOM 1414 CG PRO A1979 -21.489 -10.364 -3.360 1.00 2.90 C ATOM 1415 CD PRO A1979 -20.299 -9.665 -2.782 1.00 2.38 C ATOM 0 HA PRO A1979 -20.908 -12.364 -1.191 1.00 2.55 H new ATOM 0 HB2 PRO A1979 -20.588 -12.108 -4.203 1.00 2.93 H new ATOM 0 HB3 PRO A1979 -22.060 -12.422 -3.305 1.00 2.93 H new ATOM 0 HG2 PRO A1979 -21.682 -10.032 -4.380 1.00 2.90 H new ATOM 0 HG3 PRO A1979 -22.388 -10.152 -2.781 1.00 2.90 H new ATOM 0 HD2 PRO A1979 -19.548 -9.448 -3.542 1.00 2.38 H new ATOM 0 HD3 PRO A1979 -20.571 -8.715 -2.322 1.00 2.38 H new ATOM 1423 N THR A1980 -18.020 -12.540 -2.456 1.00 2.44 N ATOM 1424 CA THR A1980 -16.861 -13.366 -2.645 1.00 2.58 C ATOM 1425 C THR A1980 -15.981 -13.357 -1.352 1.00 2.52 C ATOM 1426 O THR A1980 -14.885 -13.887 -1.321 1.00 2.86 O ATOM 1427 CB THR A1980 -16.084 -12.827 -3.854 1.00 2.52 C ATOM 1428 OG1 THR A1980 -17.055 -12.422 -4.851 1.00 2.72 O ATOM 1429 CG2 THR A1980 -15.221 -13.914 -4.458 1.00 2.83 C ATOM 0 H THR A1980 -17.819 -11.540 -2.478 1.00 2.44 H new ATOM 0 HA THR A1980 -17.151 -14.400 -2.834 1.00 2.58 H new ATOM 0 HB THR A1980 -15.449 -11.999 -3.540 1.00 2.52 H new ATOM 0 HG1 THR A1980 -16.589 -12.070 -5.638 1.00 2.72 H new ATOM 0 HG21 THR A1980 -14.678 -13.514 -5.314 1.00 2.83 H new ATOM 0 HG22 THR A1980 -14.511 -14.271 -3.712 1.00 2.83 H new ATOM 0 HG23 THR A1980 -15.852 -14.741 -4.784 1.00 2.83 H new ATOM 1437 N ASP A1981 -16.514 -12.747 -0.302 1.00 2.25 N ATOM 1438 CA ASP A1981 -15.849 -12.603 1.015 1.00 2.32 C ATOM 1439 C ASP A1981 -16.788 -13.044 2.098 1.00 2.24 C ATOM 1440 O ASP A1981 -16.795 -12.502 3.205 1.00 2.36 O ATOM 1441 CB ASP A1981 -15.490 -11.144 1.294 1.00 2.46 C ATOM 1442 CG ASP A1981 -14.149 -10.682 0.782 1.00 2.87 C ATOM 1443 OD1 ASP A1981 -13.163 -10.745 1.540 1.00 3.20 O ATOM 1444 OD2 ASP A1981 -14.065 -10.138 -0.321 1.00 3.37 O ATOM 0 H ASP A1981 -17.442 -12.324 -0.328 1.00 2.25 H new ATOM 0 HA ASP A1981 -14.944 -13.210 0.997 1.00 2.32 H new ATOM 0 HB2 ASP A1981 -16.261 -10.511 0.856 1.00 2.46 H new ATOM 0 HB3 ASP A1981 -15.520 -10.983 2.372 1.00 2.46 H new ATOM 1449 N LEU A1982 -17.530 -14.041 1.816 1.00 2.24 N ATOM 1450 CA LEU A1982 -18.475 -14.560 2.763 1.00 2.35 C ATOM 1451 C LEU A1982 -17.769 -15.573 3.627 1.00 2.41 C ATOM 1452 O LEU A1982 -17.983 -15.657 4.832 1.00 2.56 O ATOM 1453 CB LEU A1982 -19.597 -15.235 2.010 1.00 2.55 C ATOM 1454 CG LEU A1982 -20.303 -14.376 0.989 1.00 2.64 C ATOM 1455 CD1 LEU A1982 -21.182 -15.232 0.138 1.00 2.83 C ATOM 1456 CD2 LEU A1982 -21.111 -13.300 1.669 1.00 2.91 C ATOM 0 H LEU A1982 -17.511 -14.533 0.923 1.00 2.24 H new ATOM 0 HA LEU A1982 -18.881 -13.760 3.381 1.00 2.35 H new ATOM 0 HB2 LEU A1982 -19.195 -16.113 1.505 1.00 2.55 H new ATOM 0 HB3 LEU A1982 -20.333 -15.591 2.731 1.00 2.55 H new ATOM 0 HG LEU A1982 -19.559 -13.890 0.358 1.00 2.64 H new ATOM 0 HD11 LEU A1982 -21.691 -14.611 -0.599 1.00 2.83 H new ATOM 0 HD12 LEU A1982 -20.576 -15.980 -0.374 1.00 2.83 H new ATOM 0 HD13 LEU A1982 -21.921 -15.731 0.765 1.00 2.83 H new ATOM 0 HD21 LEU A1982 -21.612 -12.691 0.917 1.00 2.91 H new ATOM 0 HD22 LEU A1982 -21.856 -13.760 2.319 1.00 2.91 H new ATOM 0 HD23 LEU A1982 -20.450 -12.670 2.264 1.00 2.91 H new ATOM 1468 N LYS A1983 -16.914 -16.323 2.988 1.00 2.40 N ATOM 1469 CA LYS A1983 -16.171 -17.375 3.610 1.00 2.57 C ATOM 1470 C LYS A1983 -14.689 -16.973 3.786 1.00 2.46 C ATOM 1471 O LYS A1983 -13.886 -17.685 4.401 1.00 2.62 O ATOM 1472 CB LYS A1983 -16.328 -18.640 2.739 1.00 2.75 C ATOM 1473 CG LYS A1983 -15.505 -19.815 3.189 1.00 2.91 C ATOM 1474 CD LYS A1983 -15.814 -21.072 2.392 1.00 3.23 C ATOM 1475 CE LYS A1983 -15.016 -22.262 2.907 1.00 3.77 C ATOM 1476 NZ LYS A1983 -15.336 -23.515 2.180 1.00 4.43 N ATOM 0 H LYS A1983 -16.712 -16.213 1.994 1.00 2.40 H new ATOM 0 HA LYS A1983 -16.553 -17.574 4.611 1.00 2.57 H new ATOM 0 HB2 LYS A1983 -17.378 -18.931 2.730 1.00 2.75 H new ATOM 0 HB3 LYS A1983 -16.056 -18.394 1.712 1.00 2.75 H new ATOM 0 HG2 LYS A1983 -14.447 -19.575 3.089 1.00 2.91 H new ATOM 0 HG3 LYS A1983 -15.691 -20.003 4.247 1.00 2.91 H new ATOM 0 HD2 LYS A1983 -16.880 -21.292 2.454 1.00 3.23 H new ATOM 0 HD3 LYS A1983 -15.583 -20.904 1.340 1.00 3.23 H new ATOM 0 HE2 LYS A1983 -13.951 -22.051 2.810 1.00 3.77 H new ATOM 0 HE3 LYS A1983 -15.219 -22.400 3.969 1.00 3.77 H new ATOM 0 HZ1 LYS A1983 -14.768 -24.296 2.567 1.00 4.43 H new ATOM 0 HZ2 LYS A1983 -16.347 -23.733 2.293 1.00 4.43 H new ATOM 0 HZ3 LYS A1983 -15.118 -23.396 1.170 1.00 4.43 H new ATOM 1490 N MET A1984 -14.341 -15.816 3.317 1.00 2.32 N ATOM 1491 CA MET A1984 -13.014 -15.390 3.325 1.00 2.29 C ATOM 1492 C MET A1984 -12.995 -13.925 3.513 1.00 2.18 C ATOM 1493 O MET A1984 -14.013 -13.271 3.409 1.00 2.40 O ATOM 1494 CB MET A1984 -12.304 -15.764 2.020 1.00 2.28 C ATOM 1495 CG MET A1984 -12.968 -15.240 0.759 1.00 2.33 C ATOM 1496 SD MET A1984 -11.987 -15.590 -0.710 1.00 2.53 S ATOM 1497 CE MET A1984 -10.571 -14.534 -0.398 1.00 2.68 C ATOM 0 H MET A1984 -14.996 -15.145 2.916 1.00 2.32 H new ATOM 0 HA MET A1984 -12.483 -15.883 4.140 1.00 2.29 H new ATOM 0 HB2 MET A1984 -11.282 -15.387 2.058 1.00 2.28 H new ATOM 0 HB3 MET A1984 -12.241 -16.850 1.956 1.00 2.28 H new ATOM 0 HG2 MET A1984 -13.954 -15.692 0.653 1.00 2.33 H new ATOM 0 HG3 MET A1984 -13.118 -14.164 0.848 1.00 2.33 H new ATOM 0 HE1 MET A1984 -10.064 -14.318 -1.338 1.00 2.68 H new ATOM 0 HE2 MET A1984 -10.906 -13.601 0.056 1.00 2.68 H new ATOM 0 HE3 MET A1984 -9.882 -15.040 0.278 1.00 2.68 H new ATOM 1507 N LYS A1985 -11.884 -13.459 3.852 1.00 2.14 N ATOM 1508 CA LYS A1985 -11.610 -12.056 3.998 1.00 2.09 C ATOM 1509 C LYS A1985 -10.355 -11.728 3.223 1.00 1.89 C ATOM 1510 O LYS A1985 -9.231 -12.015 3.675 1.00 2.34 O ATOM 1511 CB LYS A1985 -11.513 -11.648 5.478 1.00 2.67 C ATOM 1512 CG LYS A1985 -12.850 -11.693 6.204 1.00 3.08 C ATOM 1513 CD LYS A1985 -13.805 -10.654 5.625 1.00 3.73 C ATOM 1514 CE LYS A1985 -15.216 -10.794 6.170 1.00 4.42 C ATOM 1515 NZ LYS A1985 -15.872 -12.039 5.714 1.00 4.89 N ATOM 0 H LYS A1985 -11.077 -14.050 4.053 1.00 2.14 H new ATOM 0 HA LYS A1985 -12.437 -11.475 3.589 1.00 2.09 H new ATOM 0 HB2 LYS A1985 -10.810 -12.309 5.985 1.00 2.67 H new ATOM 0 HB3 LYS A1985 -11.106 -10.639 5.544 1.00 2.67 H new ATOM 0 HG2 LYS A1985 -13.287 -12.688 6.114 1.00 3.08 H new ATOM 0 HG3 LYS A1985 -12.700 -11.506 7.267 1.00 3.08 H new ATOM 0 HD2 LYS A1985 -13.430 -9.655 5.849 1.00 3.73 H new ATOM 0 HD3 LYS A1985 -13.827 -10.750 4.539 1.00 3.73 H new ATOM 0 HE2 LYS A1985 -15.186 -10.780 7.259 1.00 4.42 H new ATOM 0 HE3 LYS A1985 -15.811 -9.936 5.857 1.00 4.42 H new ATOM 0 HZ1 LYS A1985 -16.854 -12.059 6.055 1.00 4.89 H new ATOM 0 HZ2 LYS A1985 -15.865 -12.074 4.675 1.00 4.89 H new ATOM 0 HZ3 LYS A1985 -15.358 -12.861 6.092 1.00 4.89 H new ATOM 1529 N HIS A1986 -10.562 -11.194 2.035 1.00 1.63 N ATOM 1530 CA HIS A1986 -9.498 -10.867 1.068 1.00 1.68 C ATOM 1531 C HIS A1986 -8.358 -10.046 1.676 1.00 1.14 C ATOM 1532 O HIS A1986 -8.548 -9.301 2.638 1.00 1.35 O ATOM 1533 CB HIS A1986 -10.075 -10.100 -0.161 1.00 2.46 C ATOM 1534 CG HIS A1986 -10.661 -8.734 0.158 1.00 3.48 C ATOM 1535 ND1 HIS A1986 -12.002 -8.489 0.210 1.00 4.38 N ATOM 1536 CD2 HIS A1986 -10.057 -7.553 0.463 1.00 4.21 C ATOM 1537 CE1 HIS A1986 -12.205 -7.234 0.538 1.00 5.37 C ATOM 1538 NE2 HIS A1986 -11.033 -6.641 0.703 1.00 5.32 N ATOM 0 H HIS A1986 -11.495 -10.964 1.694 1.00 1.63 H new ATOM 0 HA HIS A1986 -9.086 -11.826 0.753 1.00 1.68 H new ATOM 0 HB2 HIS A1986 -9.283 -9.976 -0.899 1.00 2.46 H new ATOM 0 HB3 HIS A1986 -10.849 -10.713 -0.623 1.00 2.46 H new ATOM 0 HD1 HIS A1986 -12.734 -9.175 0.023 1.00 4.38 H new ATOM 0 HD2 HIS A1986 -8.993 -7.374 0.506 1.00 4.21 H new ATOM 0 HE1 HIS A1986 -13.170 -6.763 0.654 1.00 5.37 H new ATOM 1547 N LYS A1987 -7.197 -10.180 1.099 1.00 1.12 N ATOM 1548 CA LYS A1987 -6.068 -9.395 1.458 1.00 1.18 C ATOM 1549 C LYS A1987 -5.668 -8.691 0.188 1.00 1.02 C ATOM 1550 O LYS A1987 -5.585 -9.333 -0.858 1.00 1.30 O ATOM 1551 CB LYS A1987 -4.923 -10.299 1.941 1.00 1.91 C ATOM 1552 CG LYS A1987 -5.324 -11.259 3.052 1.00 2.70 C ATOM 1553 CD LYS A1987 -4.196 -12.204 3.418 1.00 3.34 C ATOM 1554 CE LYS A1987 -4.697 -13.300 4.342 1.00 3.96 C ATOM 1555 NZ LYS A1987 -3.644 -14.280 4.681 1.00 4.45 N ATOM 0 H LYS A1987 -7.014 -10.852 0.354 1.00 1.12 H new ATOM 0 HA LYS A1987 -6.292 -8.699 2.266 1.00 1.18 H new ATOM 0 HB2 LYS A1987 -4.545 -10.874 1.096 1.00 1.91 H new ATOM 0 HB3 LYS A1987 -4.103 -9.673 2.293 1.00 1.91 H new ATOM 0 HG2 LYS A1987 -5.621 -10.690 3.933 1.00 2.70 H new ATOM 0 HG3 LYS A1987 -6.193 -11.836 2.737 1.00 2.70 H new ATOM 0 HD2 LYS A1987 -3.777 -12.646 2.514 1.00 3.34 H new ATOM 0 HD3 LYS A1987 -3.393 -11.650 3.904 1.00 3.34 H new ATOM 0 HE2 LYS A1987 -5.080 -12.851 5.259 1.00 3.96 H new ATOM 0 HE3 LYS A1987 -5.531 -13.817 3.868 1.00 3.96 H new ATOM 0 HZ1 LYS A1987 -4.036 -15.007 5.313 1.00 4.45 H new ATOM 0 HZ2 LYS A1987 -3.295 -14.730 3.811 1.00 4.45 H new ATOM 0 HZ3 LYS A1987 -2.858 -13.794 5.158 1.00 4.45 H new ATOM 1569 N SER A1988 -5.494 -7.420 0.247 1.00 0.68 N ATOM 1570 CA SER A1988 -5.114 -6.657 -0.899 1.00 0.60 C ATOM 1571 C SER A1988 -3.606 -6.549 -0.933 1.00 0.50 C ATOM 1572 O SER A1988 -2.971 -6.282 0.089 1.00 0.57 O ATOM 1573 CB SER A1988 -5.802 -5.298 -0.856 1.00 0.64 C ATOM 1574 OG SER A1988 -7.217 -5.482 -0.847 1.00 1.41 O ATOM 0 H SER A1988 -5.611 -6.870 1.098 1.00 0.68 H new ATOM 0 HA SER A1988 -5.433 -7.146 -1.820 1.00 0.60 H new ATOM 0 HB2 SER A1988 -5.490 -4.748 0.032 1.00 0.64 H new ATOM 0 HB3 SER A1988 -5.507 -4.702 -1.720 1.00 0.64 H new ATOM 0 HG SER A1988 -7.633 -4.793 -0.287 1.00 1.41 H new ATOM 1580 N TYR A1989 -3.044 -6.784 -2.085 1.00 0.51 N ATOM 1581 CA TYR A1989 -1.628 -6.923 -2.220 1.00 0.49 C ATOM 1582 C TYR A1989 -1.009 -5.650 -2.759 1.00 0.41 C ATOM 1583 O TYR A1989 -1.360 -5.175 -3.857 1.00 0.42 O ATOM 1584 CB TYR A1989 -1.327 -8.096 -3.157 1.00 0.63 C ATOM 1585 CG TYR A1989 -2.057 -9.381 -2.789 1.00 0.75 C ATOM 1586 CD1 TYR A1989 -1.590 -10.214 -1.782 1.00 1.18 C ATOM 1587 CD2 TYR A1989 -3.232 -9.742 -3.443 1.00 1.69 C ATOM 1588 CE1 TYR A1989 -2.273 -11.371 -1.438 1.00 1.40 C ATOM 1589 CE2 TYR A1989 -3.920 -10.889 -3.103 1.00 2.13 C ATOM 1590 CZ TYR A1989 -3.438 -11.700 -2.101 1.00 1.66 C ATOM 1591 OH TYR A1989 -4.130 -12.844 -1.751 1.00 2.20 O ATOM 0 H TYR A1989 -3.561 -6.884 -2.959 1.00 0.51 H new ATOM 0 HA TYR A1989 -1.195 -7.116 -1.239 1.00 0.49 H new ATOM 0 HB2 TYR A1989 -1.598 -7.814 -4.175 1.00 0.63 H new ATOM 0 HB3 TYR A1989 -0.254 -8.285 -3.153 1.00 0.63 H new ATOM 0 HD1 TYR A1989 -0.681 -9.957 -1.258 1.00 1.18 H new ATOM 0 HD2 TYR A1989 -3.613 -9.111 -4.233 1.00 1.69 H new ATOM 0 HE1 TYR A1989 -1.895 -12.012 -0.655 1.00 1.40 H new ATOM 0 HE2 TYR A1989 -4.832 -11.149 -3.620 1.00 2.13 H new ATOM 0 HH TYR A1989 -4.928 -12.929 -2.314 1.00 2.20 H new ATOM 1601 N PHE A1990 -0.120 -5.089 -1.997 1.00 0.40 N ATOM 1602 CA PHE A1990 0.577 -3.915 -2.412 1.00 0.40 C ATOM 1603 C PHE A1990 2.004 -4.329 -2.726 1.00 0.40 C ATOM 1604 O PHE A1990 2.670 -4.952 -1.897 1.00 0.51 O ATOM 1605 CB PHE A1990 0.576 -2.882 -1.293 1.00 0.49 C ATOM 1606 CG PHE A1990 0.652 -1.447 -1.750 1.00 0.84 C ATOM 1607 CD1 PHE A1990 1.588 -1.074 -2.700 1.00 1.31 C ATOM 1608 CD2 PHE A1990 -0.198 -0.480 -1.246 1.00 1.45 C ATOM 1609 CE1 PHE A1990 1.674 0.228 -3.134 1.00 2.02 C ATOM 1610 CE2 PHE A1990 -0.112 0.823 -1.676 1.00 2.10 C ATOM 1611 CZ PHE A1990 0.761 1.201 -2.558 1.00 2.31 C ATOM 0 H PHE A1990 0.141 -5.433 -1.073 1.00 0.40 H new ATOM 0 HA PHE A1990 0.097 -3.471 -3.284 1.00 0.40 H new ATOM 0 HB2 PHE A1990 -0.330 -3.011 -0.700 1.00 0.49 H new ATOM 0 HB3 PHE A1990 1.420 -3.083 -0.633 1.00 0.49 H new ATOM 0 HD1 PHE A1990 2.260 -1.816 -3.106 1.00 1.31 H new ATOM 0 HD2 PHE A1990 -0.937 -0.751 -0.507 1.00 1.45 H new ATOM 0 HE1 PHE A1990 2.398 0.519 -3.880 1.00 2.02 H new ATOM 0 HE2 PHE A1990 -0.793 1.555 -1.267 1.00 2.10 H new ATOM 0 HZ PHE A1990 0.809 2.236 -2.863 1.00 2.31 H new ATOM 1621 N SER A1991 2.432 -4.042 -3.906 1.00 0.35 N ATOM 1622 CA SER A1991 3.752 -4.354 -4.334 1.00 0.36 C ATOM 1623 C SER A1991 4.577 -3.069 -4.309 1.00 0.40 C ATOM 1624 O SER A1991 4.114 -2.022 -4.744 1.00 0.55 O ATOM 1625 CB SER A1991 3.682 -4.939 -5.758 1.00 0.36 C ATOM 1626 OG SER A1991 4.920 -5.492 -6.183 1.00 1.09 O ATOM 0 H SER A1991 1.865 -3.575 -4.614 1.00 0.35 H new ATOM 0 HA SER A1991 4.220 -5.089 -3.679 1.00 0.36 H new ATOM 0 HB2 SER A1991 2.913 -5.710 -5.792 1.00 0.36 H new ATOM 0 HB3 SER A1991 3.380 -4.156 -6.454 1.00 0.36 H new ATOM 0 HG SER A1991 5.426 -5.799 -5.402 1.00 1.09 H new ATOM 1632 N PHE A1992 5.743 -3.137 -3.766 1.00 0.36 N ATOM 1633 CA PHE A1992 6.632 -2.020 -3.716 1.00 0.37 C ATOM 1634 C PHE A1992 7.834 -2.325 -4.563 1.00 0.39 C ATOM 1635 O PHE A1992 8.676 -3.184 -4.226 1.00 0.40 O ATOM 1636 CB PHE A1992 7.022 -1.663 -2.277 1.00 0.40 C ATOM 1637 CG PHE A1992 5.854 -1.248 -1.435 1.00 0.48 C ATOM 1638 CD1 PHE A1992 5.425 0.072 -1.409 1.00 0.56 C ATOM 1639 CD2 PHE A1992 5.188 -2.181 -0.663 1.00 0.58 C ATOM 1640 CE1 PHE A1992 4.353 0.447 -0.627 1.00 0.68 C ATOM 1641 CE2 PHE A1992 4.119 -1.815 0.120 1.00 0.71 C ATOM 1642 CZ PHE A1992 3.688 -0.461 0.107 1.00 0.74 C ATOM 0 H PHE A1992 6.115 -3.983 -3.336 1.00 0.36 H new ATOM 0 HA PHE A1992 6.126 -1.140 -4.113 1.00 0.37 H new ATOM 0 HB2 PHE A1992 7.508 -2.523 -1.815 1.00 0.40 H new ATOM 0 HB3 PHE A1992 7.754 -0.855 -2.295 1.00 0.40 H new ATOM 0 HD1 PHE A1992 5.936 0.812 -2.007 1.00 0.56 H new ATOM 0 HD2 PHE A1992 5.512 -3.211 -0.675 1.00 0.58 H new ATOM 0 HE1 PHE A1992 4.045 1.482 -0.604 1.00 0.68 H new ATOM 0 HE2 PHE A1992 3.615 -2.545 0.735 1.00 0.71 H new ATOM 0 HZ PHE A1992 2.827 -0.162 0.686 1.00 0.74 H new ATOM 1652 N VAL A1993 7.885 -1.654 -5.668 1.00 0.44 N ATOM 1653 CA VAL A1993 8.894 -1.825 -6.666 1.00 0.51 C ATOM 1654 C VAL A1993 9.653 -0.505 -6.814 1.00 0.53 C ATOM 1655 O VAL A1993 9.120 0.557 -6.527 1.00 0.58 O ATOM 1656 CB VAL A1993 8.251 -2.319 -8.016 1.00 0.59 C ATOM 1657 CG1 VAL A1993 7.082 -1.451 -8.429 1.00 0.76 C ATOM 1658 CG2 VAL A1993 9.264 -2.395 -9.142 1.00 0.91 C ATOM 0 H VAL A1993 7.196 -0.942 -5.911 1.00 0.44 H new ATOM 0 HA VAL A1993 9.606 -2.596 -6.371 1.00 0.51 H new ATOM 0 HB VAL A1993 7.885 -3.328 -7.825 1.00 0.59 H new ATOM 0 HG11 VAL A1993 6.665 -1.823 -9.365 1.00 0.76 H new ATOM 0 HG12 VAL A1993 6.316 -1.479 -7.654 1.00 0.76 H new ATOM 0 HG13 VAL A1993 7.422 -0.424 -8.566 1.00 0.76 H new ATOM 0 HG21 VAL A1993 8.772 -2.741 -10.051 1.00 0.91 H new ATOM 0 HG22 VAL A1993 9.692 -1.407 -9.314 1.00 0.91 H new ATOM 0 HG23 VAL A1993 10.057 -3.092 -8.871 1.00 0.91 H new ATOM 1668 N CYS A1994 10.877 -0.574 -7.199 1.00 0.59 N ATOM 1669 CA CYS A1994 11.707 0.587 -7.256 1.00 0.67 C ATOM 1670 C CYS A1994 11.576 1.360 -8.541 1.00 0.65 C ATOM 1671 O CYS A1994 11.250 0.808 -9.579 1.00 0.84 O ATOM 1672 CB CYS A1994 13.127 0.197 -7.005 1.00 0.88 C ATOM 1673 SG CYS A1994 13.648 -1.244 -7.947 1.00 1.47 S ATOM 0 H CYS A1994 11.338 -1.438 -7.485 1.00 0.59 H new ATOM 0 HA CYS A1994 11.365 1.265 -6.474 1.00 0.67 H new ATOM 0 HB2 CYS A1994 13.776 1.037 -7.252 1.00 0.88 H new ATOM 0 HB3 CYS A1994 13.258 -0.006 -5.942 1.00 0.88 H new ATOM 1678 N LYS A1995 11.760 2.653 -8.429 1.00 0.77 N ATOM 1679 CA LYS A1995 11.805 3.541 -9.551 1.00 0.93 C ATOM 1680 C LYS A1995 12.911 4.547 -9.268 1.00 1.05 C ATOM 1681 O LYS A1995 12.901 5.191 -8.219 1.00 1.39 O ATOM 1682 CB LYS A1995 10.457 4.261 -9.740 1.00 1.37 C ATOM 1683 CG LYS A1995 10.381 5.127 -10.990 1.00 1.79 C ATOM 1684 CD LYS A1995 9.092 5.929 -11.063 1.00 2.03 C ATOM 1685 CE LYS A1995 9.058 6.785 -12.324 1.00 2.56 C ATOM 1686 NZ LYS A1995 7.899 7.693 -12.350 1.00 3.14 N ATOM 0 H LYS A1995 11.885 3.122 -7.532 1.00 0.77 H new ATOM 0 HA LYS A1995 12.000 2.989 -10.470 1.00 0.93 H new ATOM 0 HB2 LYS A1995 9.662 3.516 -9.779 1.00 1.37 H new ATOM 0 HB3 LYS A1995 10.266 4.885 -8.867 1.00 1.37 H new ATOM 0 HG2 LYS A1995 11.231 5.809 -11.008 1.00 1.79 H new ATOM 0 HG3 LYS A1995 10.462 4.493 -11.873 1.00 1.79 H new ATOM 0 HD2 LYS A1995 8.237 5.253 -11.054 1.00 2.03 H new ATOM 0 HD3 LYS A1995 9.004 6.566 -10.183 1.00 2.03 H new ATOM 0 HE2 LYS A1995 9.976 7.369 -12.389 1.00 2.56 H new ATOM 0 HE3 LYS A1995 9.029 6.137 -13.200 1.00 2.56 H new ATOM 0 HZ1 LYS A1995 7.750 8.038 -13.320 1.00 3.14 H new ATOM 0 HZ2 LYS A1995 7.051 7.183 -12.030 1.00 3.14 H new ATOM 0 HZ3 LYS A1995 8.076 8.500 -11.719 1.00 3.14 H new ATOM 1700 N SER A1996 13.834 4.696 -10.181 1.00 1.31 N ATOM 1701 CA SER A1996 14.974 5.591 -9.999 1.00 1.68 C ATOM 1702 C SER A1996 14.565 7.025 -10.361 1.00 1.67 C ATOM 1703 O SER A1996 15.318 7.980 -10.196 1.00 2.05 O ATOM 1704 CB SER A1996 16.106 5.121 -10.900 1.00 2.15 C ATOM 1705 OG SER A1996 16.279 3.709 -10.778 1.00 2.57 O ATOM 0 H SER A1996 13.828 4.206 -11.076 1.00 1.31 H new ATOM 0 HA SER A1996 15.304 5.577 -8.960 1.00 1.68 H new ATOM 0 HB2 SER A1996 15.887 5.380 -11.936 1.00 2.15 H new ATOM 0 HB3 SER A1996 17.030 5.633 -10.632 1.00 2.15 H new ATOM 0 HG SER A1996 17.009 3.417 -11.363 1.00 2.57 H new ATOM 1711 N ASP A1997 13.374 7.131 -10.882 1.00 1.56 N ATOM 1712 CA ASP A1997 12.765 8.398 -11.258 1.00 1.73 C ATOM 1713 C ASP A1997 11.610 8.731 -10.288 1.00 1.59 C ATOM 1714 O ASP A1997 10.807 9.628 -10.515 1.00 2.04 O ATOM 1715 CB ASP A1997 12.275 8.272 -12.718 1.00 1.99 C ATOM 1716 CG ASP A1997 11.570 9.494 -13.278 1.00 2.32 C ATOM 1717 OD1 ASP A1997 12.208 10.557 -13.426 1.00 2.65 O ATOM 1718 OD2 ASP A1997 10.375 9.387 -13.641 1.00 2.80 O ATOM 0 H ASP A1997 12.777 6.325 -11.066 1.00 1.56 H new ATOM 0 HA ASP A1997 13.483 9.216 -11.193 1.00 1.73 H new ATOM 0 HB2 ASP A1997 13.132 8.046 -13.352 1.00 1.99 H new ATOM 0 HB3 ASP A1997 11.597 7.421 -12.783 1.00 1.99 H new ATOM 1723 N ALA A1998 11.555 8.010 -9.172 1.00 1.32 N ATOM 1724 CA ALA A1998 10.486 8.190 -8.184 1.00 1.24 C ATOM 1725 C ALA A1998 10.540 9.568 -7.534 1.00 1.57 C ATOM 1726 O ALA A1998 9.497 10.205 -7.322 1.00 1.87 O ATOM 1727 CB ALA A1998 10.539 7.108 -7.130 1.00 1.44 C ATOM 0 H ALA A1998 12.238 7.293 -8.925 1.00 1.32 H new ATOM 0 HA ALA A1998 9.539 8.113 -8.717 1.00 1.24 H new ATOM 0 HB1 ALA A1998 9.737 7.263 -6.409 1.00 1.44 H new ATOM 0 HB2 ALA A1998 10.419 6.133 -7.603 1.00 1.44 H new ATOM 0 HB3 ALA A1998 11.500 7.146 -6.617 1.00 1.44 H new ATOM 1733 N GLY A1999 11.751 10.028 -7.251 1.00 2.05 N ATOM 1734 CA GLY A1999 11.953 11.326 -6.648 1.00 2.88 C ATOM 1735 C GLY A1999 11.392 11.414 -5.246 1.00 2.81 C ATOM 1736 O GLY A1999 11.423 10.436 -4.485 1.00 3.07 O ATOM 0 H GLY A1999 12.611 9.512 -7.434 1.00 2.05 H new ATOM 0 HA2 GLY A1999 13.020 11.548 -6.622 1.00 2.88 H new ATOM 0 HA3 GLY A1999 11.484 12.088 -7.271 1.00 2.88 H new ATOM 1740 N ASP A2000 10.851 12.560 -4.914 1.00 2.90 N ATOM 1741 CA ASP A2000 10.278 12.784 -3.594 1.00 3.13 C ATOM 1742 C ASP A2000 8.799 12.501 -3.640 1.00 2.60 C ATOM 1743 O ASP A2000 8.193 12.141 -2.630 1.00 2.99 O ATOM 1744 CB ASP A2000 10.518 14.226 -3.116 1.00 3.84 C ATOM 1745 CG ASP A2000 9.930 14.493 -1.733 1.00 3.99 C ATOM 1746 OD1 ASP A2000 10.585 14.173 -0.706 1.00 4.30 O ATOM 1747 OD2 ASP A2000 8.801 15.028 -1.647 1.00 4.11 O ATOM 0 H ASP A2000 10.792 13.363 -5.540 1.00 2.90 H new ATOM 0 HA ASP A2000 10.765 12.112 -2.888 1.00 3.13 H new ATOM 0 HB2 ASP A2000 11.590 14.424 -3.095 1.00 3.84 H new ATOM 0 HB3 ASP A2000 10.079 14.920 -3.833 1.00 3.84 H new ATOM 1752 N ASP A2001 8.238 12.639 -4.831 1.00 2.08 N ATOM 1753 CA ASP A2001 6.810 12.433 -5.060 1.00 1.96 C ATOM 1754 C ASP A2001 6.446 11.017 -4.695 1.00 1.77 C ATOM 1755 O ASP A2001 5.670 10.794 -3.759 1.00 2.29 O ATOM 1756 CB ASP A2001 6.477 12.659 -6.523 1.00 2.29 C ATOM 1757 CG ASP A2001 4.989 12.770 -6.780 1.00 2.96 C ATOM 1758 OD1 ASP A2001 4.383 13.796 -6.424 1.00 3.70 O ATOM 1759 OD2 ASP A2001 4.394 11.805 -7.316 1.00 3.24 O ATOM 0 H ASP A2001 8.758 12.897 -5.670 1.00 2.08 H new ATOM 0 HA ASP A2001 6.249 13.138 -4.446 1.00 1.96 H new ATOM 0 HB2 ASP A2001 6.968 13.570 -6.865 1.00 2.29 H new ATOM 0 HB3 ASP A2001 6.882 11.837 -7.113 1.00 2.29 H new ATOM 1764 N SER A2002 7.085 10.073 -5.409 1.00 1.56 N ATOM 1765 CA SER A2002 6.915 8.643 -5.230 1.00 1.44 C ATOM 1766 C SER A2002 5.477 8.215 -5.653 1.00 1.26 C ATOM 1767 O SER A2002 4.476 8.600 -5.035 1.00 1.36 O ATOM 1768 CB SER A2002 7.261 8.252 -3.778 1.00 1.64 C ATOM 1769 OG SER A2002 7.994 7.034 -3.730 1.00 1.88 O ATOM 0 H SER A2002 7.751 10.304 -6.146 1.00 1.56 H new ATOM 0 HA SER A2002 7.604 8.101 -5.878 1.00 1.44 H new ATOM 0 HB2 SER A2002 7.844 9.048 -3.314 1.00 1.64 H new ATOM 0 HB3 SER A2002 6.344 8.150 -3.199 1.00 1.64 H new ATOM 0 HG SER A2002 8.200 6.813 -2.798 1.00 1.88 H new ATOM 1775 N GLN A2003 5.373 7.419 -6.703 1.00 1.23 N ATOM 1776 CA GLN A2003 4.064 7.122 -7.249 1.00 1.09 C ATOM 1777 C GLN A2003 3.533 5.728 -6.935 1.00 0.88 C ATOM 1778 O GLN A2003 4.170 4.699 -7.247 1.00 1.00 O ATOM 1779 CB GLN A2003 3.984 7.377 -8.756 1.00 1.33 C ATOM 1780 CG GLN A2003 4.924 6.549 -9.610 1.00 1.53 C ATOM 1781 CD GLN A2003 4.567 6.612 -11.083 1.00 1.86 C ATOM 1782 OE1 GLN A2003 5.443 6.512 -11.946 1.00 2.51 O ATOM 1783 NE2 GLN A2003 3.291 6.744 -11.384 1.00 1.74 N ATOM 0 H GLN A2003 6.157 6.978 -7.183 1.00 1.23 H new ATOM 0 HA GLN A2003 3.413 7.825 -6.729 1.00 1.09 H new ATOM 0 HB2 GLN A2003 2.962 7.189 -9.085 1.00 1.33 H new ATOM 0 HB3 GLN A2003 4.189 8.432 -8.940 1.00 1.33 H new ATOM 0 HG2 GLN A2003 5.945 6.903 -9.470 1.00 1.53 H new ATOM 0 HG3 GLN A2003 4.897 5.512 -9.276 1.00 1.53 H new ATOM 0 HE21 GLN A2003 2.597 6.824 -10.641 1.00 1.74 H new ATOM 0 HE22 GLN A2003 2.997 6.766 -12.360 1.00 1.74 H new ATOM 1792 N PRO A2004 2.357 5.673 -6.320 1.00 0.72 N ATOM 1793 CA PRO A2004 1.631 4.452 -6.122 1.00 0.61 C ATOM 1794 C PRO A2004 0.804 4.167 -7.361 1.00 0.60 C ATOM 1795 O PRO A2004 -0.134 4.900 -7.682 1.00 0.74 O ATOM 1796 CB PRO A2004 0.703 4.748 -4.934 1.00 0.66 C ATOM 1797 CG PRO A2004 0.925 6.187 -4.586 1.00 0.77 C ATOM 1798 CD PRO A2004 1.642 6.807 -5.745 1.00 0.83 C ATOM 0 HA PRO A2004 2.276 3.593 -5.940 1.00 0.61 H new ATOM 0 HB2 PRO A2004 -0.339 4.567 -5.198 1.00 0.66 H new ATOM 0 HB3 PRO A2004 0.934 4.102 -4.087 1.00 0.66 H new ATOM 0 HG2 PRO A2004 -0.024 6.691 -4.404 1.00 0.77 H new ATOM 0 HG3 PRO A2004 1.514 6.278 -3.674 1.00 0.77 H new ATOM 0 HD2 PRO A2004 0.949 7.253 -6.458 1.00 0.83 H new ATOM 0 HD3 PRO A2004 2.323 7.596 -5.425 1.00 0.83 H new ATOM 1806 N VAL A2005 1.176 3.175 -8.086 1.00 0.57 N ATOM 1807 CA VAL A2005 0.471 2.826 -9.282 1.00 0.59 C ATOM 1808 C VAL A2005 -0.514 1.736 -8.953 1.00 0.59 C ATOM 1809 O VAL A2005 -0.131 0.634 -8.550 1.00 0.62 O ATOM 1810 CB VAL A2005 1.435 2.341 -10.407 1.00 0.66 C ATOM 1811 CG1 VAL A2005 0.669 1.997 -11.683 1.00 0.73 C ATOM 1812 CG2 VAL A2005 2.497 3.391 -10.696 1.00 0.69 C ATOM 0 H VAL A2005 1.976 2.578 -7.874 1.00 0.57 H new ATOM 0 HA VAL A2005 -0.041 3.713 -9.655 1.00 0.59 H new ATOM 0 HB VAL A2005 1.927 1.435 -10.053 1.00 0.66 H new ATOM 0 HG11 VAL A2005 1.369 1.662 -12.448 1.00 0.73 H new ATOM 0 HG12 VAL A2005 -0.048 1.203 -11.474 1.00 0.73 H new ATOM 0 HG13 VAL A2005 0.138 2.880 -12.038 1.00 0.73 H new ATOM 0 HG21 VAL A2005 3.159 3.032 -11.484 1.00 0.69 H new ATOM 0 HG22 VAL A2005 2.017 4.315 -11.018 1.00 0.69 H new ATOM 0 HG23 VAL A2005 3.077 3.580 -9.793 1.00 0.69 H new ATOM 1822 N PHE A2006 -1.762 2.053 -9.044 1.00 0.62 N ATOM 1823 CA PHE A2006 -2.782 1.077 -8.832 1.00 0.65 C ATOM 1824 C PHE A2006 -2.902 0.259 -10.113 1.00 0.63 C ATOM 1825 O PHE A2006 -2.817 0.810 -11.221 1.00 0.71 O ATOM 1826 CB PHE A2006 -4.133 1.755 -8.468 1.00 0.76 C ATOM 1827 CG PHE A2006 -4.731 2.588 -9.579 1.00 0.86 C ATOM 1828 CD1 PHE A2006 -4.248 3.856 -9.860 1.00 0.91 C ATOM 1829 CD2 PHE A2006 -5.759 2.078 -10.360 1.00 1.01 C ATOM 1830 CE1 PHE A2006 -4.778 4.596 -10.891 1.00 1.08 C ATOM 1831 CE2 PHE A2006 -6.288 2.815 -11.394 1.00 1.17 C ATOM 1832 CZ PHE A2006 -5.798 4.072 -11.660 1.00 1.21 C ATOM 0 H PHE A2006 -2.104 2.988 -9.266 1.00 0.62 H new ATOM 0 HA PHE A2006 -2.523 0.429 -7.994 1.00 0.65 H new ATOM 0 HB2 PHE A2006 -4.848 0.983 -8.183 1.00 0.76 H new ATOM 0 HB3 PHE A2006 -3.984 2.389 -7.594 1.00 0.76 H new ATOM 0 HD1 PHE A2006 -3.447 4.267 -9.263 1.00 0.91 H new ATOM 0 HD2 PHE A2006 -6.148 1.092 -10.154 1.00 1.01 H new ATOM 0 HE1 PHE A2006 -4.397 5.585 -11.099 1.00 1.08 H new ATOM 0 HE2 PHE A2006 -7.087 2.407 -11.996 1.00 1.17 H new ATOM 0 HZ PHE A2006 -6.212 4.651 -12.472 1.00 1.21 H new ATOM 1842 N LEU A2007 -3.031 -1.027 -9.987 1.00 0.62 N ATOM 1843 CA LEU A2007 -3.191 -1.860 -11.153 1.00 0.71 C ATOM 1844 C LEU A2007 -4.647 -1.905 -11.497 1.00 0.81 C ATOM 1845 O LEU A2007 -5.072 -1.386 -12.544 1.00 0.97 O ATOM 1846 CB LEU A2007 -2.619 -3.284 -10.949 1.00 0.81 C ATOM 1847 CG LEU A2007 -1.080 -3.447 -10.987 1.00 0.85 C ATOM 1848 CD1 LEU A2007 -0.394 -2.640 -9.904 1.00 1.29 C ATOM 1849 CD2 LEU A2007 -0.698 -4.913 -10.872 1.00 1.10 C ATOM 0 H LEU A2007 -3.029 -1.525 -9.097 1.00 0.62 H new ATOM 0 HA LEU A2007 -2.621 -1.429 -11.976 1.00 0.71 H new ATOM 0 HB2 LEU A2007 -2.973 -3.654 -9.987 1.00 0.81 H new ATOM 0 HB3 LEU A2007 -3.045 -3.931 -11.716 1.00 0.81 H new ATOM 0 HG LEU A2007 -0.738 -3.062 -11.948 1.00 0.85 H new ATOM 0 HD11 LEU A2007 0.684 -2.785 -9.970 1.00 1.29 H new ATOM 0 HD12 LEU A2007 -0.626 -1.583 -10.035 1.00 1.29 H new ATOM 0 HD13 LEU A2007 -0.746 -2.970 -8.926 1.00 1.29 H new ATOM 0 HD21 LEU A2007 0.387 -5.009 -10.900 1.00 1.10 H new ATOM 0 HD22 LEU A2007 -1.073 -5.314 -9.931 1.00 1.10 H new ATOM 0 HD23 LEU A2007 -1.134 -5.469 -11.702 1.00 1.10 H new ATOM 1861 N SER A2008 -5.418 -2.447 -10.585 1.00 0.80 N ATOM 1862 CA SER A2008 -6.827 -2.546 -10.729 1.00 0.99 C ATOM 1863 C SER A2008 -7.391 -3.108 -9.430 1.00 0.80 C ATOM 1864 O SER A2008 -6.643 -3.705 -8.612 1.00 0.64 O ATOM 1865 CB SER A2008 -7.179 -3.481 -11.922 1.00 1.31 C ATOM 1866 OG SER A2008 -8.556 -3.397 -12.287 1.00 1.75 O ATOM 0 H SER A2008 -5.064 -2.835 -9.710 1.00 0.80 H new ATOM 0 HA SER A2008 -7.258 -1.566 -10.933 1.00 0.99 H new ATOM 0 HB2 SER A2008 -6.561 -3.219 -12.781 1.00 1.31 H new ATOM 0 HB3 SER A2008 -6.937 -4.511 -11.658 1.00 1.31 H new ATOM 0 HG SER A2008 -8.732 -3.999 -13.040 1.00 1.75 H new ATOM 1872 N PHE A2009 -8.651 -2.856 -9.204 1.00 0.90 N ATOM 1873 CA PHE A2009 -9.366 -3.448 -8.119 1.00 0.77 C ATOM 1874 C PHE A2009 -9.904 -4.758 -8.667 1.00 0.80 C ATOM 1875 O PHE A2009 -10.410 -4.801 -9.799 1.00 0.93 O ATOM 1876 CB PHE A2009 -10.528 -2.529 -7.685 1.00 0.85 C ATOM 1877 CG PHE A2009 -11.232 -2.944 -6.410 1.00 0.77 C ATOM 1878 CD1 PHE A2009 -12.175 -3.956 -6.432 1.00 1.14 C ATOM 1879 CD2 PHE A2009 -10.943 -2.333 -5.195 1.00 0.72 C ATOM 1880 CE1 PHE A2009 -12.820 -4.350 -5.276 1.00 1.16 C ATOM 1881 CE2 PHE A2009 -11.586 -2.722 -4.037 1.00 0.81 C ATOM 1882 CZ PHE A2009 -12.524 -3.680 -4.059 1.00 0.87 C ATOM 0 H PHE A2009 -9.212 -2.226 -9.777 1.00 0.90 H new ATOM 0 HA PHE A2009 -8.734 -3.601 -7.244 1.00 0.77 H new ATOM 0 HB2 PHE A2009 -10.142 -1.518 -7.556 1.00 0.85 H new ATOM 0 HB3 PHE A2009 -11.261 -2.491 -8.491 1.00 0.85 H new ATOM 0 HD1 PHE A2009 -12.410 -4.445 -7.366 1.00 1.14 H new ATOM 0 HD2 PHE A2009 -10.206 -1.544 -5.157 1.00 0.72 H new ATOM 0 HE1 PHE A2009 -13.539 -5.156 -5.297 1.00 1.16 H new ATOM 0 HE2 PHE A2009 -11.330 -2.248 -3.101 1.00 0.81 H new ATOM 0 HZ PHE A2009 -13.053 -3.941 -3.154 1.00 0.87 H new ATOM 1892 N ASP A2010 -9.792 -5.795 -7.926 1.00 0.74 N ATOM 1893 CA ASP A2010 -10.212 -7.089 -8.393 1.00 0.83 C ATOM 1894 C ASP A2010 -11.554 -7.430 -7.816 1.00 0.88 C ATOM 1895 O ASP A2010 -11.697 -7.528 -6.624 1.00 0.97 O ATOM 1896 CB ASP A2010 -9.180 -8.147 -8.014 1.00 0.97 C ATOM 1897 CG ASP A2010 -9.610 -9.551 -8.364 1.00 1.63 C ATOM 1898 OD1 ASP A2010 -9.433 -9.974 -9.531 1.00 2.43 O ATOM 1899 OD2 ASP A2010 -10.133 -10.258 -7.479 1.00 2.01 O ATOM 0 H ASP A2010 -9.410 -5.786 -6.980 1.00 0.74 H new ATOM 0 HA ASP A2010 -10.296 -7.065 -9.480 1.00 0.83 H new ATOM 0 HB2 ASP A2010 -8.240 -7.925 -8.519 1.00 0.97 H new ATOM 0 HB3 ASP A2010 -8.987 -8.090 -6.943 1.00 0.97 H new ATOM 1904 N GLU A2011 -12.539 -7.600 -8.658 1.00 1.03 N ATOM 1905 CA GLU A2011 -13.871 -7.936 -8.182 1.00 1.24 C ATOM 1906 C GLU A2011 -14.044 -9.444 -8.155 1.00 1.30 C ATOM 1907 O GLU A2011 -15.047 -9.959 -7.674 1.00 1.46 O ATOM 1908 CB GLU A2011 -14.960 -7.294 -9.034 1.00 1.52 C ATOM 1909 CG GLU A2011 -14.970 -7.736 -10.477 1.00 1.76 C ATOM 1910 CD GLU A2011 -16.143 -7.169 -11.222 1.00 2.09 C ATOM 1911 OE1 GLU A2011 -16.156 -5.948 -11.497 1.00 2.23 O ATOM 1912 OE2 GLU A2011 -17.098 -7.924 -11.511 1.00 2.75 O ATOM 0 H GLU A2011 -12.454 -7.514 -9.671 1.00 1.03 H new ATOM 0 HA GLU A2011 -13.973 -7.539 -7.172 1.00 1.24 H new ATOM 0 HB2 GLU A2011 -15.930 -7.520 -8.591 1.00 1.52 H new ATOM 0 HB3 GLU A2011 -14.839 -6.211 -9.000 1.00 1.52 H new ATOM 0 HG2 GLU A2011 -14.045 -7.422 -10.961 1.00 1.76 H new ATOM 0 HG3 GLU A2011 -15.000 -8.825 -10.524 1.00 1.76 H new ATOM 1919 N GLN A2012 -13.041 -10.131 -8.667 1.00 1.32 N ATOM 1920 CA GLN A2012 -13.013 -11.577 -8.714 1.00 1.52 C ATOM 1921 C GLN A2012 -13.028 -12.153 -7.307 1.00 1.49 C ATOM 1922 O GLN A2012 -13.692 -13.148 -7.054 1.00 1.71 O ATOM 1923 CB GLN A2012 -11.804 -12.040 -9.522 1.00 1.75 C ATOM 1924 CG GLN A2012 -11.517 -13.523 -9.503 1.00 2.10 C ATOM 1925 CD GLN A2012 -10.326 -13.883 -10.374 1.00 2.62 C ATOM 1926 OE1 GLN A2012 -10.239 -14.994 -10.892 1.00 3.40 O ATOM 1927 NE2 GLN A2012 -9.421 -12.951 -10.562 1.00 2.81 N ATOM 0 H GLN A2012 -12.212 -9.692 -9.067 1.00 1.32 H new ATOM 0 HA GLN A2012 -13.907 -11.948 -9.216 1.00 1.52 H new ATOM 0 HB2 GLN A2012 -11.946 -11.732 -10.558 1.00 1.75 H new ATOM 0 HB3 GLN A2012 -10.923 -11.516 -9.151 1.00 1.75 H new ATOM 0 HG2 GLN A2012 -11.327 -13.842 -8.478 1.00 2.10 H new ATOM 0 HG3 GLN A2012 -12.396 -14.067 -9.848 1.00 2.10 H new ATOM 0 HE21 GLN A2012 -9.527 -12.040 -10.115 1.00 2.81 H new ATOM 0 HE22 GLN A2012 -8.612 -13.138 -11.155 1.00 2.81 H new ATOM 1936 N THR A2013 -12.283 -11.546 -6.407 1.00 1.37 N ATOM 1937 CA THR A2013 -12.358 -11.926 -5.020 1.00 1.47 C ATOM 1938 C THR A2013 -12.364 -10.672 -4.115 1.00 1.37 C ATOM 1939 O THR A2013 -12.121 -10.756 -2.914 1.00 1.57 O ATOM 1940 CB THR A2013 -11.230 -12.934 -4.622 1.00 1.72 C ATOM 1941 OG1 THR A2013 -11.461 -13.443 -3.302 1.00 1.95 O ATOM 1942 CG2 THR A2013 -9.855 -12.292 -4.672 1.00 1.76 C ATOM 0 H THR A2013 -11.625 -10.794 -6.612 1.00 1.37 H new ATOM 0 HA THR A2013 -13.300 -12.453 -4.869 1.00 1.47 H new ATOM 0 HB THR A2013 -11.257 -13.748 -5.346 1.00 1.72 H new ATOM 0 HG1 THR A2013 -11.776 -12.718 -2.722 1.00 1.95 H new ATOM 0 HG21 THR A2013 -9.100 -13.026 -4.389 1.00 1.76 H new ATOM 0 HG22 THR A2013 -9.655 -11.938 -5.683 1.00 1.76 H new ATOM 0 HG23 THR A2013 -9.821 -11.451 -3.980 1.00 1.76 H new ATOM 1950 N CYS A2014 -12.670 -9.524 -4.721 1.00 1.20 N ATOM 1951 CA CYS A2014 -12.789 -8.229 -4.016 1.00 1.22 C ATOM 1952 C CYS A2014 -11.471 -7.719 -3.412 1.00 1.19 C ATOM 1953 O CYS A2014 -11.471 -6.916 -2.491 1.00 1.49 O ATOM 1954 CB CYS A2014 -13.961 -8.217 -3.001 1.00 1.49 C ATOM 1955 SG CYS A2014 -15.619 -8.103 -3.801 1.00 1.65 S ATOM 0 H CYS A2014 -12.845 -9.457 -5.724 1.00 1.20 H new ATOM 0 HA CYS A2014 -13.036 -7.503 -4.790 1.00 1.22 H new ATOM 0 HB2 CYS A2014 -13.918 -9.123 -2.397 1.00 1.49 H new ATOM 0 HB3 CYS A2014 -13.835 -7.375 -2.321 1.00 1.49 H new ATOM 1960 N THR A2015 -10.356 -8.118 -3.996 1.00 1.02 N ATOM 1961 CA THR A2015 -9.061 -7.666 -3.535 1.00 1.04 C ATOM 1962 C THR A2015 -8.612 -6.437 -4.374 1.00 0.96 C ATOM 1963 O THR A2015 -9.375 -5.916 -5.190 1.00 1.08 O ATOM 1964 CB THR A2015 -7.992 -8.820 -3.582 1.00 1.15 C ATOM 1965 OG1 THR A2015 -6.733 -8.370 -3.065 1.00 1.56 O ATOM 1966 CG2 THR A2015 -7.786 -9.332 -4.996 1.00 1.39 C ATOM 0 H THR A2015 -10.324 -8.755 -4.792 1.00 1.02 H new ATOM 0 HA THR A2015 -9.147 -7.366 -2.491 1.00 1.04 H new ATOM 0 HB THR A2015 -8.375 -9.632 -2.963 1.00 1.15 H new ATOM 0 HG1 THR A2015 -6.503 -8.889 -2.266 1.00 1.56 H new ATOM 0 HG21 THR A2015 -7.041 -10.128 -4.990 1.00 1.39 H new ATOM 0 HG22 THR A2015 -8.728 -9.720 -5.383 1.00 1.39 H new ATOM 0 HG23 THR A2015 -7.440 -8.517 -5.631 1.00 1.39 H new ATOM 1974 N SER A2016 -7.420 -5.974 -4.153 1.00 0.87 N ATOM 1975 CA SER A2016 -6.870 -4.849 -4.857 1.00 0.83 C ATOM 1976 C SER A2016 -5.403 -5.122 -5.160 1.00 0.71 C ATOM 1977 O SER A2016 -4.718 -5.798 -4.373 1.00 0.74 O ATOM 1978 CB SER A2016 -6.997 -3.593 -3.995 1.00 0.87 C ATOM 1979 OG SER A2016 -8.338 -3.374 -3.613 1.00 1.36 O ATOM 0 H SER A2016 -6.785 -6.375 -3.463 1.00 0.87 H new ATOM 0 HA SER A2016 -7.413 -4.695 -5.790 1.00 0.83 H new ATOM 0 HB2 SER A2016 -6.374 -3.693 -3.106 1.00 0.87 H new ATOM 0 HB3 SER A2016 -6.627 -2.729 -4.548 1.00 0.87 H new ATOM 0 HG SER A2016 -8.852 -3.062 -4.387 1.00 1.36 H new ATOM 1985 N TYR A2017 -4.929 -4.651 -6.300 1.00 0.64 N ATOM 1986 CA TYR A2017 -3.533 -4.815 -6.661 1.00 0.57 C ATOM 1987 C TYR A2017 -2.891 -3.462 -6.838 1.00 0.49 C ATOM 1988 O TYR A2017 -3.328 -2.659 -7.680 1.00 0.56 O ATOM 1989 CB TYR A2017 -3.380 -5.646 -7.942 1.00 0.71 C ATOM 1990 CG TYR A2017 -3.951 -7.035 -7.830 1.00 0.86 C ATOM 1991 CD1 TYR A2017 -3.337 -7.994 -7.036 1.00 0.92 C ATOM 1992 CD2 TYR A2017 -5.117 -7.382 -8.497 1.00 1.01 C ATOM 1993 CE1 TYR A2017 -3.866 -9.259 -6.915 1.00 1.09 C ATOM 1994 CE2 TYR A2017 -5.654 -8.644 -8.374 1.00 1.18 C ATOM 1995 CZ TYR A2017 -5.025 -9.577 -7.582 1.00 1.20 C ATOM 1996 OH TYR A2017 -5.562 -10.828 -7.450 1.00 1.38 O ATOM 0 H TYR A2017 -5.490 -4.152 -6.991 1.00 0.64 H new ATOM 0 HA TYR A2017 -3.033 -5.352 -5.855 1.00 0.57 H new ATOM 0 HB2 TYR A2017 -3.871 -5.125 -8.764 1.00 0.71 H new ATOM 0 HB3 TYR A2017 -2.322 -5.716 -8.196 1.00 0.71 H new ATOM 0 HD1 TYR A2017 -2.430 -7.744 -6.505 1.00 0.92 H new ATOM 0 HD2 TYR A2017 -5.610 -6.652 -9.122 1.00 1.01 H new ATOM 0 HE1 TYR A2017 -3.373 -9.997 -6.300 1.00 1.09 H new ATOM 0 HE2 TYR A2017 -6.564 -8.900 -8.896 1.00 1.18 H new ATOM 0 HH TYR A2017 -6.381 -10.891 -7.985 1.00 1.38 H new ATOM 2006 N PHE A2018 -1.889 -3.183 -6.043 1.00 0.39 N ATOM 2007 CA PHE A2018 -1.191 -1.915 -6.121 1.00 0.39 C ATOM 2008 C PHE A2018 0.288 -2.153 -6.283 1.00 0.36 C ATOM 2009 O PHE A2018 0.796 -3.192 -5.884 1.00 0.40 O ATOM 2010 CB PHE A2018 -1.418 -1.078 -4.857 1.00 0.47 C ATOM 2011 CG PHE A2018 -2.849 -0.809 -4.533 1.00 0.57 C ATOM 2012 CD1 PHE A2018 -3.640 -0.089 -5.401 1.00 0.74 C ATOM 2013 CD2 PHE A2018 -3.406 -1.288 -3.362 1.00 0.74 C ATOM 2014 CE1 PHE A2018 -4.959 0.153 -5.111 1.00 0.89 C ATOM 2015 CE2 PHE A2018 -4.727 -1.048 -3.063 1.00 0.87 C ATOM 2016 CZ PHE A2018 -5.508 -0.325 -3.941 1.00 0.87 C ATOM 0 H PHE A2018 -1.533 -3.818 -5.329 1.00 0.39 H new ATOM 0 HA PHE A2018 -1.584 -1.372 -6.981 1.00 0.39 H new ATOM 0 HB2 PHE A2018 -0.959 -1.591 -4.012 1.00 0.47 H new ATOM 0 HB3 PHE A2018 -0.901 -0.125 -4.971 1.00 0.47 H new ATOM 0 HD1 PHE A2018 -3.217 0.289 -6.320 1.00 0.74 H new ATOM 0 HD2 PHE A2018 -2.797 -1.857 -2.675 1.00 0.74 H new ATOM 0 HE1 PHE A2018 -5.568 0.719 -5.801 1.00 0.89 H new ATOM 0 HE2 PHE A2018 -5.151 -1.424 -2.144 1.00 0.87 H new ATOM 0 HZ PHE A2018 -6.546 -0.134 -3.712 1.00 0.87 H new ATOM 2026 N SER A2019 0.963 -1.234 -6.898 1.00 0.45 N ATOM 2027 CA SER A2019 2.390 -1.283 -7.036 1.00 0.47 C ATOM 2028 C SER A2019 2.965 0.126 -6.937 1.00 0.45 C ATOM 2029 O SER A2019 2.722 0.968 -7.784 1.00 0.49 O ATOM 2030 CB SER A2019 2.785 -1.952 -8.352 1.00 0.51 C ATOM 2031 OG SER A2019 2.317 -3.291 -8.396 1.00 1.24 O ATOM 0 H SER A2019 0.534 -0.414 -7.326 1.00 0.45 H new ATOM 0 HA SER A2019 2.805 -1.884 -6.227 1.00 0.47 H new ATOM 0 HB2 SER A2019 2.372 -1.390 -9.189 1.00 0.51 H new ATOM 0 HB3 SER A2019 3.869 -1.937 -8.462 1.00 0.51 H new ATOM 0 HG SER A2019 2.579 -3.701 -9.247 1.00 1.24 H new ATOM 2037 N TRP A2020 3.729 0.370 -5.930 1.00 0.52 N ATOM 2038 CA TRP A2020 4.283 1.671 -5.709 1.00 0.57 C ATOM 2039 C TRP A2020 5.676 1.647 -6.252 1.00 0.49 C ATOM 2040 O TRP A2020 6.446 0.756 -5.936 1.00 0.43 O ATOM 2041 CB TRP A2020 4.314 1.991 -4.197 1.00 0.69 C ATOM 2042 CG TRP A2020 4.627 3.429 -3.837 1.00 0.88 C ATOM 2043 CD1 TRP A2020 5.671 4.185 -4.274 1.00 0.81 C ATOM 2044 CD2 TRP A2020 3.903 4.261 -2.920 1.00 1.75 C ATOM 2045 NE1 TRP A2020 5.626 5.429 -3.720 1.00 1.00 N ATOM 2046 CE2 TRP A2020 4.557 5.506 -2.883 1.00 1.65 C ATOM 2047 CE3 TRP A2020 2.764 4.081 -2.137 1.00 2.75 C ATOM 2048 CZ2 TRP A2020 4.113 6.562 -2.095 1.00 2.41 C ATOM 2049 CZ3 TRP A2020 2.324 5.129 -1.355 1.00 3.55 C ATOM 2050 CH2 TRP A2020 2.997 6.354 -1.340 1.00 3.35 C ATOM 0 H TRP A2020 3.991 -0.325 -5.231 1.00 0.52 H new ATOM 0 HA TRP A2020 3.681 2.436 -6.200 1.00 0.57 H new ATOM 0 HB2 TRP A2020 3.346 1.731 -3.769 1.00 0.69 H new ATOM 0 HB3 TRP A2020 5.055 1.347 -3.723 1.00 0.69 H new ATOM 0 HD1 TRP A2020 6.430 3.846 -4.964 1.00 0.81 H new ATOM 0 HE1 TRP A2020 6.289 6.182 -3.904 1.00 1.00 H new ATOM 0 HE3 TRP A2020 2.236 3.139 -2.142 1.00 2.75 H new ATOM 0 HZ2 TRP A2020 4.632 7.509 -2.082 1.00 2.41 H new ATOM 0 HZ3 TRP A2020 1.443 5.001 -0.743 1.00 3.55 H new ATOM 0 HH2 TRP A2020 2.625 7.153 -0.717 1.00 3.35 H new ATOM 2061 N HIS A2021 5.964 2.589 -7.101 1.00 0.61 N ATOM 2062 CA HIS A2021 7.261 2.734 -7.697 1.00 0.66 C ATOM 2063 C HIS A2021 8.022 3.767 -6.889 1.00 0.64 C ATOM 2064 O HIS A2021 7.888 4.973 -7.120 1.00 0.81 O ATOM 2065 CB HIS A2021 7.158 3.157 -9.190 1.00 0.86 C ATOM 2066 CG HIS A2021 6.547 2.126 -10.119 1.00 0.93 C ATOM 2067 ND1 HIS A2021 7.026 1.865 -11.390 1.00 1.53 N ATOM 2068 CD2 HIS A2021 5.474 1.311 -9.966 1.00 1.33 C ATOM 2069 CE1 HIS A2021 6.280 0.939 -11.961 1.00 1.61 C ATOM 2070 NE2 HIS A2021 5.338 0.593 -11.117 1.00 1.43 N ATOM 0 H HIS A2021 5.291 3.293 -7.405 1.00 0.61 H new ATOM 0 HA HIS A2021 7.786 1.779 -7.684 1.00 0.66 H new ATOM 0 HB2 HIS A2021 6.567 4.071 -9.251 1.00 0.86 H new ATOM 0 HB3 HIS A2021 8.158 3.399 -9.551 1.00 0.86 H new ATOM 0 HD2 HIS A2021 4.843 1.243 -9.092 1.00 1.33 H new ATOM 0 HE1 HIS A2021 6.421 0.535 -12.953 1.00 1.61 H new ATOM 0 HE2 HIS A2021 4.616 -0.105 -11.294 1.00 1.43 H new ATOM 2079 N THR A2022 8.751 3.293 -5.910 1.00 0.51 N ATOM 2080 CA THR A2022 9.467 4.139 -4.984 1.00 0.50 C ATOM 2081 C THR A2022 10.954 3.816 -5.026 1.00 0.48 C ATOM 2082 O THR A2022 11.340 2.693 -5.315 1.00 0.50 O ATOM 2083 CB THR A2022 8.905 3.994 -3.527 1.00 0.53 C ATOM 2084 OG1 THR A2022 9.646 4.802 -2.606 1.00 0.63 O ATOM 2085 CG2 THR A2022 8.902 2.543 -3.054 1.00 0.56 C ATOM 0 H THR A2022 8.866 2.296 -5.730 1.00 0.51 H new ATOM 0 HA THR A2022 9.324 5.176 -5.287 1.00 0.50 H new ATOM 0 HB THR A2022 7.872 4.341 -3.556 1.00 0.53 H new ATOM 0 HG1 THR A2022 9.275 4.695 -1.705 1.00 0.63 H new ATOM 0 HG21 THR A2022 8.505 2.492 -2.040 1.00 0.56 H new ATOM 0 HG22 THR A2022 8.279 1.945 -3.719 1.00 0.56 H new ATOM 0 HG23 THR A2022 9.920 2.155 -3.065 1.00 0.56 H new ATOM 2093 N SER A2023 11.776 4.783 -4.741 1.00 0.55 N ATOM 2094 CA SER A2023 13.208 4.613 -4.810 1.00 0.60 C ATOM 2095 C SER A2023 13.772 3.918 -3.559 1.00 0.59 C ATOM 2096 O SER A2023 14.908 3.431 -3.560 1.00 0.75 O ATOM 2097 CB SER A2023 13.845 5.966 -5.014 1.00 0.85 C ATOM 2098 OG SER A2023 13.349 6.895 -4.050 1.00 1.21 O ATOM 0 H SER A2023 11.478 5.715 -4.453 1.00 0.55 H new ATOM 0 HA SER A2023 13.443 3.961 -5.651 1.00 0.60 H new ATOM 0 HB2 SER A2023 14.928 5.883 -4.926 1.00 0.85 H new ATOM 0 HB3 SER A2023 13.634 6.327 -6.020 1.00 0.85 H new ATOM 0 HG SER A2023 13.770 7.769 -4.191 1.00 1.21 H new ATOM 2104 N LEU A2024 12.973 3.854 -2.507 1.00 0.61 N ATOM 2105 CA LEU A2024 13.407 3.221 -1.259 1.00 0.74 C ATOM 2106 C LEU A2024 13.262 1.706 -1.345 1.00 0.76 C ATOM 2107 O LEU A2024 13.908 0.964 -0.594 1.00 0.93 O ATOM 2108 CB LEU A2024 12.612 3.753 -0.029 1.00 0.91 C ATOM 2109 CG LEU A2024 12.802 5.238 0.386 1.00 0.78 C ATOM 2110 CD1 LEU A2024 14.267 5.573 0.593 1.00 1.53 C ATOM 2111 CD2 LEU A2024 12.142 6.207 -0.593 1.00 1.11 C ATOM 0 H LEU A2024 12.024 4.228 -2.485 1.00 0.61 H new ATOM 0 HA LEU A2024 14.457 3.478 -1.121 1.00 0.74 H new ATOM 0 HB2 LEU A2024 11.551 3.596 -0.226 1.00 0.91 H new ATOM 0 HB3 LEU A2024 12.872 3.132 0.829 1.00 0.91 H new ATOM 0 HG LEU A2024 12.293 5.363 1.342 1.00 0.78 H new ATOM 0 HD11 LEU A2024 14.364 6.619 0.882 1.00 1.53 H new ATOM 0 HD12 LEU A2024 14.677 4.940 1.379 1.00 1.53 H new ATOM 0 HD13 LEU A2024 14.814 5.401 -0.334 1.00 1.53 H new ATOM 0 HD21 LEU A2024 12.304 7.231 -0.257 1.00 1.11 H new ATOM 0 HD22 LEU A2024 12.578 6.077 -1.583 1.00 1.11 H new ATOM 0 HD23 LEU A2024 11.072 6.006 -0.639 1.00 1.11 H new ATOM 2123 N ALA A2025 12.431 1.272 -2.285 1.00 0.66 N ATOM 2124 CA ALA A2025 12.070 -0.125 -2.472 1.00 0.72 C ATOM 2125 C ALA A2025 13.252 -1.076 -2.686 1.00 0.85 C ATOM 2126 O ALA A2025 13.671 -1.738 -1.770 1.00 1.20 O ATOM 2127 CB ALA A2025 11.071 -0.258 -3.594 1.00 0.64 C ATOM 0 H ALA A2025 11.980 1.897 -2.953 1.00 0.66 H new ATOM 0 HA ALA A2025 11.624 -0.439 -1.528 1.00 0.72 H new ATOM 0 HB1 ALA A2025 10.808 -1.308 -3.725 1.00 0.64 H new ATOM 0 HB2 ALA A2025 10.175 0.313 -3.353 1.00 0.64 H new ATOM 0 HB3 ALA A2025 11.507 0.124 -4.517 1.00 0.64 H new ATOM 2133 N CYS A2026 13.805 -1.128 -3.875 1.00 0.90 N ATOM 2134 CA CYS A2026 14.827 -2.132 -4.141 1.00 1.05 C ATOM 2135 C CYS A2026 16.200 -1.493 -4.098 1.00 1.23 C ATOM 2136 O CYS A2026 16.327 -0.289 -3.839 1.00 1.55 O ATOM 2137 CB CYS A2026 14.614 -2.802 -5.514 1.00 1.61 C ATOM 2138 SG CYS A2026 15.271 -1.853 -6.933 1.00 2.15 S ATOM 0 H CYS A2026 13.579 -0.512 -4.656 1.00 0.90 H new ATOM 0 HA CYS A2026 14.751 -2.899 -3.371 1.00 1.05 H new ATOM 0 HB2 CYS A2026 15.085 -3.785 -5.501 1.00 1.61 H new ATOM 0 HB3 CYS A2026 13.546 -2.962 -5.664 1.00 1.61 H new