USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1097 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A2002 SER OG : rot 70:sc= 2.3 USER MOD Set 1.2: A2022 THR OG1 : rot 106:sc= 0.273 USER MOD Set 2.1: A1988 SER OG : rot 104:sc= 0.579 USER MOD Set 2.2: A2016 SER OG : rot -51:sc= 0.426 USER MOD Set 3.1: A1984 MET CE :methyl -167:sc= -3.52! (180deg=-4.31!) USER MOD Set 3.2: A2013 THR OG1 : rot 26:sc= 1.32 USER MOD Set 4.1: A1897 ASN : amide:sc= -0.867 K(o=-1.1,f=-3.6!) USER MOD Set 4.2: A1900 THR OG1 : rot 7:sc= -0.176 USER MOD Set 4.3: A1966 GLN : amide:sc= -0.0287 K(o=-1.1,f=-4.9!) USER MOD Set 5.1: A1924 LYS NZ :NH3+ 173:sc= -0.995! (180deg=-1.79!) USER MOD Set 5.2: A1936 SER OG : rot 67:sc= 1.23 USER MOD Set 5.3: A1946 THR OG1 : rot -120:sc= 0.778 USER MOD Set 6.1: A1888 ASN : amide:sc= 0.00464 K(o=-0.0058,f=-6.3!) USER MOD Set 6.2: A1890 GLN : amide:sc= -0.0105 K(o=-0.0058,f=-2.6!) USER MOD Single : A1885 MET CE :methyl -118:sc= -0.989 (180deg=-1.16) USER MOD Single : A1886 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1887 SER OG : rot 180:sc= 0 USER MOD Single : A1891 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1896 THR OG1 : rot 180:sc= 0 USER MOD Single : A1902 HIS : no HE2:sc= 0.428 K(o=0.43,f=-5.5!) USER MOD Single : A1907 THR OG1 : rot -130:sc= -0.171 USER MOD Single : A1908 SER OG : rot -160:sc= -0.225 USER MOD Single : A1910 LYS NZ :NH3+ 170:sc= 2.86 (180deg=2.55) USER MOD Single : A1913 SER OG : rot 180:sc= 0.301 USER MOD Single : A1915 TYR OH : rot 110:sc= 0.495 USER MOD Single : A1916 THR OG1 : rot 41:sc= 1.06 USER MOD Single : A1918 THR OG1 : rot 180:sc= 0 USER MOD Single : A1920 SER OG : rot -32:sc= 0.575 USER MOD Single : A1921 HIS : no HD1:sc= -0.0863 X(o=-0.086,f=0) USER MOD Single : A1922 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1928 ASN : amide:sc= -6.53! C(o=-6.5!,f=-6.2!) USER MOD Single : A1934 LYS NZ :NH3+ 180:sc= 2.22 (180deg=2.22) USER MOD Single : A1935 SER OG : rot 4:sc= 0.329 USER MOD Single : A1939 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1950 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0458) USER MOD Single : A1951 THR OG1 : rot 171:sc= 0.0153 USER MOD Single : A1953 ASN : amide:sc= -2.64! C(o=-2.6!,f=-4!) USER MOD Single : A1956 LYS NZ :NH3+ -177:sc= 0.844 (180deg=0.759) USER MOD Single : A1958 SER OG : rot 180:sc= 0 USER MOD Single : A1959 LYS NZ :NH3+ -175:sc= 1.27 (180deg=1.21) USER MOD Single : A1960 THR OG1 : rot 180:sc= 0 USER MOD Single : A1962 THR OG1 : rot -40:sc= -2.7! USER MOD Single : A1963 TYR OH : rot 180:sc= 0 USER MOD Single : A1969 LYS NZ :NH3+ -124:sc= -0.254 (180deg=-3.72!) USER MOD Single : A1972 TYR OH : rot 60:sc= 0.593 USER MOD Single : A1980 THR OG1 : rot 155:sc= 1.48 USER MOD Single : A1983 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1985 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0297) USER MOD Single : A1986 HIS : no HE2:sc= -1.41! C(o=-1.4!,f=-6.8!) USER MOD Single : A1987 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1989 TYR OH : rot 180:sc= 0 USER MOD Single : A1991 SER OG : rot -160:sc= -0.714 USER MOD Single : A1995 LYS NZ :NH3+ -159:sc= 1.1 (180deg=0.752) USER MOD Single : A1996 SER OG : rot -78:sc= 0.599 USER MOD Single : A2003 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2008 SER OG : rot 180:sc= 0 USER MOD Single : A2012 GLN : amide:sc= -0.206 K(o=-0.21,f=-2.3!) USER MOD Single : A2015 THR OG1 : rot -170:sc= -1.74! USER MOD Single : A2017 TYR OH : rot 180:sc= 0 USER MOD Single : A2019 SER OG : rot 180:sc= 0 USER MOD Single : A2021 HIS : no HD1:sc= -3.05! K(o=-3!,f=-0.11) USER MOD Single : A2023 SER OG : rot 100:sc= -0.0176 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A1885 13.848 11.684 2.570 1.00 5.18 N ATOM 2 CA MET A1885 13.787 10.256 2.857 1.00 4.46 C ATOM 3 C MET A1885 13.683 10.050 4.345 1.00 3.65 C ATOM 4 O MET A1885 14.161 10.874 5.113 1.00 3.88 O ATOM 5 CB MET A1885 15.016 9.510 2.314 1.00 4.63 C ATOM 6 CG MET A1885 15.157 9.537 0.799 1.00 4.63 C ATOM 7 SD MET A1885 16.596 8.605 0.211 1.00 5.35 S ATOM 8 CE MET A1885 16.182 6.939 0.741 1.00 5.61 C ATOM 0 HA MET A1885 12.907 9.849 2.358 1.00 4.46 H new ATOM 0 HB2 MET A1885 15.913 9.944 2.757 1.00 4.63 H new ATOM 0 HB3 MET A1885 14.969 8.472 2.643 1.00 4.63 H new ATOM 0 HG2 MET A1885 14.254 9.126 0.347 1.00 4.63 H new ATOM 0 HG3 MET A1885 15.238 10.571 0.465 1.00 4.63 H new ATOM 0 HE1 MET A1885 16.930 6.587 1.451 1.00 5.61 H new ATOM 0 HE2 MET A1885 15.202 6.942 1.218 1.00 5.61 H new ATOM 0 HE3 MET A1885 16.162 6.276 -0.124 1.00 5.61 H new ATOM 20 N LYS A1886 13.025 8.968 4.740 1.00 3.10 N ATOM 21 CA LYS A1886 12.823 8.586 6.140 1.00 2.49 C ATOM 22 C LYS A1886 12.013 9.604 6.921 1.00 1.74 C ATOM 23 O LYS A1886 12.559 10.414 7.654 1.00 2.11 O ATOM 24 CB LYS A1886 14.128 8.209 6.874 1.00 3.19 C ATOM 25 CG LYS A1886 14.805 6.964 6.329 1.00 3.90 C ATOM 26 CD LYS A1886 15.996 6.554 7.178 1.00 4.56 C ATOM 27 CE LYS A1886 16.595 5.254 6.672 1.00 5.38 C ATOM 28 NZ LYS A1886 17.746 4.816 7.481 1.00 5.95 N ATOM 0 H LYS A1886 12.604 8.312 4.082 1.00 3.10 H new ATOM 0 HA LYS A1886 12.227 7.674 6.094 1.00 2.49 H new ATOM 0 HB2 LYS A1886 14.823 9.046 6.810 1.00 3.19 H new ATOM 0 HB3 LYS A1886 13.908 8.057 7.931 1.00 3.19 H new ATOM 0 HG2 LYS A1886 14.086 6.146 6.292 1.00 3.90 H new ATOM 0 HG3 LYS A1886 15.133 7.147 5.306 1.00 3.90 H new ATOM 0 HD2 LYS A1886 16.751 7.340 7.158 1.00 4.56 H new ATOM 0 HD3 LYS A1886 15.685 6.437 8.216 1.00 4.56 H new ATOM 0 HE2 LYS A1886 15.831 4.477 6.681 1.00 5.38 H new ATOM 0 HE3 LYS A1886 16.909 5.380 5.636 1.00 5.38 H new ATOM 0 HZ1 LYS A1886 18.121 3.925 7.097 1.00 5.95 H new ATOM 0 HZ2 LYS A1886 18.488 5.544 7.452 1.00 5.95 H new ATOM 0 HZ3 LYS A1886 17.443 4.669 8.465 1.00 5.95 H new ATOM 42 N SER A1887 10.718 9.592 6.708 1.00 1.11 N ATOM 43 CA SER A1887 9.834 10.499 7.403 1.00 1.23 C ATOM 44 C SER A1887 9.318 9.882 8.722 1.00 1.05 C ATOM 45 O SER A1887 9.461 10.478 9.796 1.00 1.33 O ATOM 46 CB SER A1887 8.671 10.916 6.475 1.00 1.99 C ATOM 47 OG SER A1887 7.772 11.818 7.103 1.00 2.83 O ATOM 0 H SER A1887 10.251 8.961 6.056 1.00 1.11 H new ATOM 0 HA SER A1887 10.395 11.394 7.672 1.00 1.23 H new ATOM 0 HB2 SER A1887 9.076 11.379 5.575 1.00 1.99 H new ATOM 0 HB3 SER A1887 8.126 10.027 6.158 1.00 1.99 H new ATOM 0 HG SER A1887 7.055 12.054 6.478 1.00 2.83 H new ATOM 53 N ASN A1888 8.762 8.687 8.649 1.00 0.86 N ATOM 54 CA ASN A1888 8.170 8.036 9.810 1.00 0.91 C ATOM 55 C ASN A1888 8.896 6.741 10.096 1.00 0.87 C ATOM 56 O ASN A1888 9.275 6.015 9.170 1.00 1.23 O ATOM 57 CB ASN A1888 6.681 7.768 9.515 1.00 1.19 C ATOM 58 CG ASN A1888 5.839 7.184 10.653 1.00 1.37 C ATOM 59 OD1 ASN A1888 6.301 6.433 11.503 1.00 1.91 O ATOM 60 ND2 ASN A1888 4.581 7.521 10.643 1.00 1.53 N ATOM 0 H ASN A1888 8.706 8.140 7.790 1.00 0.86 H new ATOM 0 HA ASN A1888 8.257 8.677 10.687 1.00 0.91 H new ATOM 0 HB2 ASN A1888 6.224 8.707 9.203 1.00 1.19 H new ATOM 0 HB3 ASN A1888 6.621 7.087 8.666 1.00 1.19 H new ATOM 0 HD21 ASN A1888 3.950 7.157 11.357 1.00 1.53 H new ATOM 0 HD22 ASN A1888 4.227 8.149 9.921 1.00 1.53 H new ATOM 67 N VAL A1889 9.105 6.462 11.350 1.00 0.91 N ATOM 68 CA VAL A1889 9.736 5.243 11.773 1.00 1.02 C ATOM 69 C VAL A1889 8.782 4.427 12.651 1.00 1.13 C ATOM 70 O VAL A1889 8.387 4.850 13.731 1.00 1.41 O ATOM 71 CB VAL A1889 11.119 5.481 12.486 1.00 1.34 C ATOM 72 CG1 VAL A1889 11.006 6.424 13.684 1.00 1.98 C ATOM 73 CG2 VAL A1889 11.753 4.156 12.905 1.00 2.12 C ATOM 0 H VAL A1889 8.840 7.080 12.117 1.00 0.91 H new ATOM 0 HA VAL A1889 9.961 4.669 10.874 1.00 1.02 H new ATOM 0 HB VAL A1889 11.767 5.966 11.756 1.00 1.34 H new ATOM 0 HG11 VAL A1889 11.988 6.554 14.139 1.00 1.98 H new ATOM 0 HG12 VAL A1889 10.630 7.391 13.351 1.00 1.98 H new ATOM 0 HG13 VAL A1889 10.320 6.000 14.417 1.00 1.98 H new ATOM 0 HG21 VAL A1889 12.707 4.348 13.395 1.00 2.12 H new ATOM 0 HG22 VAL A1889 11.088 3.637 13.596 1.00 2.12 H new ATOM 0 HG23 VAL A1889 11.916 3.536 12.024 1.00 2.12 H new ATOM 83 N GLN A1890 8.358 3.296 12.141 1.00 1.17 N ATOM 84 CA GLN A1890 7.513 2.405 12.916 1.00 1.48 C ATOM 85 C GLN A1890 8.324 1.270 13.491 1.00 1.69 C ATOM 86 O GLN A1890 7.945 0.690 14.494 1.00 2.49 O ATOM 87 CB GLN A1890 6.333 1.866 12.106 1.00 1.71 C ATOM 88 CG GLN A1890 5.250 2.892 11.790 1.00 1.52 C ATOM 89 CD GLN A1890 4.621 3.498 13.024 1.00 2.03 C ATOM 90 OE1 GLN A1890 3.651 2.969 13.563 1.00 2.63 O ATOM 91 NE2 GLN A1890 5.124 4.624 13.441 1.00 2.40 N ATOM 0 H GLN A1890 8.579 2.968 11.201 1.00 1.17 H new ATOM 0 HA GLN A1890 7.096 2.993 13.733 1.00 1.48 H new ATOM 0 HB2 GLN A1890 6.711 1.457 11.169 1.00 1.71 H new ATOM 0 HB3 GLN A1890 5.881 1.040 12.655 1.00 1.71 H new ATOM 0 HG2 GLN A1890 5.680 3.688 11.182 1.00 1.52 H new ATOM 0 HG3 GLN A1890 4.473 2.417 11.191 1.00 1.52 H new ATOM 0 HE21 GLN A1890 5.930 5.030 12.965 1.00 2.40 H new ATOM 0 HE22 GLN A1890 4.712 5.101 14.243 1.00 2.40 H new ATOM 100 N ASN A1891 9.440 0.946 12.819 1.00 1.59 N ATOM 101 CA ASN A1891 10.409 -0.099 13.256 1.00 1.88 C ATOM 102 C ASN A1891 9.917 -1.541 13.000 1.00 1.48 C ATOM 103 O ASN A1891 10.721 -2.455 12.835 1.00 1.86 O ATOM 104 CB ASN A1891 10.856 0.108 14.738 1.00 2.50 C ATOM 105 CG ASN A1891 11.871 -0.920 15.238 1.00 3.17 C ATOM 106 OD1 ASN A1891 13.074 -0.742 15.080 1.00 3.82 O ATOM 107 ND2 ASN A1891 11.401 -1.971 15.866 1.00 3.53 N ATOM 0 H ASN A1891 9.707 1.401 11.946 1.00 1.59 H new ATOM 0 HA ASN A1891 11.288 0.030 12.625 1.00 1.88 H new ATOM 0 HB2 ASN A1891 11.285 1.105 14.840 1.00 2.50 H new ATOM 0 HB3 ASN A1891 9.975 0.073 15.379 1.00 2.50 H new ATOM 0 HD21 ASN A1891 12.042 -2.671 16.240 1.00 3.53 H new ATOM 0 HD22 ASN A1891 10.394 -2.089 15.980 1.00 3.53 H new ATOM 114 N ASP A1892 8.632 -1.740 12.934 1.00 1.00 N ATOM 115 CA ASP A1892 8.083 -3.072 12.721 1.00 1.01 C ATOM 116 C ASP A1892 7.818 -3.375 11.249 1.00 1.00 C ATOM 117 O ASP A1892 8.206 -4.450 10.766 1.00 1.59 O ATOM 118 CB ASP A1892 6.847 -3.339 13.591 1.00 1.40 C ATOM 119 CG ASP A1892 5.685 -2.422 13.320 1.00 2.05 C ATOM 120 OD1 ASP A1892 5.911 -1.284 12.859 1.00 2.66 O ATOM 121 OD2 ASP A1892 4.515 -2.835 13.497 1.00 2.61 O ATOM 0 H ASP A1892 7.933 -1.002 13.023 1.00 1.00 H new ATOM 0 HA ASP A1892 8.857 -3.769 13.044 1.00 1.01 H new ATOM 0 HB2 ASP A1892 6.525 -4.369 13.437 1.00 1.40 H new ATOM 0 HB3 ASP A1892 7.129 -3.247 14.640 1.00 1.40 H new ATOM 126 N CYS A1893 7.167 -2.468 10.515 1.00 0.74 N ATOM 127 CA CYS A1893 6.973 -2.713 9.085 1.00 0.87 C ATOM 128 C CYS A1893 8.231 -2.399 8.272 1.00 0.75 C ATOM 129 O CYS A1893 8.367 -1.338 7.657 1.00 0.80 O ATOM 130 CB CYS A1893 5.728 -2.028 8.496 1.00 1.17 C ATOM 131 SG CYS A1893 5.727 -0.198 8.526 1.00 1.58 S ATOM 0 H CYS A1893 6.780 -1.593 10.869 1.00 0.74 H new ATOM 0 HA CYS A1893 6.783 -3.783 9.003 1.00 0.87 H new ATOM 0 HB2 CYS A1893 5.613 -2.354 7.462 1.00 1.17 H new ATOM 0 HB3 CYS A1893 4.852 -2.381 9.041 1.00 1.17 H new ATOM 136 N ARG A1894 9.162 -3.296 8.356 1.00 0.73 N ATOM 137 CA ARG A1894 10.392 -3.247 7.636 1.00 0.73 C ATOM 138 C ARG A1894 10.869 -4.647 7.473 1.00 0.72 C ATOM 139 O ARG A1894 10.519 -5.517 8.285 1.00 0.92 O ATOM 140 CB ARG A1894 11.448 -2.394 8.356 1.00 0.85 C ATOM 141 CG ARG A1894 11.721 -2.771 9.802 1.00 1.21 C ATOM 142 CD ARG A1894 12.772 -1.854 10.407 1.00 1.35 C ATOM 143 NE ARG A1894 12.435 -0.440 10.194 1.00 1.45 N ATOM 144 CZ ARG A1894 13.103 0.621 10.646 1.00 1.80 C ATOM 145 NH1 ARG A1894 14.068 0.496 11.535 1.00 2.09 N ATOM 146 NH2 ARG A1894 12.743 1.820 10.222 1.00 2.57 N ATOM 0 H ARG A1894 9.080 -4.118 8.955 1.00 0.73 H new ATOM 0 HA ARG A1894 10.229 -2.776 6.667 1.00 0.73 H new ATOM 0 HB2 ARG A1894 12.383 -2.459 7.799 1.00 0.85 H new ATOM 0 HB3 ARG A1894 11.130 -1.352 8.325 1.00 0.85 H new ATOM 0 HG2 ARG A1894 10.799 -2.707 10.380 1.00 1.21 H new ATOM 0 HG3 ARG A1894 12.060 -3.806 9.856 1.00 1.21 H new ATOM 0 HD2 ARG A1894 12.859 -2.052 11.475 1.00 1.35 H new ATOM 0 HD3 ARG A1894 13.744 -2.069 9.963 1.00 1.35 H new ATOM 0 HE ARG A1894 11.600 -0.250 9.640 1.00 1.45 H new ATOM 0 HH11 ARG A1894 14.317 -0.427 11.891 1.00 2.09 H new ATOM 0 HH12 ARG A1894 14.566 1.322 11.867 1.00 2.09 H new ATOM 0 HH21 ARG A1894 11.970 1.917 9.564 1.00 2.57 H new ATOM 0 HH22 ARG A1894 13.238 2.648 10.553 1.00 2.57 H new ATOM 160 N VAL A1895 11.610 -4.892 6.446 1.00 0.58 N ATOM 161 CA VAL A1895 12.103 -6.210 6.187 1.00 0.60 C ATOM 162 C VAL A1895 13.442 -6.086 5.483 1.00 0.52 C ATOM 163 O VAL A1895 13.686 -5.112 4.784 1.00 0.47 O ATOM 164 CB VAL A1895 11.082 -7.036 5.336 1.00 0.63 C ATOM 165 CG1 VAL A1895 10.944 -6.518 3.910 1.00 0.57 C ATOM 166 CG2 VAL A1895 11.400 -8.514 5.365 1.00 0.72 C ATOM 0 H VAL A1895 11.893 -4.190 5.762 1.00 0.58 H new ATOM 0 HA VAL A1895 12.233 -6.749 7.125 1.00 0.60 H new ATOM 0 HB VAL A1895 10.108 -6.898 5.806 1.00 0.63 H new ATOM 0 HG11 VAL A1895 10.223 -7.130 3.369 1.00 0.57 H new ATOM 0 HG12 VAL A1895 10.600 -5.484 3.930 1.00 0.57 H new ATOM 0 HG13 VAL A1895 11.911 -6.569 3.409 1.00 0.57 H new ATOM 0 HG21 VAL A1895 10.670 -9.055 4.763 1.00 0.72 H new ATOM 0 HG22 VAL A1895 12.398 -8.679 4.960 1.00 0.72 H new ATOM 0 HG23 VAL A1895 11.361 -8.874 6.393 1.00 0.72 H new ATOM 176 N THR A1896 14.321 -6.995 5.721 1.00 0.63 N ATOM 177 CA THR A1896 15.611 -6.957 5.100 1.00 0.69 C ATOM 178 C THR A1896 15.648 -7.957 3.954 1.00 0.69 C ATOM 179 O THR A1896 15.164 -9.076 4.089 1.00 0.76 O ATOM 180 CB THR A1896 16.684 -7.306 6.140 1.00 0.89 C ATOM 181 OG1 THR A1896 16.424 -6.520 7.303 1.00 0.98 O ATOM 182 CG2 THR A1896 18.079 -6.977 5.625 1.00 1.02 C ATOM 0 H THR A1896 14.173 -7.786 6.348 1.00 0.63 H new ATOM 0 HA THR A1896 15.805 -5.959 4.708 1.00 0.69 H new ATOM 0 HB THR A1896 16.647 -8.374 6.356 1.00 0.89 H new ATOM 0 HG1 THR A1896 17.093 -6.721 7.990 1.00 0.98 H new ATOM 0 HG21 THR A1896 18.817 -7.235 6.384 1.00 1.02 H new ATOM 0 HG22 THR A1896 18.276 -7.548 4.718 1.00 1.02 H new ATOM 0 HG23 THR A1896 18.143 -5.912 5.404 1.00 1.02 H new ATOM 190 N ASN A1897 16.161 -7.547 2.828 1.00 0.75 N ATOM 191 CA ASN A1897 16.319 -8.452 1.710 1.00 0.88 C ATOM 192 C ASN A1897 17.751 -8.916 1.689 1.00 1.04 C ATOM 193 O ASN A1897 18.641 -8.128 1.448 1.00 1.06 O ATOM 194 CB ASN A1897 15.929 -7.783 0.375 1.00 0.95 C ATOM 195 CG ASN A1897 16.207 -8.653 -0.864 1.00 1.17 C ATOM 196 OD1 ASN A1897 16.215 -9.884 -0.796 1.00 1.65 O ATOM 197 ND2 ASN A1897 16.415 -8.019 -2.003 1.00 1.21 N ATOM 0 H ASN A1897 16.479 -6.593 2.654 1.00 0.75 H new ATOM 0 HA ASN A1897 15.650 -9.304 1.831 1.00 0.88 H new ATOM 0 HB2 ASN A1897 14.868 -7.534 0.401 1.00 0.95 H new ATOM 0 HB3 ASN A1897 16.474 -6.844 0.277 1.00 0.95 H new ATOM 0 HD21 ASN A1897 16.588 -8.549 -2.857 1.00 1.21 H new ATOM 0 HD22 ASN A1897 16.402 -6.999 -2.029 1.00 1.21 H new ATOM 204 N PRO A1898 18.001 -10.192 1.979 1.00 1.26 N ATOM 205 CA PRO A1898 19.362 -10.758 2.033 1.00 1.47 C ATOM 206 C PRO A1898 20.085 -10.698 0.686 1.00 1.54 C ATOM 207 O PRO A1898 21.300 -10.838 0.616 1.00 1.71 O ATOM 208 CB PRO A1898 19.131 -12.209 2.447 1.00 1.73 C ATOM 209 CG PRO A1898 17.711 -12.484 2.108 1.00 1.69 C ATOM 210 CD PRO A1898 16.986 -11.202 2.313 1.00 1.40 C ATOM 0 HA PRO A1898 20.000 -10.199 2.718 1.00 1.47 H new ATOM 0 HB2 PRO A1898 19.802 -12.883 1.914 1.00 1.73 H new ATOM 0 HB3 PRO A1898 19.317 -12.350 3.512 1.00 1.73 H new ATOM 0 HG2 PRO A1898 17.615 -12.826 1.078 1.00 1.69 H new ATOM 0 HG3 PRO A1898 17.303 -13.269 2.744 1.00 1.69 H new ATOM 0 HD2 PRO A1898 16.112 -11.125 1.667 1.00 1.40 H new ATOM 0 HD3 PRO A1898 16.634 -11.097 3.339 1.00 1.40 H new ATOM 218 N ALA A1899 19.330 -10.491 -0.376 1.00 1.48 N ATOM 219 CA ALA A1899 19.902 -10.364 -1.697 1.00 1.62 C ATOM 220 C ALA A1899 20.598 -9.017 -1.851 1.00 1.54 C ATOM 221 O ALA A1899 21.610 -8.904 -2.537 1.00 1.69 O ATOM 222 CB ALA A1899 18.834 -10.529 -2.744 1.00 1.72 C ATOM 0 H ALA A1899 18.314 -10.407 -0.346 1.00 1.48 H new ATOM 0 HA ALA A1899 20.645 -11.150 -1.831 1.00 1.62 H new ATOM 0 HB1 ALA A1899 19.278 -10.431 -3.735 1.00 1.72 H new ATOM 0 HB2 ALA A1899 18.378 -11.514 -2.646 1.00 1.72 H new ATOM 0 HB3 ALA A1899 18.072 -9.761 -2.610 1.00 1.72 H new ATOM 228 N THR A1900 20.048 -8.004 -1.218 1.00 1.37 N ATOM 229 CA THR A1900 20.626 -6.685 -1.241 1.00 1.38 C ATOM 230 C THR A1900 21.486 -6.482 -0.005 1.00 1.36 C ATOM 231 O THR A1900 22.478 -5.752 -0.018 1.00 1.53 O ATOM 232 CB THR A1900 19.501 -5.621 -1.305 1.00 1.31 C ATOM 233 OG1 THR A1900 18.525 -5.879 -0.288 1.00 1.45 O ATOM 234 CG2 THR A1900 18.837 -5.676 -2.653 1.00 1.46 C ATOM 0 H THR A1900 19.188 -8.075 -0.674 1.00 1.37 H new ATOM 0 HA THR A1900 21.255 -6.578 -2.125 1.00 1.38 H new ATOM 0 HB THR A1900 19.935 -4.634 -1.146 1.00 1.31 H new ATOM 0 HG1 THR A1900 18.838 -6.606 0.289 1.00 1.45 H new ATOM 0 HG21 THR A1900 18.045 -4.928 -2.699 1.00 1.46 H new ATOM 0 HG22 THR A1900 19.574 -5.473 -3.430 1.00 1.46 H new ATOM 0 HG23 THR A1900 18.410 -6.667 -2.808 1.00 1.46 H new ATOM 242 N GLY A1901 21.085 -7.145 1.069 1.00 1.23 N ATOM 243 CA GLY A1901 21.758 -7.052 2.340 1.00 1.29 C ATOM 244 C GLY A1901 21.328 -5.810 3.059 1.00 1.27 C ATOM 245 O GLY A1901 21.826 -5.479 4.135 1.00 1.46 O ATOM 0 H GLY A1901 20.276 -7.766 1.075 1.00 1.23 H new ATOM 0 HA2 GLY A1901 21.531 -7.929 2.946 1.00 1.29 H new ATOM 0 HA3 GLY A1901 22.837 -7.039 2.189 1.00 1.29 H new ATOM 249 N HIS A1902 20.406 -5.109 2.444 1.00 1.12 N ATOM 250 CA HIS A1902 19.945 -3.842 2.927 1.00 1.15 C ATOM 251 C HIS A1902 18.512 -3.941 3.420 1.00 0.91 C ATOM 252 O HIS A1902 17.773 -4.885 3.065 1.00 0.84 O ATOM 253 CB HIS A1902 20.142 -2.730 1.865 1.00 1.34 C ATOM 254 CG HIS A1902 21.606 -2.410 1.567 1.00 2.00 C ATOM 255 ND1 HIS A1902 22.014 -1.326 0.839 1.00 2.46 N ATOM 256 CD2 HIS A1902 22.756 -3.053 1.917 1.00 2.87 C ATOM 257 CE1 HIS A1902 23.326 -1.319 0.757 1.00 3.18 C ATOM 258 NE2 HIS A1902 23.796 -2.350 1.398 1.00 3.41 N ATOM 0 H HIS A1902 19.952 -5.412 1.582 1.00 1.12 H new ATOM 0 HA HIS A1902 20.553 -3.556 3.785 1.00 1.15 H new ATOM 0 HB2 HIS A1902 19.651 -3.034 0.940 1.00 1.34 H new ATOM 0 HB3 HIS A1902 19.644 -1.823 2.207 1.00 1.34 H new ATOM 0 HD1 HIS A1902 21.395 -0.630 0.423 1.00 2.46 H new ATOM 0 HD2 HIS A1902 22.827 -3.958 2.502 1.00 2.87 H new ATOM 0 HE1 HIS A1902 23.918 -0.578 0.241 1.00 3.18 H new ATOM 267 N LEU A1903 18.129 -2.984 4.207 1.00 0.87 N ATOM 268 CA LEU A1903 16.846 -2.959 4.879 1.00 0.75 C ATOM 269 C LEU A1903 15.835 -2.161 4.079 1.00 0.70 C ATOM 270 O LEU A1903 16.139 -1.083 3.582 1.00 0.88 O ATOM 271 CB LEU A1903 17.021 -2.328 6.274 1.00 0.94 C ATOM 272 CG LEU A1903 15.760 -2.129 7.130 1.00 0.99 C ATOM 273 CD1 LEU A1903 15.137 -3.458 7.514 1.00 1.34 C ATOM 274 CD2 LEU A1903 16.089 -1.307 8.365 1.00 1.48 C ATOM 0 H LEU A1903 18.709 -2.171 4.412 1.00 0.87 H new ATOM 0 HA LEU A1903 16.476 -3.980 4.975 1.00 0.75 H new ATOM 0 HB2 LEU A1903 17.715 -2.950 6.839 1.00 0.94 H new ATOM 0 HB3 LEU A1903 17.496 -1.356 6.145 1.00 0.94 H new ATOM 0 HG LEU A1903 15.027 -1.585 6.534 1.00 0.99 H new ATOM 0 HD11 LEU A1903 14.248 -3.282 8.119 1.00 1.34 H new ATOM 0 HD12 LEU A1903 14.860 -4.004 6.612 1.00 1.34 H new ATOM 0 HD13 LEU A1903 15.855 -4.044 8.087 1.00 1.34 H new ATOM 0 HD21 LEU A1903 15.188 -1.173 8.963 1.00 1.48 H new ATOM 0 HD22 LEU A1903 16.844 -1.825 8.957 1.00 1.48 H new ATOM 0 HD23 LEU A1903 16.472 -0.332 8.062 1.00 1.48 H new ATOM 286 N PHE A1904 14.657 -2.706 3.943 1.00 0.53 N ATOM 287 CA PHE A1904 13.569 -2.030 3.290 1.00 0.51 C ATOM 288 C PHE A1904 12.615 -1.523 4.346 1.00 0.48 C ATOM 289 O PHE A1904 12.152 -2.306 5.188 1.00 0.49 O ATOM 290 CB PHE A1904 12.775 -2.977 2.377 1.00 0.51 C ATOM 291 CG PHE A1904 13.505 -3.595 1.214 1.00 0.58 C ATOM 292 CD1 PHE A1904 14.665 -3.037 0.691 1.00 1.01 C ATOM 293 CD2 PHE A1904 12.991 -4.732 0.624 1.00 0.71 C ATOM 294 CE1 PHE A1904 15.290 -3.616 -0.395 1.00 1.17 C ATOM 295 CE2 PHE A1904 13.596 -5.310 -0.458 1.00 0.79 C ATOM 296 CZ PHE A1904 14.754 -4.754 -0.974 1.00 0.86 C ATOM 0 H PHE A1904 14.423 -3.638 4.285 1.00 0.53 H new ATOM 0 HA PHE A1904 13.990 -1.223 2.690 1.00 0.51 H new ATOM 0 HB2 PHE A1904 12.379 -3.784 2.993 1.00 0.51 H new ATOM 0 HB3 PHE A1904 11.920 -2.427 1.984 1.00 0.51 H new ATOM 0 HD1 PHE A1904 15.080 -2.145 1.137 1.00 1.01 H new ATOM 0 HD2 PHE A1904 12.092 -5.175 1.025 1.00 0.71 H new ATOM 0 HE1 PHE A1904 16.196 -3.182 -0.793 1.00 1.17 H new ATOM 0 HE2 PHE A1904 13.172 -6.196 -0.908 1.00 0.79 H new ATOM 0 HZ PHE A1904 15.238 -5.207 -1.826 1.00 0.86 H new ATOM 306 N ASP A1905 12.347 -0.248 4.331 1.00 0.57 N ATOM 307 CA ASP A1905 11.349 0.345 5.203 1.00 0.61 C ATOM 308 C ASP A1905 10.750 1.517 4.488 1.00 0.55 C ATOM 309 O ASP A1905 11.468 2.434 4.053 1.00 0.71 O ATOM 310 CB ASP A1905 11.923 0.813 6.564 1.00 0.88 C ATOM 311 CG ASP A1905 10.832 1.329 7.533 1.00 1.37 C ATOM 312 OD1 ASP A1905 10.150 2.301 7.229 1.00 1.95 O ATOM 313 OD2 ASP A1905 10.688 0.791 8.640 1.00 1.97 O ATOM 0 H ASP A1905 12.811 0.419 3.715 1.00 0.57 H new ATOM 0 HA ASP A1905 10.605 -0.419 5.429 1.00 0.61 H new ATOM 0 HB2 ASP A1905 12.455 -0.015 7.032 1.00 0.88 H new ATOM 0 HB3 ASP A1905 12.653 1.604 6.392 1.00 0.88 H new ATOM 318 N LEU A1906 9.451 1.501 4.354 1.00 0.48 N ATOM 319 CA LEU A1906 8.730 2.560 3.711 1.00 0.48 C ATOM 320 C LEU A1906 8.525 3.683 4.710 1.00 0.52 C ATOM 321 O LEU A1906 7.428 3.896 5.231 1.00 0.71 O ATOM 322 CB LEU A1906 7.405 2.032 3.175 1.00 0.50 C ATOM 323 CG LEU A1906 7.530 0.890 2.165 1.00 0.47 C ATOM 324 CD1 LEU A1906 6.182 0.295 1.874 1.00 0.53 C ATOM 325 CD2 LEU A1906 8.172 1.382 0.873 1.00 0.54 C ATOM 0 H LEU A1906 8.859 0.742 4.693 1.00 0.48 H new ATOM 0 HA LEU A1906 9.294 2.948 2.862 1.00 0.48 H new ATOM 0 HB2 LEU A1906 6.800 1.691 4.015 1.00 0.50 H new ATOM 0 HB3 LEU A1906 6.865 2.855 2.707 1.00 0.50 H new ATOM 0 HG LEU A1906 8.168 0.121 2.600 1.00 0.47 H new ATOM 0 HD11 LEU A1906 6.290 -0.516 1.154 1.00 0.53 H new ATOM 0 HD12 LEU A1906 5.749 -0.094 2.796 1.00 0.53 H new ATOM 0 HD13 LEU A1906 5.527 1.062 1.461 1.00 0.53 H new ATOM 0 HD21 LEU A1906 8.252 0.554 0.168 1.00 0.54 H new ATOM 0 HD22 LEU A1906 7.558 2.171 0.439 1.00 0.54 H new ATOM 0 HD23 LEU A1906 9.167 1.773 1.087 1.00 0.54 H new ATOM 337 N THR A1907 9.613 4.315 5.027 1.00 0.66 N ATOM 338 CA THR A1907 9.712 5.348 6.025 1.00 0.74 C ATOM 339 C THR A1907 8.878 6.581 5.696 1.00 0.69 C ATOM 340 O THR A1907 8.070 7.026 6.492 1.00 0.70 O ATOM 341 CB THR A1907 11.183 5.741 6.180 1.00 1.11 C ATOM 342 OG1 THR A1907 11.794 5.781 4.870 1.00 1.59 O ATOM 343 CG2 THR A1907 11.942 4.772 7.066 1.00 1.13 C ATOM 0 H THR A1907 10.506 4.117 4.575 1.00 0.66 H new ATOM 0 HA THR A1907 9.314 4.946 6.957 1.00 0.74 H new ATOM 0 HB THR A1907 11.226 6.720 6.657 1.00 1.11 H new ATOM 0 HG1 THR A1907 12.627 5.264 4.881 1.00 1.59 H new ATOM 0 HG21 THR A1907 12.981 5.091 7.147 1.00 1.13 H new ATOM 0 HG22 THR A1907 11.489 4.754 8.057 1.00 1.13 H new ATOM 0 HG23 THR A1907 11.902 3.773 6.631 1.00 1.13 H new ATOM 351 N SER A1908 9.063 7.108 4.530 1.00 0.83 N ATOM 352 CA SER A1908 8.379 8.320 4.120 1.00 1.00 C ATOM 353 C SER A1908 6.976 8.057 3.597 1.00 0.94 C ATOM 354 O SER A1908 6.230 8.991 3.289 1.00 1.16 O ATOM 355 CB SER A1908 9.205 9.050 3.093 1.00 1.28 C ATOM 356 OG SER A1908 10.483 9.342 3.615 1.00 1.36 O ATOM 0 H SER A1908 9.690 6.721 3.825 1.00 0.83 H new ATOM 0 HA SER A1908 8.264 8.945 5.006 1.00 1.00 H new ATOM 0 HB2 SER A1908 9.302 8.442 2.194 1.00 1.28 H new ATOM 0 HB3 SER A1908 8.704 9.973 2.801 1.00 1.28 H new ATOM 0 HG SER A1908 10.891 10.067 3.096 1.00 1.36 H new ATOM 362 N LEU A1909 6.614 6.800 3.492 1.00 0.76 N ATOM 363 CA LEU A1909 5.330 6.456 2.946 1.00 0.87 C ATOM 364 C LEU A1909 4.271 6.428 4.054 1.00 0.82 C ATOM 365 O LEU A1909 3.081 6.656 3.813 1.00 1.00 O ATOM 366 CB LEU A1909 5.424 5.128 2.214 1.00 0.89 C ATOM 367 CG LEU A1909 4.333 4.869 1.194 1.00 1.28 C ATOM 368 CD1 LEU A1909 4.298 6.013 0.194 1.00 2.03 C ATOM 369 CD2 LEU A1909 4.599 3.564 0.473 1.00 1.67 C ATOM 0 H LEU A1909 7.188 6.006 3.776 1.00 0.76 H new ATOM 0 HA LEU A1909 5.023 7.214 2.225 1.00 0.87 H new ATOM 0 HB2 LEU A1909 6.389 5.078 1.709 1.00 0.89 H new ATOM 0 HB3 LEU A1909 5.408 4.325 2.950 1.00 0.89 H new ATOM 0 HG LEU A1909 3.371 4.801 1.702 1.00 1.28 H new ATOM 0 HD11 LEU A1909 3.514 5.830 -0.541 1.00 2.03 H new ATOM 0 HD12 LEU A1909 4.094 6.947 0.717 1.00 2.03 H new ATOM 0 HD13 LEU A1909 5.261 6.083 -0.312 1.00 2.03 H new ATOM 0 HD21 LEU A1909 3.811 3.385 -0.258 1.00 1.67 H new ATOM 0 HD22 LEU A1909 5.561 3.619 -0.037 1.00 1.67 H new ATOM 0 HD23 LEU A1909 4.617 2.747 1.194 1.00 1.67 H new ATOM 381 N LYS A1910 4.721 6.180 5.264 1.00 0.69 N ATOM 382 CA LYS A1910 3.859 6.226 6.421 1.00 0.78 C ATOM 383 C LYS A1910 3.820 7.624 6.964 1.00 0.81 C ATOM 384 O LYS A1910 4.846 8.306 6.996 1.00 0.92 O ATOM 385 CB LYS A1910 4.266 5.202 7.489 1.00 0.85 C ATOM 386 CG LYS A1910 5.751 4.945 7.623 1.00 1.10 C ATOM 387 CD LYS A1910 6.018 3.989 8.762 1.00 1.40 C ATOM 388 CE LYS A1910 7.425 3.432 8.742 1.00 2.20 C ATOM 389 NZ LYS A1910 7.627 2.480 7.635 1.00 2.72 N ATOM 0 H LYS A1910 5.691 5.942 5.472 1.00 0.69 H new ATOM 0 HA LYS A1910 2.852 5.946 6.112 1.00 0.78 H new ATOM 0 HB2 LYS A1910 3.887 5.541 8.453 1.00 0.85 H new ATOM 0 HB3 LYS A1910 3.771 4.257 7.266 1.00 0.85 H new ATOM 0 HG2 LYS A1910 6.140 4.531 6.693 1.00 1.10 H new ATOM 0 HG3 LYS A1910 6.275 5.885 7.798 1.00 1.10 H new ATOM 0 HD2 LYS A1910 5.849 4.502 9.709 1.00 1.40 H new ATOM 0 HD3 LYS A1910 5.305 3.166 8.714 1.00 1.40 H new ATOM 0 HE2 LYS A1910 8.138 4.251 8.650 1.00 2.20 H new ATOM 0 HE3 LYS A1910 7.631 2.935 9.690 1.00 2.20 H new ATOM 0 HZ1 LYS A1910 8.639 2.253 7.553 1.00 2.72 H new ATOM 0 HZ2 LYS A1910 7.091 1.609 7.824 1.00 2.72 H new ATOM 0 HZ3 LYS A1910 7.295 2.906 6.746 1.00 2.72 H new ATOM 403 N ARG A1911 2.657 8.061 7.376 1.00 0.82 N ATOM 404 CA ARG A1911 2.460 9.429 7.785 1.00 0.91 C ATOM 405 C ARG A1911 1.202 9.545 8.636 1.00 0.98 C ATOM 406 O ARG A1911 0.608 8.525 9.014 1.00 1.03 O ATOM 407 CB ARG A1911 2.396 10.315 6.528 1.00 0.99 C ATOM 408 CG ARG A1911 1.344 9.878 5.519 1.00 1.05 C ATOM 409 CD ARG A1911 1.523 10.571 4.185 1.00 1.26 C ATOM 410 NE ARG A1911 1.324 12.025 4.254 1.00 1.50 N ATOM 411 CZ ARG A1911 1.618 12.874 3.255 1.00 1.86 C ATOM 412 NH1 ARG A1911 2.351 12.461 2.219 1.00 1.90 N ATOM 413 NH2 ARG A1911 1.226 14.140 3.322 1.00 2.60 N ATOM 0 H ARG A1911 1.821 7.480 7.437 1.00 0.82 H new ATOM 0 HA ARG A1911 3.292 9.768 8.402 1.00 0.91 H new ATOM 0 HB2 ARG A1911 2.192 11.342 6.830 1.00 0.99 H new ATOM 0 HB3 ARG A1911 3.373 10.313 6.044 1.00 0.99 H new ATOM 0 HG2 ARG A1911 1.401 8.799 5.379 1.00 1.05 H new ATOM 0 HG3 ARG A1911 0.351 10.096 5.912 1.00 1.05 H new ATOM 0 HD2 ARG A1911 2.525 10.366 3.809 1.00 1.26 H new ATOM 0 HD3 ARG A1911 0.820 10.149 3.467 1.00 1.26 H new ATOM 0 HE ARG A1911 0.938 12.414 5.114 1.00 1.50 H new ATOM 0 HH11 ARG A1911 2.689 11.499 2.185 1.00 1.90 H new ATOM 0 HH12 ARG A1911 2.573 13.107 1.462 1.00 1.90 H new ATOM 0 HH21 ARG A1911 0.701 14.469 4.132 1.00 2.60 H new ATOM 0 HH22 ARG A1911 1.450 14.784 2.563 1.00 2.60 H new ATOM 427 N GLU A1912 0.812 10.755 8.963 1.00 1.18 N ATOM 428 CA GLU A1912 -0.348 10.985 9.812 1.00 1.43 C ATOM 429 C GLU A1912 -1.643 11.192 9.030 1.00 1.27 C ATOM 430 O GLU A1912 -2.705 11.420 9.618 1.00 1.48 O ATOM 431 CB GLU A1912 -0.088 12.125 10.792 1.00 1.83 C ATOM 432 CG GLU A1912 1.009 11.812 11.803 1.00 2.47 C ATOM 433 CD GLU A1912 0.658 10.645 12.704 1.00 2.80 C ATOM 434 OE1 GLU A1912 0.759 9.486 12.279 1.00 3.25 O ATOM 435 OE2 GLU A1912 0.248 10.870 13.859 1.00 3.16 O ATOM 0 H GLU A1912 1.282 11.606 8.654 1.00 1.18 H new ATOM 0 HA GLU A1912 -0.498 10.070 10.384 1.00 1.43 H new ATOM 0 HB2 GLU A1912 0.187 13.020 10.233 1.00 1.83 H new ATOM 0 HB3 GLU A1912 -1.010 12.353 11.326 1.00 1.83 H new ATOM 0 HG2 GLU A1912 1.935 11.590 11.272 1.00 2.47 H new ATOM 0 HG3 GLU A1912 1.196 12.695 12.415 1.00 2.47 H new ATOM 442 N SER A1913 -1.572 11.125 7.733 1.00 1.09 N ATOM 443 CA SER A1913 -2.755 11.256 6.929 1.00 1.05 C ATOM 444 C SER A1913 -3.015 9.999 6.072 1.00 0.93 C ATOM 445 O SER A1913 -3.634 9.036 6.542 1.00 1.08 O ATOM 446 CB SER A1913 -2.675 12.531 6.085 1.00 1.25 C ATOM 447 OG SER A1913 -1.438 12.580 5.375 1.00 1.86 O ATOM 0 H SER A1913 -0.709 10.981 7.208 1.00 1.09 H new ATOM 0 HA SER A1913 -3.615 11.345 7.593 1.00 1.05 H new ATOM 0 HB2 SER A1913 -3.507 12.562 5.382 1.00 1.25 H new ATOM 0 HB3 SER A1913 -2.768 13.407 6.727 1.00 1.25 H new ATOM 0 HG SER A1913 -1.401 13.399 4.838 1.00 1.86 H new ATOM 453 N GLY A1914 -2.473 9.993 4.870 1.00 0.88 N ATOM 454 CA GLY A1914 -2.662 8.907 3.938 1.00 0.88 C ATOM 455 C GLY A1914 -1.990 9.233 2.625 1.00 0.86 C ATOM 456 O GLY A1914 -1.239 10.220 2.549 1.00 1.14 O ATOM 0 H GLY A1914 -1.886 10.747 4.514 1.00 0.88 H new ATOM 0 HA2 GLY A1914 -2.248 7.987 4.350 1.00 0.88 H new ATOM 0 HA3 GLY A1914 -3.726 8.734 3.779 1.00 0.88 H new ATOM 460 N TYR A1915 -2.241 8.449 1.608 1.00 0.70 N ATOM 461 CA TYR A1915 -1.656 8.674 0.308 1.00 0.82 C ATOM 462 C TYR A1915 -2.697 8.337 -0.742 1.00 0.65 C ATOM 463 O TYR A1915 -3.374 7.309 -0.653 1.00 0.66 O ATOM 464 CB TYR A1915 -0.383 7.840 0.129 1.00 1.06 C ATOM 465 CG TYR A1915 0.567 8.440 -0.869 1.00 1.50 C ATOM 466 CD1 TYR A1915 1.509 9.388 -0.504 1.00 2.32 C ATOM 467 CD2 TYR A1915 0.533 8.024 -2.193 1.00 1.97 C ATOM 468 CE1 TYR A1915 2.390 9.905 -1.433 1.00 3.26 C ATOM 469 CE2 TYR A1915 1.402 8.537 -3.125 1.00 2.95 C ATOM 470 CZ TYR A1915 2.306 9.619 -2.676 1.00 3.50 C ATOM 471 OH TYR A1915 3.213 9.972 -3.664 1.00 4.60 O ATOM 0 H TYR A1915 -2.856 7.637 1.656 1.00 0.70 H new ATOM 0 HA TYR A1915 -1.361 9.718 0.204 1.00 0.82 H new ATOM 0 HB2 TYR A1915 0.121 7.742 1.091 1.00 1.06 H new ATOM 0 HB3 TYR A1915 -0.654 6.834 -0.193 1.00 1.06 H new ATOM 0 HD1 TYR A1915 1.555 9.727 0.520 1.00 2.32 H new ATOM 0 HD2 TYR A1915 -0.191 7.282 -2.496 1.00 1.97 H new ATOM 0 HE1 TYR A1915 3.173 10.570 -1.100 1.00 3.26 H new ATOM 0 HE2 TYR A1915 1.424 8.167 -4.140 1.00 2.95 H new ATOM 0 HH TYR A1915 3.688 9.172 -3.973 1.00 4.60 H new ATOM 481 N THR A1916 -2.819 9.170 -1.731 1.00 0.65 N ATOM 482 CA THR A1916 -3.899 9.051 -2.658 1.00 0.60 C ATOM 483 C THR A1916 -3.478 9.134 -4.093 1.00 0.60 C ATOM 484 O THR A1916 -2.487 9.783 -4.474 1.00 0.76 O ATOM 485 CB THR A1916 -5.015 10.087 -2.327 1.00 0.79 C ATOM 486 OG1 THR A1916 -6.162 9.936 -3.190 1.00 1.21 O ATOM 487 CG2 THR A1916 -4.476 11.504 -2.434 1.00 1.26 C ATOM 0 H THR A1916 -2.179 9.943 -1.916 1.00 0.65 H new ATOM 0 HA THR A1916 -4.301 8.045 -2.537 1.00 0.60 H new ATOM 0 HB THR A1916 -5.336 9.898 -1.303 1.00 0.79 H new ATOM 0 HG1 THR A1916 -6.351 8.983 -3.319 1.00 1.21 H new ATOM 0 HG21 THR A1916 -5.269 12.214 -2.199 1.00 1.26 H new ATOM 0 HG22 THR A1916 -3.653 11.634 -1.731 1.00 1.26 H new ATOM 0 HG23 THR A1916 -4.118 11.682 -3.448 1.00 1.26 H new ATOM 495 N ILE A1917 -4.246 8.422 -4.849 1.00 0.52 N ATOM 496 CA ILE A1917 -4.169 8.301 -6.259 1.00 0.56 C ATOM 497 C ILE A1917 -5.578 8.218 -6.813 1.00 0.57 C ATOM 498 O ILE A1917 -6.549 8.203 -6.046 1.00 0.59 O ATOM 499 CB ILE A1917 -3.437 7.027 -6.671 1.00 0.59 C ATOM 500 CG1 ILE A1917 -3.942 5.787 -5.904 1.00 0.69 C ATOM 501 CG2 ILE A1917 -1.952 7.191 -6.589 1.00 0.74 C ATOM 502 CD1 ILE A1917 -3.366 4.467 -6.394 1.00 0.74 C ATOM 0 H ILE A1917 -5.006 7.865 -4.459 1.00 0.52 H new ATOM 0 HA ILE A1917 -3.628 9.165 -6.645 1.00 0.56 H new ATOM 0 HB ILE A1917 -3.674 6.847 -7.720 1.00 0.59 H new ATOM 0 HG12 ILE A1917 -3.700 5.905 -4.848 1.00 0.69 H new ATOM 0 HG13 ILE A1917 -5.029 5.746 -5.980 1.00 0.69 H new ATOM 0 HG21 ILE A1917 -1.466 6.263 -6.890 1.00 0.74 H new ATOM 0 HG22 ILE A1917 -1.638 7.997 -7.252 1.00 0.74 H new ATOM 0 HG23 ILE A1917 -1.669 7.433 -5.565 1.00 0.74 H new ATOM 0 HD11 ILE A1917 -3.774 3.649 -5.800 1.00 0.74 H new ATOM 0 HD12 ILE A1917 -3.630 4.321 -7.442 1.00 0.74 H new ATOM 0 HD13 ILE A1917 -2.281 4.483 -6.292 1.00 0.74 H new ATOM 514 N THR A1918 -5.700 8.140 -8.103 1.00 0.65 N ATOM 515 CA THR A1918 -6.985 7.989 -8.718 1.00 0.72 C ATOM 516 C THR A1918 -7.291 6.488 -8.867 1.00 0.68 C ATOM 517 O THR A1918 -6.379 5.679 -9.044 1.00 0.76 O ATOM 518 CB THR A1918 -6.988 8.675 -10.104 1.00 0.94 C ATOM 519 OG1 THR A1918 -6.480 10.013 -9.960 1.00 1.07 O ATOM 520 CG2 THR A1918 -8.398 8.752 -10.677 1.00 1.06 C ATOM 0 H THR A1918 -4.918 8.179 -8.756 1.00 0.65 H new ATOM 0 HA THR A1918 -7.750 8.457 -8.099 1.00 0.72 H new ATOM 0 HB THR A1918 -6.366 8.089 -10.781 1.00 0.94 H new ATOM 0 HG1 THR A1918 -6.476 10.457 -10.834 1.00 1.07 H new ATOM 0 HG21 THR A1918 -8.369 9.239 -11.652 1.00 1.06 H new ATOM 0 HG22 THR A1918 -8.802 7.745 -10.786 1.00 1.06 H new ATOM 0 HG23 THR A1918 -9.034 9.327 -10.003 1.00 1.06 H new ATOM 528 N ASP A1919 -8.547 6.131 -8.727 1.00 0.69 N ATOM 529 CA ASP A1919 -9.001 4.759 -8.897 1.00 0.74 C ATOM 530 C ASP A1919 -9.311 4.530 -10.386 1.00 0.99 C ATOM 531 O ASP A1919 -9.068 5.413 -11.207 1.00 1.30 O ATOM 532 CB ASP A1919 -10.249 4.526 -7.985 1.00 0.76 C ATOM 533 CG ASP A1919 -10.962 3.207 -8.203 1.00 0.99 C ATOM 534 OD1 ASP A1919 -10.440 2.173 -7.856 1.00 1.28 O ATOM 535 OD2 ASP A1919 -12.069 3.223 -8.789 1.00 1.62 O ATOM 0 H ASP A1919 -9.293 6.786 -8.490 1.00 0.69 H new ATOM 0 HA ASP A1919 -8.236 4.042 -8.599 1.00 0.74 H new ATOM 0 HB2 ASP A1919 -9.935 4.585 -6.943 1.00 0.76 H new ATOM 0 HB3 ASP A1919 -10.958 5.337 -8.150 1.00 0.76 H new ATOM 540 N SER A1920 -9.800 3.360 -10.743 1.00 1.06 N ATOM 541 CA SER A1920 -10.220 3.078 -12.090 1.00 1.32 C ATOM 542 C SER A1920 -11.482 3.910 -12.414 1.00 1.30 C ATOM 543 O SER A1920 -11.794 4.184 -13.576 1.00 1.75 O ATOM 544 CB SER A1920 -10.505 1.589 -12.199 1.00 1.64 C ATOM 545 OG SER A1920 -9.373 0.849 -11.757 1.00 2.13 O ATOM 0 H SER A1920 -9.916 2.577 -10.099 1.00 1.06 H new ATOM 0 HA SER A1920 -9.442 3.346 -12.805 1.00 1.32 H new ATOM 0 HB2 SER A1920 -11.377 1.331 -11.598 1.00 1.64 H new ATOM 0 HB3 SER A1920 -10.741 1.329 -13.231 1.00 1.64 H new ATOM 0 HG SER A1920 -8.555 1.346 -11.967 1.00 2.13 H new ATOM 551 N HIS A1921 -12.188 4.301 -11.370 1.00 1.22 N ATOM 552 CA HIS A1921 -13.355 5.151 -11.481 1.00 1.77 C ATOM 553 C HIS A1921 -12.924 6.612 -11.312 1.00 1.73 C ATOM 554 O HIS A1921 -11.737 6.925 -11.379 1.00 2.31 O ATOM 555 CB HIS A1921 -14.387 4.781 -10.394 1.00 2.44 C ATOM 556 CG HIS A1921 -15.036 3.431 -10.545 1.00 3.25 C ATOM 557 ND1 HIS A1921 -16.278 3.133 -10.032 1.00 4.13 N ATOM 558 CD2 HIS A1921 -14.603 2.291 -11.134 1.00 3.75 C ATOM 559 CE1 HIS A1921 -16.575 1.883 -10.300 1.00 4.85 C ATOM 560 NE2 HIS A1921 -15.577 1.352 -10.966 1.00 4.66 N ATOM 0 H HIS A1921 -11.964 4.034 -10.411 1.00 1.22 H new ATOM 0 HA HIS A1921 -13.815 5.012 -12.459 1.00 1.77 H new ATOM 0 HB2 HIS A1921 -13.895 4.821 -9.422 1.00 2.44 H new ATOM 0 HB3 HIS A1921 -15.168 5.541 -10.387 1.00 2.44 H new ATOM 0 HD2 HIS A1921 -13.661 2.152 -11.643 1.00 3.75 H new ATOM 0 HE1 HIS A1921 -17.487 1.377 -10.020 1.00 4.85 H new ATOM 0 HE2 HIS A1921 -15.536 0.390 -11.304 1.00 4.66 H new ATOM 569 N ASN A1922 -13.883 7.499 -11.126 1.00 1.59 N ATOM 570 CA ASN A1922 -13.597 8.913 -10.869 1.00 1.80 C ATOM 571 C ASN A1922 -13.100 9.091 -9.458 1.00 1.38 C ATOM 572 O ASN A1922 -12.284 9.974 -9.162 1.00 1.72 O ATOM 573 CB ASN A1922 -14.847 9.749 -11.045 1.00 2.28 C ATOM 574 CG ASN A1922 -15.271 9.907 -12.483 1.00 3.05 C ATOM 575 OD1 ASN A1922 -16.061 9.117 -13.001 1.00 3.29 O ATOM 576 ND2 ASN A1922 -14.765 10.916 -13.134 1.00 3.89 N ATOM 0 H ASN A1922 -14.877 7.271 -11.147 1.00 1.59 H new ATOM 0 HA ASN A1922 -12.836 9.237 -11.579 1.00 1.80 H new ATOM 0 HB2 ASN A1922 -15.662 9.292 -10.483 1.00 2.28 H new ATOM 0 HB3 ASN A1922 -14.677 10.736 -10.615 1.00 2.28 H new ATOM 0 HD21 ASN A1922 -15.020 11.074 -14.109 1.00 3.89 H new ATOM 0 HD22 ASN A1922 -14.114 11.548 -12.669 1.00 3.89 H new ATOM 583 N ARG A1923 -13.659 8.281 -8.594 1.00 0.98 N ATOM 584 CA ARG A1923 -13.316 8.192 -7.173 1.00 0.97 C ATOM 585 C ARG A1923 -11.800 8.021 -6.940 1.00 0.83 C ATOM 586 O ARG A1923 -11.034 7.662 -7.852 1.00 0.99 O ATOM 587 CB ARG A1923 -14.071 7.026 -6.548 1.00 1.46 C ATOM 588 CG ARG A1923 -13.666 5.686 -7.109 1.00 1.89 C ATOM 589 CD ARG A1923 -14.471 4.560 -6.527 1.00 2.66 C ATOM 590 NE ARG A1923 -14.054 3.276 -7.088 1.00 2.93 N ATOM 591 CZ ARG A1923 -14.699 2.132 -6.953 1.00 3.73 C ATOM 592 NH1 ARG A1923 -15.911 2.117 -6.432 1.00 4.35 N ATOM 593 NH2 ARG A1923 -14.144 1.003 -7.401 1.00 4.26 N ATOM 0 H ARG A1923 -14.399 7.632 -8.861 1.00 0.98 H new ATOM 0 HA ARG A1923 -13.607 9.131 -6.702 1.00 0.97 H new ATOM 0 HB2 ARG A1923 -13.902 7.028 -5.471 1.00 1.46 H new ATOM 0 HB3 ARG A1923 -15.140 7.169 -6.703 1.00 1.46 H new ATOM 0 HG2 ARG A1923 -13.788 5.696 -8.192 1.00 1.89 H new ATOM 0 HG3 ARG A1923 -12.608 5.515 -6.909 1.00 1.89 H new ATOM 0 HD2 ARG A1923 -14.351 4.544 -5.444 1.00 2.66 H new ATOM 0 HD3 ARG A1923 -15.530 4.723 -6.728 1.00 2.66 H new ATOM 0 HE ARG A1923 -13.190 3.263 -7.630 1.00 2.93 H new ATOM 0 HH11 ARG A1923 -16.349 2.989 -6.134 1.00 4.35 H new ATOM 0 HH12 ARG A1923 -16.410 1.234 -6.327 1.00 4.35 H new ATOM 0 HH21 ARG A1923 -13.226 1.027 -7.845 1.00 4.26 H new ATOM 0 HH22 ARG A1923 -14.638 0.116 -7.299 1.00 4.26 H new ATOM 607 N LYS A1924 -11.383 8.245 -5.730 1.00 0.68 N ATOM 608 CA LYS A1924 -9.980 8.218 -5.414 1.00 0.67 C ATOM 609 C LYS A1924 -9.619 7.048 -4.515 1.00 0.53 C ATOM 610 O LYS A1924 -10.419 6.605 -3.675 1.00 0.55 O ATOM 611 CB LYS A1924 -9.569 9.538 -4.746 1.00 0.87 C ATOM 612 CG LYS A1924 -10.284 9.819 -3.427 1.00 1.32 C ATOM 613 CD LYS A1924 -9.915 11.175 -2.876 1.00 1.59 C ATOM 614 CE LYS A1924 -10.612 11.457 -1.556 1.00 2.07 C ATOM 615 NZ LYS A1924 -10.119 10.591 -0.455 1.00 2.72 N ATOM 0 H LYS A1924 -11.995 8.450 -4.940 1.00 0.68 H new ATOM 0 HA LYS A1924 -9.435 8.093 -6.350 1.00 0.67 H new ATOM 0 HB2 LYS A1924 -8.494 9.523 -4.568 1.00 0.87 H new ATOM 0 HB3 LYS A1924 -9.766 10.359 -5.436 1.00 0.87 H new ATOM 0 HG2 LYS A1924 -11.362 9.768 -3.578 1.00 1.32 H new ATOM 0 HG3 LYS A1924 -10.027 9.048 -2.701 1.00 1.32 H new ATOM 0 HD2 LYS A1924 -8.835 11.229 -2.736 1.00 1.59 H new ATOM 0 HD3 LYS A1924 -10.181 11.946 -3.599 1.00 1.59 H new ATOM 0 HE2 LYS A1924 -10.462 12.502 -1.286 1.00 2.07 H new ATOM 0 HE3 LYS A1924 -11.685 11.309 -1.677 1.00 2.07 H new ATOM 0 HZ1 LYS A1924 -10.538 10.901 0.445 1.00 2.72 H new ATOM 0 HZ2 LYS A1924 -10.390 9.604 -0.641 1.00 2.72 H new ATOM 0 HZ3 LYS A1924 -9.083 10.660 -0.396 1.00 2.72 H new ATOM 629 N ILE A1925 -8.432 6.554 -4.701 1.00 0.49 N ATOM 630 CA ILE A1925 -7.868 5.553 -3.841 1.00 0.44 C ATOM 631 C ILE A1925 -7.063 6.316 -2.828 1.00 0.44 C ATOM 632 O ILE A1925 -6.239 7.155 -3.204 1.00 0.51 O ATOM 633 CB ILE A1925 -6.936 4.581 -4.614 1.00 0.51 C ATOM 634 CG1 ILE A1925 -7.719 3.833 -5.680 1.00 0.53 C ATOM 635 CG2 ILE A1925 -6.279 3.593 -3.659 1.00 0.56 C ATOM 636 CD1 ILE A1925 -6.870 2.950 -6.590 1.00 0.64 C ATOM 0 H ILE A1925 -7.818 6.838 -5.465 1.00 0.49 H new ATOM 0 HA ILE A1925 -8.652 4.941 -3.395 1.00 0.44 H new ATOM 0 HB ILE A1925 -6.155 5.169 -5.097 1.00 0.51 H new ATOM 0 HG12 ILE A1925 -8.470 3.212 -5.192 1.00 0.53 H new ATOM 0 HG13 ILE A1925 -8.254 4.557 -6.294 1.00 0.53 H new ATOM 0 HG21 ILE A1925 -5.630 2.921 -4.220 1.00 0.56 H new ATOM 0 HG22 ILE A1925 -5.688 4.137 -2.923 1.00 0.56 H new ATOM 0 HG23 ILE A1925 -7.048 3.013 -3.150 1.00 0.56 H new ATOM 0 HD11 ILE A1925 -7.512 2.455 -7.319 1.00 0.64 H new ATOM 0 HD12 ILE A1925 -6.135 3.564 -7.111 1.00 0.64 H new ATOM 0 HD13 ILE A1925 -6.355 2.199 -5.991 1.00 0.64 H new ATOM 648 N GLU A1926 -7.316 6.092 -1.589 1.00 0.43 N ATOM 649 CA GLU A1926 -6.673 6.834 -0.560 1.00 0.48 C ATOM 650 C GLU A1926 -6.347 5.861 0.558 1.00 0.46 C ATOM 651 O GLU A1926 -7.224 5.330 1.225 1.00 0.56 O ATOM 652 CB GLU A1926 -7.633 7.941 -0.139 1.00 0.67 C ATOM 653 CG GLU A1926 -6.986 9.222 0.332 1.00 1.40 C ATOM 654 CD GLU A1926 -6.373 9.137 1.684 1.00 1.65 C ATOM 655 OE1 GLU A1926 -7.088 9.433 2.657 1.00 1.95 O ATOM 656 OE2 GLU A1926 -5.180 8.852 1.789 1.00 2.28 O ATOM 0 H GLU A1926 -7.976 5.388 -1.257 1.00 0.43 H new ATOM 0 HA GLU A1926 -5.740 7.304 -0.871 1.00 0.48 H new ATOM 0 HB2 GLU A1926 -8.284 8.173 -0.982 1.00 0.67 H new ATOM 0 HB3 GLU A1926 -8.269 7.561 0.660 1.00 0.67 H new ATOM 0 HG2 GLU A1926 -6.218 9.512 -0.385 1.00 1.40 H new ATOM 0 HG3 GLU A1926 -7.735 10.014 0.335 1.00 1.40 H new ATOM 663 N LEU A1927 -5.109 5.575 0.699 1.00 0.44 N ATOM 664 CA LEU A1927 -4.665 4.562 1.604 1.00 0.51 C ATOM 665 C LEU A1927 -3.349 4.920 2.226 1.00 0.46 C ATOM 666 O LEU A1927 -2.516 5.574 1.602 1.00 0.61 O ATOM 667 CB LEU A1927 -4.632 3.182 0.881 1.00 0.68 C ATOM 668 CG LEU A1927 -4.259 3.169 -0.622 1.00 0.87 C ATOM 669 CD1 LEU A1927 -2.844 3.620 -0.907 1.00 1.54 C ATOM 670 CD2 LEU A1927 -4.509 1.812 -1.208 1.00 1.48 C ATOM 0 H LEU A1927 -4.358 6.038 0.187 1.00 0.44 H new ATOM 0 HA LEU A1927 -5.375 4.487 2.427 1.00 0.51 H new ATOM 0 HB2 LEU A1927 -3.924 2.543 1.409 1.00 0.68 H new ATOM 0 HB3 LEU A1927 -5.615 2.723 0.987 1.00 0.68 H new ATOM 0 HG LEU A1927 -4.907 3.903 -1.102 1.00 0.87 H new ATOM 0 HD11 LEU A1927 -2.660 3.583 -1.981 1.00 1.54 H new ATOM 0 HD12 LEU A1927 -2.709 4.641 -0.551 1.00 1.54 H new ATOM 0 HD13 LEU A1927 -2.142 2.961 -0.395 1.00 1.54 H new ATOM 0 HD21 LEU A1927 -4.242 1.817 -2.265 1.00 1.48 H new ATOM 0 HD22 LEU A1927 -3.903 1.072 -0.685 1.00 1.48 H new ATOM 0 HD23 LEU A1927 -5.564 1.558 -1.101 1.00 1.48 H new ATOM 682 N ASN A1928 -3.152 4.540 3.449 1.00 0.51 N ATOM 683 CA ASN A1928 -1.901 4.839 4.070 1.00 0.51 C ATOM 684 C ASN A1928 -1.131 3.563 4.268 1.00 0.64 C ATOM 685 O ASN A1928 -1.672 2.554 4.718 1.00 0.81 O ATOM 686 CB ASN A1928 -2.036 5.638 5.382 1.00 0.55 C ATOM 687 CG ASN A1928 -0.710 6.314 5.759 1.00 0.54 C ATOM 688 OD1 ASN A1928 -0.392 6.514 6.910 1.00 0.88 O ATOM 689 ND2 ASN A1928 0.043 6.719 4.764 1.00 0.80 N ATOM 0 H ASN A1928 -3.824 4.034 4.026 1.00 0.51 H new ATOM 0 HA ASN A1928 -1.349 5.499 3.400 1.00 0.51 H new ATOM 0 HB2 ASN A1928 -2.814 6.393 5.272 1.00 0.55 H new ATOM 0 HB3 ASN A1928 -2.349 4.972 6.186 1.00 0.55 H new ATOM 0 HD21 ASN A1928 0.915 7.213 4.953 1.00 0.80 H new ATOM 0 HD22 ASN A1928 -0.244 6.540 3.802 1.00 0.80 H new ATOM 696 N VAL A1929 0.098 3.595 3.865 1.00 0.65 N ATOM 697 CA VAL A1929 0.951 2.454 3.925 1.00 0.82 C ATOM 698 C VAL A1929 1.890 2.567 5.096 1.00 0.87 C ATOM 699 O VAL A1929 2.530 3.599 5.276 1.00 1.69 O ATOM 700 CB VAL A1929 1.754 2.308 2.609 1.00 0.99 C ATOM 701 CG1 VAL A1929 2.825 1.245 2.728 1.00 1.51 C ATOM 702 CG2 VAL A1929 0.815 1.971 1.467 1.00 1.73 C ATOM 0 H VAL A1929 0.544 4.427 3.479 1.00 0.65 H new ATOM 0 HA VAL A1929 0.332 1.566 4.055 1.00 0.82 H new ATOM 0 HB VAL A1929 2.247 3.259 2.408 1.00 0.99 H new ATOM 0 HG11 VAL A1929 3.369 1.169 1.786 1.00 1.51 H new ATOM 0 HG12 VAL A1929 3.517 1.513 3.526 1.00 1.51 H new ATOM 0 HG13 VAL A1929 2.361 0.285 2.957 1.00 1.51 H new ATOM 0 HG21 VAL A1929 1.386 1.870 0.544 1.00 1.73 H new ATOM 0 HG22 VAL A1929 0.303 1.033 1.682 1.00 1.73 H new ATOM 0 HG23 VAL A1929 0.080 2.768 1.353 1.00 1.73 H new ATOM 712 N CYS A1930 1.928 1.511 5.905 1.00 0.74 N ATOM 713 CA CYS A1930 2.815 1.399 7.067 1.00 0.83 C ATOM 714 C CYS A1930 2.349 2.236 8.232 1.00 0.74 C ATOM 715 O CYS A1930 3.058 2.373 9.229 1.00 0.97 O ATOM 716 CB CYS A1930 4.269 1.722 6.719 1.00 1.01 C ATOM 717 SG CYS A1930 5.364 0.286 6.580 1.00 1.20 S ATOM 0 H CYS A1930 1.334 0.693 5.772 1.00 0.74 H new ATOM 0 HA CYS A1930 2.770 0.354 7.374 1.00 0.83 H new ATOM 0 HB2 CYS A1930 4.288 2.266 5.775 1.00 1.01 H new ATOM 0 HB3 CYS A1930 4.668 2.391 7.481 1.00 1.01 H new ATOM 722 N ALA A1931 1.172 2.766 8.120 1.00 0.63 N ATOM 723 CA ALA A1931 0.586 3.551 9.147 1.00 0.65 C ATOM 724 C ALA A1931 -0.892 3.488 8.971 1.00 0.75 C ATOM 725 O ALA A1931 -1.370 3.107 7.899 1.00 1.31 O ATOM 726 CB ALA A1931 1.078 4.990 9.092 1.00 0.62 C ATOM 0 H ALA A1931 0.584 2.660 7.293 1.00 0.63 H new ATOM 0 HA ALA A1931 0.871 3.161 10.124 1.00 0.65 H new ATOM 0 HB1 ALA A1931 0.611 5.565 9.891 1.00 0.62 H new ATOM 0 HB2 ALA A1931 2.161 5.009 9.216 1.00 0.62 H new ATOM 0 HB3 ALA A1931 0.815 5.428 8.129 1.00 0.62 H new ATOM 732 N GLU A1932 -1.590 3.789 10.021 1.00 0.53 N ATOM 733 CA GLU A1932 -3.039 3.793 10.053 1.00 0.58 C ATOM 734 C GLU A1932 -3.573 4.760 8.997 1.00 0.48 C ATOM 735 O GLU A1932 -2.996 5.839 8.788 1.00 0.49 O ATOM 736 CB GLU A1932 -3.560 4.284 11.427 1.00 0.84 C ATOM 737 CG GLU A1932 -2.814 3.805 12.673 1.00 0.82 C ATOM 738 CD GLU A1932 -1.496 4.543 12.874 1.00 1.32 C ATOM 739 OE1 GLU A1932 -1.505 5.685 13.370 1.00 2.07 O ATOM 740 OE2 GLU A1932 -0.444 4.031 12.483 1.00 1.72 O ATOM 0 H GLU A1932 -1.165 4.048 10.911 1.00 0.53 H new ATOM 0 HA GLU A1932 -3.377 2.774 9.866 1.00 0.58 H new ATOM 0 HB2 GLU A1932 -3.545 5.374 11.423 1.00 0.84 H new ATOM 0 HB3 GLU A1932 -4.603 3.980 11.521 1.00 0.84 H new ATOM 0 HG2 GLU A1932 -3.446 3.948 13.550 1.00 0.82 H new ATOM 0 HG3 GLU A1932 -2.621 2.736 12.590 1.00 0.82 H new ATOM 747 N ALA A1933 -4.644 4.395 8.332 1.00 0.51 N ATOM 748 CA ALA A1933 -5.272 5.299 7.395 1.00 0.57 C ATOM 749 C ALA A1933 -6.076 6.319 8.165 1.00 0.59 C ATOM 750 O ALA A1933 -7.249 6.105 8.502 1.00 0.77 O ATOM 751 CB ALA A1933 -6.136 4.577 6.379 1.00 0.74 C ATOM 0 H ALA A1933 -5.097 3.485 8.421 1.00 0.51 H new ATOM 0 HA ALA A1933 -4.490 5.798 6.823 1.00 0.57 H new ATOM 0 HB1 ALA A1933 -6.583 5.303 5.700 1.00 0.74 H new ATOM 0 HB2 ALA A1933 -5.522 3.879 5.810 1.00 0.74 H new ATOM 0 HB3 ALA A1933 -6.924 4.030 6.895 1.00 0.74 H new ATOM 757 N LYS A1934 -5.427 7.412 8.458 1.00 0.62 N ATOM 758 CA LYS A1934 -5.976 8.477 9.272 1.00 0.76 C ATOM 759 C LYS A1934 -6.590 9.554 8.407 1.00 0.88 C ATOM 760 O LYS A1934 -6.660 10.729 8.765 1.00 1.28 O ATOM 761 CB LYS A1934 -4.883 8.999 10.201 1.00 0.98 C ATOM 762 CG LYS A1934 -4.587 8.013 11.326 1.00 1.65 C ATOM 763 CD LYS A1934 -3.202 8.170 11.923 1.00 2.13 C ATOM 764 CE LYS A1934 -2.138 7.817 10.897 1.00 2.78 C ATOM 765 NZ LYS A1934 -0.824 7.563 11.509 1.00 3.10 N ATOM 0 H LYS A1934 -4.478 7.597 8.133 1.00 0.62 H new ATOM 0 HA LYS A1934 -6.789 8.100 9.892 1.00 0.76 H new ATOM 0 HB2 LYS A1934 -3.974 9.182 9.628 1.00 0.98 H new ATOM 0 HB3 LYS A1934 -5.191 9.955 10.625 1.00 0.98 H new ATOM 0 HG2 LYS A1934 -5.329 8.140 12.114 1.00 1.65 H new ATOM 0 HG3 LYS A1934 -4.696 6.997 10.946 1.00 1.65 H new ATOM 0 HD2 LYS A1934 -3.061 9.195 12.264 1.00 2.13 H new ATOM 0 HD3 LYS A1934 -3.101 7.526 12.797 1.00 2.13 H new ATOM 0 HE2 LYS A1934 -2.453 6.934 10.342 1.00 2.78 H new ATOM 0 HE3 LYS A1934 -2.048 8.631 10.177 1.00 2.78 H new ATOM 0 HZ1 LYS A1934 -0.135 7.327 10.767 1.00 3.10 H new ATOM 0 HZ2 LYS A1934 -0.508 8.413 12.017 1.00 3.10 H new ATOM 0 HZ3 LYS A1934 -0.900 6.769 12.176 1.00 3.10 H new ATOM 779 N SER A1935 -7.054 9.124 7.282 1.00 0.93 N ATOM 780 CA SER A1935 -7.759 9.912 6.343 1.00 1.23 C ATOM 781 C SER A1935 -8.720 8.995 5.593 1.00 1.17 C ATOM 782 O SER A1935 -8.543 7.763 5.621 1.00 2.00 O ATOM 783 CB SER A1935 -6.790 10.629 5.405 1.00 1.67 C ATOM 784 OG SER A1935 -6.007 11.585 6.122 1.00 2.17 O ATOM 0 H SER A1935 -6.942 8.156 6.981 1.00 0.93 H new ATOM 0 HA SER A1935 -8.330 10.694 6.844 1.00 1.23 H new ATOM 0 HB2 SER A1935 -6.135 9.902 4.925 1.00 1.67 H new ATOM 0 HB3 SER A1935 -7.346 11.129 4.612 1.00 1.67 H new ATOM 0 HG SER A1935 -6.222 11.534 7.077 1.00 2.17 H new ATOM 790 N SER A1936 -9.751 9.580 4.992 1.00 0.99 N ATOM 791 CA SER A1936 -10.802 8.872 4.272 1.00 1.20 C ATOM 792 C SER A1936 -11.685 7.999 5.186 1.00 0.95 C ATOM 793 O SER A1936 -12.842 8.342 5.426 1.00 1.08 O ATOM 794 CB SER A1936 -10.247 8.103 3.074 1.00 1.80 C ATOM 795 OG SER A1936 -9.633 8.997 2.165 1.00 2.28 O ATOM 0 H SER A1936 -9.882 10.592 4.993 1.00 0.99 H new ATOM 0 HA SER A1936 -11.471 9.636 3.876 1.00 1.20 H new ATOM 0 HB2 SER A1936 -9.523 7.361 3.412 1.00 1.80 H new ATOM 0 HB3 SER A1936 -11.051 7.561 2.576 1.00 1.80 H new ATOM 0 HG SER A1936 -8.835 9.387 2.578 1.00 2.28 H new ATOM 801 N CYS A1937 -11.150 6.914 5.715 1.00 0.87 N ATOM 802 CA CYS A1937 -11.932 6.042 6.568 1.00 0.93 C ATOM 803 C CYS A1937 -12.013 6.614 7.992 1.00 1.22 C ATOM 804 O CYS A1937 -12.976 7.331 8.322 1.00 1.98 O ATOM 805 CB CYS A1937 -11.390 4.605 6.580 1.00 1.06 C ATOM 806 SG CYS A1937 -11.409 3.755 4.970 1.00 1.44 S ATOM 0 H CYS A1937 -10.185 6.618 5.570 1.00 0.87 H new ATOM 0 HA CYS A1937 -12.939 5.996 6.153 1.00 0.93 H new ATOM 0 HB2 CYS A1937 -10.365 4.623 6.951 1.00 1.06 H new ATOM 0 HB3 CYS A1937 -11.975 4.019 7.289 1.00 1.06 H new ATOM 811 N ALA A1938 -10.985 6.369 8.812 1.00 0.97 N ATOM 812 CA ALA A1938 -10.949 6.889 10.175 1.00 1.24 C ATOM 813 C ALA A1938 -9.586 6.731 10.800 1.00 1.13 C ATOM 814 O ALA A1938 -8.745 7.624 10.708 1.00 1.32 O ATOM 815 CB ALA A1938 -11.984 6.220 11.088 1.00 1.48 C ATOM 0 H ALA A1938 -10.170 5.814 8.552 1.00 0.97 H new ATOM 0 HA ALA A1938 -11.190 7.948 10.086 1.00 1.24 H new ATOM 0 HB1 ALA A1938 -11.914 6.644 12.090 1.00 1.48 H new ATOM 0 HB2 ALA A1938 -12.984 6.391 10.691 1.00 1.48 H new ATOM 0 HB3 ALA A1938 -11.790 5.148 11.133 1.00 1.48 H new ATOM 821 N ASN A1939 -9.386 5.612 11.470 1.00 0.94 N ATOM 822 CA ASN A1939 -8.195 5.381 12.178 1.00 0.94 C ATOM 823 C ASN A1939 -7.466 4.094 11.764 1.00 0.69 C ATOM 824 O ASN A1939 -6.545 4.123 10.983 1.00 0.89 O ATOM 825 CB ASN A1939 -8.442 5.477 13.684 1.00 1.19 C ATOM 826 CG ASN A1939 -7.193 5.293 14.486 1.00 1.51 C ATOM 827 OD1 ASN A1939 -6.448 6.235 14.709 1.00 2.13 O ATOM 828 ND2 ASN A1939 -6.979 4.116 14.975 1.00 2.10 N ATOM 0 H ASN A1939 -10.063 4.851 11.523 1.00 0.94 H new ATOM 0 HA ASN A1939 -7.500 6.175 11.903 1.00 0.94 H new ATOM 0 HB2 ASN A1939 -8.878 6.449 13.915 1.00 1.19 H new ATOM 0 HB3 ASN A1939 -9.172 4.722 13.977 1.00 1.19 H new ATOM 0 HD21 ASN A1939 -6.166 3.950 15.569 1.00 2.10 H new ATOM 0 HD22 ASN A1939 -7.623 3.353 14.767 1.00 2.10 H new ATOM 835 N GLY A1940 -7.971 2.956 12.243 1.00 0.57 N ATOM 836 CA GLY A1940 -7.281 1.664 12.115 1.00 0.70 C ATOM 837 C GLY A1940 -7.377 1.002 10.754 1.00 0.61 C ATOM 838 O GLY A1940 -7.002 -0.168 10.592 1.00 0.79 O ATOM 0 H GLY A1940 -8.866 2.900 12.729 1.00 0.57 H new ATOM 0 HA2 GLY A1940 -6.228 1.810 12.355 1.00 0.70 H new ATOM 0 HA3 GLY A1940 -7.686 0.980 12.861 1.00 0.70 H new ATOM 842 N ALA A1941 -7.862 1.719 9.794 1.00 0.47 N ATOM 843 CA ALA A1941 -7.979 1.216 8.456 1.00 0.46 C ATOM 844 C ALA A1941 -6.637 1.361 7.751 1.00 0.42 C ATOM 845 O ALA A1941 -5.680 1.856 8.343 1.00 0.62 O ATOM 846 CB ALA A1941 -9.051 1.994 7.720 1.00 0.52 C ATOM 0 H ALA A1941 -8.192 2.677 9.912 1.00 0.47 H new ATOM 0 HA ALA A1941 -8.259 0.163 8.473 1.00 0.46 H new ATOM 0 HB1 ALA A1941 -9.142 1.614 6.702 1.00 0.52 H new ATOM 0 HB2 ALA A1941 -10.004 1.879 8.237 1.00 0.52 H new ATOM 0 HB3 ALA A1941 -8.779 3.049 7.690 1.00 0.52 H new ATOM 852 N ALA A1942 -6.551 0.920 6.525 1.00 0.36 N ATOM 853 CA ALA A1942 -5.344 1.102 5.757 1.00 0.38 C ATOM 854 C ALA A1942 -5.685 1.413 4.322 1.00 0.40 C ATOM 855 O ALA A1942 -5.298 2.444 3.805 1.00 0.49 O ATOM 856 CB ALA A1942 -4.455 -0.109 5.838 1.00 0.44 C ATOM 0 H ALA A1942 -7.301 0.432 6.035 1.00 0.36 H new ATOM 0 HA ALA A1942 -4.796 1.943 6.181 1.00 0.38 H new ATOM 0 HB1 ALA A1942 -3.554 0.061 5.248 1.00 0.44 H new ATOM 0 HB2 ALA A1942 -4.180 -0.290 6.877 1.00 0.44 H new ATOM 0 HB3 ALA A1942 -4.986 -0.977 5.447 1.00 0.44 H new ATOM 862 N VAL A1943 -6.432 0.525 3.689 1.00 0.41 N ATOM 863 CA VAL A1943 -6.829 0.719 2.304 1.00 0.42 C ATOM 864 C VAL A1943 -8.216 1.315 2.256 1.00 0.39 C ATOM 865 O VAL A1943 -9.187 0.681 2.711 1.00 0.43 O ATOM 866 CB VAL A1943 -6.844 -0.619 1.513 1.00 0.52 C ATOM 867 CG1 VAL A1943 -7.234 -0.401 0.058 1.00 0.73 C ATOM 868 CG2 VAL A1943 -5.508 -1.300 1.590 1.00 0.75 C ATOM 0 H VAL A1943 -6.776 -0.337 4.111 1.00 0.41 H new ATOM 0 HA VAL A1943 -6.100 1.387 1.845 1.00 0.42 H new ATOM 0 HB VAL A1943 -7.594 -1.261 1.975 1.00 0.52 H new ATOM 0 HG11 VAL A1943 -7.234 -1.357 -0.466 1.00 0.73 H new ATOM 0 HG12 VAL A1943 -8.230 0.039 0.010 1.00 0.73 H new ATOM 0 HG13 VAL A1943 -6.517 0.271 -0.414 1.00 0.73 H new ATOM 0 HG21 VAL A1943 -5.543 -2.234 1.029 1.00 0.75 H new ATOM 0 HG22 VAL A1943 -4.743 -0.650 1.165 1.00 0.75 H new ATOM 0 HG23 VAL A1943 -5.267 -1.511 2.632 1.00 0.75 H new ATOM 878 N CYS A1944 -8.326 2.499 1.719 1.00 0.41 N ATOM 879 CA CYS A1944 -9.595 3.138 1.604 1.00 0.49 C ATOM 880 C CYS A1944 -9.863 3.574 0.161 1.00 0.47 C ATOM 881 O CYS A1944 -9.053 4.236 -0.477 1.00 0.54 O ATOM 882 CB CYS A1944 -9.674 4.322 2.563 1.00 0.70 C ATOM 883 SG CYS A1944 -9.493 3.883 4.328 1.00 1.15 S ATOM 0 H CYS A1944 -7.542 3.039 1.353 1.00 0.41 H new ATOM 0 HA CYS A1944 -10.370 2.422 1.877 1.00 0.49 H new ATOM 0 HB2 CYS A1944 -8.897 5.039 2.299 1.00 0.70 H new ATOM 0 HB3 CYS A1944 -10.632 4.823 2.423 1.00 0.70 H new ATOM 888 N ILE A1945 -10.962 3.158 -0.360 1.00 0.46 N ATOM 889 CA ILE A1945 -11.388 3.563 -1.669 1.00 0.49 C ATOM 890 C ILE A1945 -12.503 4.556 -1.438 1.00 0.49 C ATOM 891 O ILE A1945 -13.591 4.178 -1.015 1.00 0.54 O ATOM 892 CB ILE A1945 -11.927 2.355 -2.497 1.00 0.56 C ATOM 893 CG1 ILE A1945 -10.892 1.206 -2.559 1.00 0.54 C ATOM 894 CG2 ILE A1945 -12.326 2.794 -3.903 1.00 0.68 C ATOM 895 CD1 ILE A1945 -9.565 1.573 -3.203 1.00 0.56 C ATOM 0 H ILE A1945 -11.604 2.519 0.109 1.00 0.46 H new ATOM 0 HA ILE A1945 -10.557 3.985 -2.234 1.00 0.49 H new ATOM 0 HB ILE A1945 -12.815 1.978 -1.989 1.00 0.56 H new ATOM 0 HG12 ILE A1945 -10.702 0.853 -1.545 1.00 0.54 H new ATOM 0 HG13 ILE A1945 -11.328 0.373 -3.110 1.00 0.54 H new ATOM 0 HG21 ILE A1945 -12.698 1.935 -4.461 1.00 0.68 H new ATOM 0 HG22 ILE A1945 -13.107 3.552 -3.840 1.00 0.68 H new ATOM 0 HG23 ILE A1945 -11.458 3.210 -4.414 1.00 0.68 H new ATOM 0 HD11 ILE A1945 -8.907 0.704 -3.200 1.00 0.56 H new ATOM 0 HD12 ILE A1945 -9.736 1.895 -4.230 1.00 0.56 H new ATOM 0 HD13 ILE A1945 -9.100 2.383 -2.641 1.00 0.56 H new ATOM 907 N THR A1946 -12.240 5.811 -1.635 1.00 0.48 N ATOM 908 CA THR A1946 -13.221 6.800 -1.316 1.00 0.51 C ATOM 909 C THR A1946 -14.160 6.993 -2.502 1.00 0.53 C ATOM 910 O THR A1946 -13.822 7.680 -3.472 1.00 0.61 O ATOM 911 CB THR A1946 -12.560 8.137 -0.938 1.00 0.61 C ATOM 912 OG1 THR A1946 -11.185 7.901 -0.543 1.00 0.91 O ATOM 913 CG2 THR A1946 -13.293 8.746 0.252 1.00 0.79 C ATOM 0 H THR A1946 -11.363 6.172 -2.011 1.00 0.48 H new ATOM 0 HA THR A1946 -13.792 6.454 -0.454 1.00 0.51 H new ATOM 0 HB THR A1946 -12.600 8.809 -1.796 1.00 0.61 H new ATOM 0 HG1 THR A1946 -11.053 8.203 0.380 1.00 0.91 H new ATOM 0 HG21 THR A1946 -12.826 9.693 0.521 1.00 0.79 H new ATOM 0 HG22 THR A1946 -14.336 8.918 -0.013 1.00 0.79 H new ATOM 0 HG23 THR A1946 -13.242 8.063 1.100 1.00 0.79 H new ATOM 921 N ASP A1947 -15.300 6.337 -2.448 1.00 0.58 N ATOM 922 CA ASP A1947 -16.272 6.430 -3.507 1.00 0.74 C ATOM 923 C ASP A1947 -17.223 7.541 -3.129 1.00 0.78 C ATOM 924 O ASP A1947 -18.171 7.343 -2.338 1.00 0.77 O ATOM 925 CB ASP A1947 -17.028 5.098 -3.668 1.00 0.91 C ATOM 926 CG ASP A1947 -17.853 5.011 -4.941 1.00 1.21 C ATOM 927 OD1 ASP A1947 -18.801 5.814 -5.097 1.00 1.24 O ATOM 928 OD2 ASP A1947 -17.561 4.178 -5.817 1.00 1.94 O ATOM 0 H ASP A1947 -15.574 5.731 -1.675 1.00 0.58 H new ATOM 0 HA ASP A1947 -15.789 6.640 -4.461 1.00 0.74 H new ATOM 0 HB2 ASP A1947 -16.309 4.279 -3.656 1.00 0.91 H new ATOM 0 HB3 ASP A1947 -17.685 4.958 -2.810 1.00 0.91 H new ATOM 933 N GLY A1948 -16.944 8.714 -3.639 1.00 0.91 N ATOM 934 CA GLY A1948 -17.684 9.874 -3.250 1.00 1.03 C ATOM 935 C GLY A1948 -17.366 10.205 -1.806 1.00 1.03 C ATOM 936 O GLY A1948 -16.189 10.226 -1.423 1.00 1.07 O ATOM 0 H GLY A1948 -16.208 8.885 -4.325 1.00 0.91 H new ATOM 0 HA2 GLY A1948 -17.429 10.716 -3.894 1.00 1.03 H new ATOM 0 HA3 GLY A1948 -18.753 9.695 -3.368 1.00 1.03 H new ATOM 940 N PRO A1949 -18.371 10.430 -0.967 1.00 1.06 N ATOM 941 CA PRO A1949 -18.164 10.693 0.441 1.00 1.15 C ATOM 942 C PRO A1949 -18.187 9.395 1.273 1.00 1.00 C ATOM 943 O PRO A1949 -18.013 9.423 2.500 1.00 1.12 O ATOM 944 CB PRO A1949 -19.369 11.586 0.811 1.00 1.37 C ATOM 945 CG PRO A1949 -20.280 11.583 -0.393 1.00 1.27 C ATOM 946 CD PRO A1949 -19.786 10.504 -1.313 1.00 1.09 C ATOM 0 HA PRO A1949 -17.196 11.153 0.641 1.00 1.15 H new ATOM 0 HB2 PRO A1949 -19.884 11.200 1.690 1.00 1.37 H new ATOM 0 HB3 PRO A1949 -19.044 12.598 1.051 1.00 1.37 H new ATOM 0 HG2 PRO A1949 -21.312 11.394 -0.096 1.00 1.27 H new ATOM 0 HG3 PRO A1949 -20.264 12.552 -0.891 1.00 1.27 H new ATOM 0 HD2 PRO A1949 -20.297 9.557 -1.142 1.00 1.09 H new ATOM 0 HD3 PRO A1949 -19.936 10.762 -2.361 1.00 1.09 H new ATOM 954 N LYS A1950 -18.401 8.269 0.608 1.00 0.86 N ATOM 955 CA LYS A1950 -18.504 6.997 1.282 1.00 0.83 C ATOM 956 C LYS A1950 -17.247 6.192 1.024 1.00 0.66 C ATOM 957 O LYS A1950 -16.965 5.784 -0.102 1.00 0.71 O ATOM 958 CB LYS A1950 -19.748 6.243 0.808 1.00 0.95 C ATOM 959 CG LYS A1950 -20.057 4.983 1.599 1.00 1.31 C ATOM 960 CD LYS A1950 -21.335 4.334 1.104 1.00 1.91 C ATOM 961 CE LYS A1950 -21.734 3.125 1.941 1.00 2.18 C ATOM 962 NZ LYS A1950 -20.725 2.051 1.897 1.00 2.52 N ATOM 0 H LYS A1950 -18.506 8.218 -0.405 1.00 0.86 H new ATOM 0 HA LYS A1950 -18.604 7.159 2.355 1.00 0.83 H new ATOM 0 HB2 LYS A1950 -20.607 6.912 0.863 1.00 0.95 H new ATOM 0 HB3 LYS A1950 -19.619 5.976 -0.241 1.00 0.95 H new ATOM 0 HG2 LYS A1950 -19.229 4.280 1.509 1.00 1.31 H new ATOM 0 HG3 LYS A1950 -20.154 5.227 2.657 1.00 1.31 H new ATOM 0 HD2 LYS A1950 -22.142 5.067 1.121 1.00 1.91 H new ATOM 0 HD3 LYS A1950 -21.205 4.027 0.066 1.00 1.91 H new ATOM 0 HE2 LYS A1950 -21.884 3.436 2.975 1.00 2.18 H new ATOM 0 HE3 LYS A1950 -22.688 2.738 1.583 1.00 2.18 H new ATOM 0 HZ1 LYS A1950 -21.087 1.214 2.397 1.00 2.52 H new ATOM 0 HZ2 LYS A1950 -20.525 1.803 0.907 1.00 2.52 H new ATOM 0 HZ3 LYS A1950 -19.851 2.377 2.356 1.00 2.52 H new ATOM 976 N THR A1951 -16.495 5.986 2.042 1.00 0.68 N ATOM 977 CA THR A1951 -15.236 5.339 1.906 1.00 0.60 C ATOM 978 C THR A1951 -15.362 3.815 2.077 1.00 0.57 C ATOM 979 O THR A1951 -15.851 3.323 3.103 1.00 0.72 O ATOM 980 CB THR A1951 -14.264 5.902 2.935 1.00 0.73 C ATOM 981 OG1 THR A1951 -14.455 7.327 3.019 1.00 1.05 O ATOM 982 CG2 THR A1951 -12.852 5.632 2.489 1.00 1.07 C ATOM 0 H THR A1951 -16.732 6.260 2.995 1.00 0.68 H new ATOM 0 HA THR A1951 -14.861 5.528 0.900 1.00 0.60 H new ATOM 0 HB THR A1951 -14.442 5.435 3.904 1.00 0.73 H new ATOM 0 HG1 THR A1951 -13.939 7.682 3.772 1.00 1.05 H new ATOM 0 HG21 THR A1951 -12.155 6.034 3.224 1.00 1.07 H new ATOM 0 HG22 THR A1951 -12.700 4.557 2.395 1.00 1.07 H new ATOM 0 HG23 THR A1951 -12.678 6.109 1.525 1.00 1.07 H new ATOM 990 N LEU A1952 -14.947 3.096 1.068 1.00 0.52 N ATOM 991 CA LEU A1952 -14.930 1.651 1.067 1.00 0.52 C ATOM 992 C LEU A1952 -13.593 1.191 1.616 1.00 0.47 C ATOM 993 O LEU A1952 -12.545 1.636 1.159 1.00 0.52 O ATOM 994 CB LEU A1952 -15.108 1.139 -0.377 1.00 0.57 C ATOM 995 CG LEU A1952 -15.007 -0.379 -0.601 1.00 0.63 C ATOM 996 CD1 LEU A1952 -16.111 -1.121 0.126 1.00 1.14 C ATOM 997 CD2 LEU A1952 -15.034 -0.699 -2.087 1.00 1.15 C ATOM 0 H LEU A1952 -14.602 3.506 0.200 1.00 0.52 H new ATOM 0 HA LEU A1952 -15.740 1.259 1.683 1.00 0.52 H new ATOM 0 HB2 LEU A1952 -16.083 1.469 -0.735 1.00 0.57 H new ATOM 0 HB3 LEU A1952 -14.358 1.624 -1.002 1.00 0.57 H new ATOM 0 HG LEU A1952 -14.056 -0.715 -0.188 1.00 0.63 H new ATOM 0 HD11 LEU A1952 -16.010 -2.191 -0.054 1.00 1.14 H new ATOM 0 HD12 LEU A1952 -16.038 -0.924 1.196 1.00 1.14 H new ATOM 0 HD13 LEU A1952 -17.080 -0.782 -0.240 1.00 1.14 H new ATOM 0 HD21 LEU A1952 -14.962 -1.777 -2.228 1.00 1.15 H new ATOM 0 HD22 LEU A1952 -15.967 -0.338 -2.520 1.00 1.15 H new ATOM 0 HD23 LEU A1952 -14.193 -0.211 -2.580 1.00 1.15 H new ATOM 1009 N ASN A1953 -13.615 0.343 2.587 1.00 0.48 N ATOM 1010 CA ASN A1953 -12.394 -0.156 3.168 1.00 0.45 C ATOM 1011 C ASN A1953 -12.037 -1.500 2.564 1.00 0.46 C ATOM 1012 O ASN A1953 -12.842 -2.426 2.567 1.00 0.64 O ATOM 1013 CB ASN A1953 -12.520 -0.257 4.693 1.00 0.59 C ATOM 1014 CG ASN A1953 -11.322 -0.915 5.334 1.00 1.20 C ATOM 1015 OD1 ASN A1953 -11.295 -2.121 5.534 1.00 1.86 O ATOM 1016 ND2 ASN A1953 -10.334 -0.150 5.653 1.00 1.93 N ATOM 0 H ASN A1953 -14.468 -0.028 3.005 1.00 0.48 H new ATOM 0 HA ASN A1953 -11.591 0.546 2.945 1.00 0.45 H new ATOM 0 HB2 ASN A1953 -12.647 0.742 5.110 1.00 0.59 H new ATOM 0 HB3 ASN A1953 -13.417 -0.823 4.943 1.00 0.59 H new ATOM 0 HD21 ASN A1953 -9.500 -0.548 6.085 1.00 1.93 H new ATOM 0 HD22 ASN A1953 -10.387 0.853 5.473 1.00 1.93 H new ATOM 1023 N ALA A1954 -10.844 -1.614 2.041 1.00 0.43 N ATOM 1024 CA ALA A1954 -10.422 -2.855 1.423 1.00 0.58 C ATOM 1025 C ALA A1954 -9.326 -3.542 2.232 1.00 0.70 C ATOM 1026 O ALA A1954 -8.750 -4.535 1.789 1.00 1.17 O ATOM 1027 CB ALA A1954 -9.986 -2.622 -0.015 1.00 0.69 C ATOM 0 H ALA A1954 -10.147 -0.870 2.028 1.00 0.43 H new ATOM 0 HA ALA A1954 -11.280 -3.527 1.410 1.00 0.58 H new ATOM 0 HB1 ALA A1954 -9.674 -3.568 -0.458 1.00 0.69 H new ATOM 0 HB2 ALA A1954 -10.819 -2.211 -0.586 1.00 0.69 H new ATOM 0 HB3 ALA A1954 -9.152 -1.920 -0.033 1.00 0.69 H new ATOM 1033 N GLY A1955 -9.074 -3.039 3.422 1.00 0.42 N ATOM 1034 CA GLY A1955 -8.068 -3.622 4.277 1.00 0.51 C ATOM 1035 C GLY A1955 -7.787 -2.759 5.484 1.00 0.43 C ATOM 1036 O GLY A1955 -7.791 -1.513 5.383 1.00 0.47 O ATOM 0 H GLY A1955 -9.552 -2.229 3.817 1.00 0.42 H new ATOM 0 HA2 GLY A1955 -8.397 -4.608 4.604 1.00 0.51 H new ATOM 0 HA3 GLY A1955 -7.148 -3.765 3.710 1.00 0.51 H new ATOM 1040 N LYS A1956 -7.568 -3.392 6.617 1.00 0.43 N ATOM 1041 CA LYS A1956 -7.272 -2.691 7.860 1.00 0.45 C ATOM 1042 C LYS A1956 -5.758 -2.526 7.978 1.00 0.38 C ATOM 1043 O LYS A1956 -5.013 -3.096 7.168 1.00 0.40 O ATOM 1044 CB LYS A1956 -7.796 -3.499 9.062 1.00 0.61 C ATOM 1045 CG LYS A1956 -7.014 -4.781 9.321 1.00 0.70 C ATOM 1046 CD LYS A1956 -7.593 -5.594 10.458 1.00 0.97 C ATOM 1047 CE LYS A1956 -6.667 -6.740 10.820 1.00 1.54 C ATOM 1048 NZ LYS A1956 -6.392 -7.629 9.668 1.00 2.43 N ATOM 0 H LYS A1956 -7.589 -4.408 6.708 1.00 0.43 H new ATOM 0 HA LYS A1956 -7.759 -1.716 7.855 1.00 0.45 H new ATOM 0 HB2 LYS A1956 -7.758 -2.874 9.954 1.00 0.61 H new ATOM 0 HB3 LYS A1956 -8.843 -3.750 8.892 1.00 0.61 H new ATOM 0 HG2 LYS A1956 -7.004 -5.386 8.414 1.00 0.70 H new ATOM 0 HG3 LYS A1956 -5.978 -4.531 9.549 1.00 0.70 H new ATOM 0 HD2 LYS A1956 -7.747 -4.955 11.328 1.00 0.97 H new ATOM 0 HD3 LYS A1956 -8.570 -5.985 10.172 1.00 0.97 H new ATOM 0 HE2 LYS A1956 -5.727 -6.338 11.198 1.00 1.54 H new ATOM 0 HE3 LYS A1956 -7.112 -7.322 11.627 1.00 1.54 H new ATOM 0 HZ1 LYS A1956 -5.797 -8.424 9.977 1.00 2.43 H new ATOM 0 HZ2 LYS A1956 -7.289 -7.995 9.290 1.00 2.43 H new ATOM 0 HZ3 LYS A1956 -5.897 -7.093 8.927 1.00 2.43 H new ATOM 1062 N LEU A1957 -5.310 -1.767 8.965 1.00 0.42 N ATOM 1063 CA LEU A1957 -3.888 -1.569 9.203 1.00 0.45 C ATOM 1064 C LEU A1957 -3.213 -2.896 9.565 1.00 0.45 C ATOM 1065 O LEU A1957 -3.549 -3.532 10.557 1.00 0.53 O ATOM 1066 CB LEU A1957 -3.665 -0.438 10.275 1.00 0.57 C ATOM 1067 CG LEU A1957 -2.220 -0.127 10.813 1.00 0.77 C ATOM 1068 CD1 LEU A1957 -1.737 -1.147 11.840 1.00 1.24 C ATOM 1069 CD2 LEU A1957 -1.206 -0.005 9.680 1.00 1.30 C ATOM 0 H LEU A1957 -5.916 -1.274 9.620 1.00 0.42 H new ATOM 0 HA LEU A1957 -3.408 -1.224 8.287 1.00 0.45 H new ATOM 0 HB2 LEU A1957 -4.059 0.487 9.854 1.00 0.57 H new ATOM 0 HB3 LEU A1957 -4.284 -0.685 11.138 1.00 0.57 H new ATOM 0 HG LEU A1957 -2.297 0.836 11.317 1.00 0.77 H new ATOM 0 HD11 LEU A1957 -0.735 -0.880 12.174 1.00 1.24 H new ATOM 0 HD12 LEU A1957 -2.415 -1.153 12.694 1.00 1.24 H new ATOM 0 HD13 LEU A1957 -1.716 -2.138 11.387 1.00 1.24 H new ATOM 0 HD21 LEU A1957 -0.221 0.210 10.095 1.00 1.30 H new ATOM 0 HD22 LEU A1957 -1.169 -0.941 9.123 1.00 1.30 H new ATOM 0 HD23 LEU A1957 -1.503 0.803 9.012 1.00 1.30 H new ATOM 1081 N SER A1958 -2.320 -3.309 8.712 1.00 0.56 N ATOM 1082 CA SER A1958 -1.519 -4.485 8.889 1.00 0.67 C ATOM 1083 C SER A1958 -0.075 -4.033 8.712 1.00 0.65 C ATOM 1084 O SER A1958 0.386 -3.779 7.596 1.00 0.84 O ATOM 1085 CB SER A1958 -1.926 -5.538 7.828 1.00 0.96 C ATOM 1086 OG SER A1958 -1.216 -6.758 7.950 1.00 1.62 O ATOM 0 H SER A1958 -2.123 -2.816 7.841 1.00 0.56 H new ATOM 0 HA SER A1958 -1.653 -4.947 9.867 1.00 0.67 H new ATOM 0 HB2 SER A1958 -2.994 -5.737 7.914 1.00 0.96 H new ATOM 0 HB3 SER A1958 -1.758 -5.125 6.833 1.00 0.96 H new ATOM 0 HG SER A1958 -1.516 -7.382 7.256 1.00 1.62 H new ATOM 1092 N LYS A1959 0.614 -3.879 9.791 1.00 0.59 N ATOM 1093 CA LYS A1959 1.912 -3.302 9.749 1.00 0.71 C ATOM 1094 C LYS A1959 3.005 -4.356 9.866 1.00 0.76 C ATOM 1095 O LYS A1959 3.496 -4.671 10.935 1.00 1.04 O ATOM 1096 CB LYS A1959 1.989 -2.158 10.775 1.00 0.86 C ATOM 1097 CG LYS A1959 3.288 -1.400 10.875 1.00 0.96 C ATOM 1098 CD LYS A1959 3.053 -0.005 11.471 1.00 1.10 C ATOM 1099 CE LYS A1959 2.274 -0.034 12.789 1.00 0.98 C ATOM 1100 NZ LYS A1959 3.021 -0.669 13.892 1.00 1.48 N ATOM 0 H LYS A1959 0.295 -4.148 10.722 1.00 0.59 H new ATOM 0 HA LYS A1959 2.096 -2.854 8.772 1.00 0.71 H new ATOM 0 HB2 LYS A1959 1.200 -1.443 10.542 1.00 0.86 H new ATOM 0 HB3 LYS A1959 1.764 -2.572 11.758 1.00 0.86 H new ATOM 0 HG2 LYS A1959 3.992 -1.954 11.497 1.00 0.96 H new ATOM 0 HG3 LYS A1959 3.739 -1.308 9.887 1.00 0.96 H new ATOM 0 HD2 LYS A1959 4.016 0.479 11.636 1.00 1.10 H new ATOM 0 HD3 LYS A1959 2.510 0.604 10.749 1.00 1.10 H new ATOM 0 HE2 LYS A1959 2.016 0.986 13.074 1.00 0.98 H new ATOM 0 HE3 LYS A1959 1.337 -0.570 12.638 1.00 0.98 H new ATOM 0 HZ1 LYS A1959 2.411 -0.734 14.732 1.00 1.48 H new ATOM 0 HZ2 LYS A1959 3.319 -1.623 13.605 1.00 1.48 H new ATOM 0 HZ3 LYS A1959 3.860 -0.097 14.117 1.00 1.48 H new ATOM 1114 N THR A1960 3.271 -4.967 8.747 1.00 0.74 N ATOM 1115 CA THR A1960 4.308 -5.944 8.589 1.00 0.81 C ATOM 1116 C THR A1960 4.776 -5.828 7.134 1.00 0.77 C ATOM 1117 O THR A1960 4.003 -5.372 6.294 1.00 1.05 O ATOM 1118 CB THR A1960 3.783 -7.385 8.922 1.00 0.92 C ATOM 1119 OG1 THR A1960 4.853 -8.343 8.873 1.00 1.63 O ATOM 1120 CG2 THR A1960 2.657 -7.813 7.975 1.00 1.27 C ATOM 0 H THR A1960 2.751 -4.791 7.887 1.00 0.74 H new ATOM 0 HA THR A1960 5.134 -5.767 9.277 1.00 0.81 H new ATOM 0 HB THR A1960 3.380 -7.352 9.934 1.00 0.92 H new ATOM 0 HG1 THR A1960 4.504 -9.234 9.085 1.00 1.63 H new ATOM 0 HG21 THR A1960 2.321 -8.816 8.239 1.00 1.27 H new ATOM 0 HG22 THR A1960 1.823 -7.116 8.063 1.00 1.27 H new ATOM 0 HG23 THR A1960 3.024 -7.812 6.949 1.00 1.27 H new ATOM 1128 N LEU A1961 6.003 -6.175 6.829 1.00 0.55 N ATOM 1129 CA LEU A1961 6.491 -6.000 5.472 1.00 0.51 C ATOM 1130 C LEU A1961 7.157 -7.294 4.974 1.00 0.51 C ATOM 1131 O LEU A1961 7.751 -8.031 5.769 1.00 0.58 O ATOM 1132 CB LEU A1961 7.463 -4.817 5.452 1.00 0.62 C ATOM 1133 CG LEU A1961 7.823 -4.245 4.090 1.00 0.71 C ATOM 1134 CD1 LEU A1961 6.570 -3.737 3.379 1.00 1.35 C ATOM 1135 CD2 LEU A1961 8.835 -3.119 4.248 1.00 1.32 C ATOM 0 H LEU A1961 6.675 -6.573 7.484 1.00 0.55 H new ATOM 0 HA LEU A1961 5.663 -5.786 4.796 1.00 0.51 H new ATOM 0 HB2 LEU A1961 7.034 -4.016 6.054 1.00 0.62 H new ATOM 0 HB3 LEU A1961 8.385 -5.127 5.944 1.00 0.62 H new ATOM 0 HG LEU A1961 8.268 -5.034 3.484 1.00 0.71 H new ATOM 0 HD11 LEU A1961 6.844 -3.330 2.405 1.00 1.35 H new ATOM 0 HD12 LEU A1961 5.869 -4.561 3.244 1.00 1.35 H new ATOM 0 HD13 LEU A1961 6.102 -2.957 3.979 1.00 1.35 H new ATOM 0 HD21 LEU A1961 9.087 -2.716 3.267 1.00 1.32 H new ATOM 0 HD22 LEU A1961 8.407 -2.330 4.866 1.00 1.32 H new ATOM 0 HD23 LEU A1961 9.737 -3.504 4.724 1.00 1.32 H new ATOM 1147 N THR A1962 7.041 -7.582 3.674 1.00 0.51 N ATOM 1148 CA THR A1962 7.579 -8.826 3.100 1.00 0.58 C ATOM 1149 C THR A1962 8.349 -8.531 1.798 1.00 0.51 C ATOM 1150 O THR A1962 8.185 -7.466 1.207 1.00 0.72 O ATOM 1151 CB THR A1962 6.429 -9.798 2.713 1.00 0.72 C ATOM 1152 OG1 THR A1962 5.631 -9.208 1.727 1.00 1.19 O ATOM 1153 CG2 THR A1962 5.508 -10.107 3.834 1.00 0.61 C ATOM 0 H THR A1962 6.580 -6.973 2.997 1.00 0.51 H new ATOM 0 HA THR A1962 8.229 -9.268 3.855 1.00 0.58 H new ATOM 0 HB THR A1962 6.922 -10.713 2.386 1.00 0.72 H new ATOM 0 HG1 THR A1962 5.510 -8.257 1.930 1.00 1.19 H new ATOM 0 HG21 THR A1962 4.732 -10.790 3.489 1.00 0.61 H new ATOM 0 HG22 THR A1962 6.067 -10.572 4.646 1.00 0.61 H new ATOM 0 HG23 THR A1962 5.048 -9.186 4.191 1.00 0.61 H new ATOM 1161 N TYR A1963 9.133 -9.483 1.348 1.00 0.47 N ATOM 1162 CA TYR A1963 9.822 -9.407 0.068 1.00 0.48 C ATOM 1163 C TYR A1963 9.534 -10.699 -0.705 1.00 0.55 C ATOM 1164 O TYR A1963 9.908 -11.792 -0.279 1.00 0.75 O ATOM 1165 CB TYR A1963 11.360 -9.148 0.232 1.00 0.62 C ATOM 1166 CG TYR A1963 12.127 -10.198 1.040 1.00 0.78 C ATOM 1167 CD1 TYR A1963 12.040 -10.226 2.416 1.00 0.78 C ATOM 1168 CD2 TYR A1963 12.918 -11.158 0.418 1.00 1.03 C ATOM 1169 CE1 TYR A1963 12.706 -11.172 3.165 1.00 1.01 C ATOM 1170 CE2 TYR A1963 13.587 -12.116 1.159 1.00 1.27 C ATOM 1171 CZ TYR A1963 13.476 -12.115 2.537 1.00 1.25 C ATOM 1172 OH TYR A1963 14.134 -13.077 3.292 1.00 1.52 O ATOM 0 H TYR A1963 9.316 -10.345 1.862 1.00 0.47 H new ATOM 0 HA TYR A1963 9.448 -8.552 -0.494 1.00 0.48 H new ATOM 0 HB2 TYR A1963 11.807 -9.082 -0.760 1.00 0.62 H new ATOM 0 HB3 TYR A1963 11.498 -8.177 0.709 1.00 0.62 H new ATOM 0 HD1 TYR A1963 11.434 -9.487 2.920 1.00 0.78 H new ATOM 0 HD2 TYR A1963 13.011 -11.156 -0.658 1.00 1.03 H new ATOM 0 HE1 TYR A1963 12.621 -11.170 4.242 1.00 1.01 H new ATOM 0 HE2 TYR A1963 14.193 -12.860 0.664 1.00 1.27 H new ATOM 0 HH TYR A1963 14.637 -13.672 2.697 1.00 1.52 H new ATOM 1182 N GLU A1964 8.860 -10.587 -1.820 1.00 0.54 N ATOM 1183 CA GLU A1964 8.460 -11.759 -2.576 1.00 0.70 C ATOM 1184 C GLU A1964 8.681 -11.471 -4.036 1.00 0.80 C ATOM 1185 O GLU A1964 8.082 -10.540 -4.568 1.00 0.78 O ATOM 1186 CB GLU A1964 6.997 -12.133 -2.211 1.00 0.87 C ATOM 1187 CG GLU A1964 6.372 -13.324 -2.944 1.00 1.25 C ATOM 1188 CD GLU A1964 5.666 -12.923 -4.211 1.00 1.87 C ATOM 1189 OE1 GLU A1964 4.615 -12.259 -4.119 1.00 2.75 O ATOM 1190 OE2 GLU A1964 6.156 -13.211 -5.310 1.00 2.22 O ATOM 0 H GLU A1964 8.573 -9.698 -2.230 1.00 0.54 H new ATOM 0 HA GLU A1964 9.060 -12.635 -2.328 1.00 0.70 H new ATOM 0 HB2 GLU A1964 6.958 -12.337 -1.141 1.00 0.87 H new ATOM 0 HB3 GLU A1964 6.371 -11.259 -2.392 1.00 0.87 H new ATOM 0 HG2 GLU A1964 7.151 -14.048 -3.181 1.00 1.25 H new ATOM 0 HG3 GLU A1964 5.665 -13.822 -2.281 1.00 1.25 H new ATOM 1197 N ASP A1965 9.611 -12.245 -4.644 1.00 1.04 N ATOM 1198 CA ASP A1965 10.116 -12.057 -6.034 1.00 1.25 C ATOM 1199 C ASP A1965 11.102 -10.872 -6.028 1.00 1.07 C ATOM 1200 O ASP A1965 11.481 -10.314 -7.055 1.00 1.08 O ATOM 1201 CB ASP A1965 8.954 -11.867 -7.055 1.00 1.46 C ATOM 1202 CG ASP A1965 9.411 -11.742 -8.492 1.00 2.18 C ATOM 1203 OD1 ASP A1965 9.867 -12.742 -9.081 1.00 2.64 O ATOM 1204 OD2 ASP A1965 9.319 -10.635 -9.067 1.00 2.74 O ATOM 0 H ASP A1965 10.045 -13.039 -4.173 1.00 1.04 H new ATOM 0 HA ASP A1965 10.638 -12.955 -6.364 1.00 1.25 H new ATOM 0 HB2 ASP A1965 8.271 -12.713 -6.974 1.00 1.46 H new ATOM 0 HB3 ASP A1965 8.389 -10.975 -6.785 1.00 1.46 H new ATOM 1209 N GLN A1966 11.555 -10.557 -4.806 1.00 1.03 N ATOM 1210 CA GLN A1966 12.423 -9.410 -4.463 1.00 1.04 C ATOM 1211 C GLN A1966 11.709 -8.075 -4.552 1.00 0.84 C ATOM 1212 O GLN A1966 12.265 -7.036 -4.181 1.00 1.05 O ATOM 1213 CB GLN A1966 13.770 -9.365 -5.187 1.00 1.33 C ATOM 1214 CG GLN A1966 14.678 -10.534 -4.879 1.00 1.71 C ATOM 1215 CD GLN A1966 16.132 -10.203 -5.136 1.00 2.12 C ATOM 1216 OE1 GLN A1966 16.560 -9.060 -4.969 1.00 2.66 O ATOM 1217 NE2 GLN A1966 16.891 -11.174 -5.535 1.00 2.40 N ATOM 0 H GLN A1966 11.318 -11.118 -3.988 1.00 1.03 H new ATOM 0 HA GLN A1966 12.666 -9.594 -3.416 1.00 1.04 H new ATOM 0 HB2 GLN A1966 13.591 -9.331 -6.262 1.00 1.33 H new ATOM 0 HB3 GLN A1966 14.283 -8.441 -4.920 1.00 1.33 H new ATOM 0 HG2 GLN A1966 14.551 -10.827 -3.837 1.00 1.71 H new ATOM 0 HG3 GLN A1966 14.387 -11.390 -5.488 1.00 1.71 H new ATOM 0 HE21 GLN A1966 16.500 -12.108 -5.662 1.00 2.40 H new ATOM 0 HE22 GLN A1966 17.879 -11.005 -5.722 1.00 2.40 H new ATOM 1226 N VAL A1967 10.496 -8.093 -5.035 1.00 0.60 N ATOM 1227 CA VAL A1967 9.693 -6.920 -5.037 1.00 0.49 C ATOM 1228 C VAL A1967 9.027 -6.862 -3.664 1.00 0.41 C ATOM 1229 O VAL A1967 8.734 -7.920 -3.060 1.00 0.41 O ATOM 1230 CB VAL A1967 8.672 -6.900 -6.238 1.00 0.52 C ATOM 1231 CG1 VAL A1967 7.679 -8.026 -6.195 1.00 1.01 C ATOM 1232 CG2 VAL A1967 7.970 -5.568 -6.382 1.00 1.06 C ATOM 0 H VAL A1967 10.048 -8.918 -5.433 1.00 0.60 H new ATOM 0 HA VAL A1967 10.293 -6.024 -5.197 1.00 0.49 H new ATOM 0 HB VAL A1967 9.283 -7.051 -7.128 1.00 0.52 H new ATOM 0 HG11 VAL A1967 7.007 -7.951 -7.050 1.00 1.01 H new ATOM 0 HG12 VAL A1967 8.207 -8.979 -6.231 1.00 1.01 H new ATOM 0 HG13 VAL A1967 7.101 -7.966 -5.273 1.00 1.01 H new ATOM 0 HG21 VAL A1967 7.279 -5.610 -7.224 1.00 1.06 H new ATOM 0 HG22 VAL A1967 7.417 -5.348 -5.469 1.00 1.06 H new ATOM 0 HG23 VAL A1967 8.708 -4.785 -6.557 1.00 1.06 H new ATOM 1242 N LEU A1968 8.805 -5.689 -3.165 1.00 0.41 N ATOM 1243 CA LEU A1968 8.371 -5.528 -1.807 1.00 0.38 C ATOM 1244 C LEU A1968 6.878 -5.757 -1.729 1.00 0.37 C ATOM 1245 O LEU A1968 6.120 -5.184 -2.502 1.00 0.49 O ATOM 1246 CB LEU A1968 8.728 -4.113 -1.342 1.00 0.42 C ATOM 1247 CG LEU A1968 8.536 -3.804 0.132 1.00 0.43 C ATOM 1248 CD1 LEU A1968 9.490 -4.631 0.956 1.00 0.47 C ATOM 1249 CD2 LEU A1968 8.756 -2.330 0.397 1.00 0.50 C ATOM 0 H LEU A1968 8.918 -4.816 -3.681 1.00 0.41 H new ATOM 0 HA LEU A1968 8.866 -6.251 -1.159 1.00 0.38 H new ATOM 0 HB2 LEU A1968 9.772 -3.927 -1.594 1.00 0.42 H new ATOM 0 HB3 LEU A1968 8.130 -3.406 -1.917 1.00 0.42 H new ATOM 0 HG LEU A1968 7.513 -4.055 0.414 1.00 0.43 H new ATOM 0 HD11 LEU A1968 9.348 -4.405 2.013 1.00 0.47 H new ATOM 0 HD12 LEU A1968 9.298 -5.690 0.782 1.00 0.47 H new ATOM 0 HD13 LEU A1968 10.515 -4.397 0.670 1.00 0.47 H new ATOM 0 HD21 LEU A1968 8.614 -2.126 1.458 1.00 0.50 H new ATOM 0 HD22 LEU A1968 9.770 -2.056 0.107 1.00 0.50 H new ATOM 0 HD23 LEU A1968 8.042 -1.745 -0.183 1.00 0.50 H new ATOM 1261 N LYS A1969 6.462 -6.620 -0.839 1.00 0.33 N ATOM 1262 CA LYS A1969 5.048 -6.921 -0.707 1.00 0.36 C ATOM 1263 C LYS A1969 4.490 -6.449 0.597 1.00 0.34 C ATOM 1264 O LYS A1969 5.160 -6.491 1.648 1.00 0.36 O ATOM 1265 CB LYS A1969 4.705 -8.415 -0.858 1.00 0.47 C ATOM 1266 CG LYS A1969 4.950 -9.025 -2.227 1.00 0.73 C ATOM 1267 CD LYS A1969 4.256 -8.221 -3.318 1.00 1.19 C ATOM 1268 CE LYS A1969 4.068 -9.022 -4.598 1.00 1.19 C ATOM 1269 NZ LYS A1969 5.266 -9.798 -4.974 1.00 1.29 N ATOM 0 H LYS A1969 7.071 -7.127 -0.197 1.00 0.33 H new ATOM 0 HA LYS A1969 4.590 -6.380 -1.535 1.00 0.36 H new ATOM 0 HB2 LYS A1969 5.285 -8.975 -0.125 1.00 0.47 H new ATOM 0 HB3 LYS A1969 3.654 -8.552 -0.605 1.00 0.47 H new ATOM 0 HG2 LYS A1969 6.021 -9.063 -2.425 1.00 0.73 H new ATOM 0 HG3 LYS A1969 4.586 -10.052 -2.241 1.00 0.73 H new ATOM 0 HD2 LYS A1969 3.284 -7.886 -2.956 1.00 1.19 H new ATOM 0 HD3 LYS A1969 4.841 -7.327 -3.535 1.00 1.19 H new ATOM 0 HE2 LYS A1969 3.225 -9.702 -4.474 1.00 1.19 H new ATOM 0 HE3 LYS A1969 3.812 -8.343 -5.411 1.00 1.19 H new ATOM 0 HZ1 LYS A1969 5.557 -9.541 -5.939 1.00 1.29 H new ATOM 0 HZ2 LYS A1969 6.039 -9.587 -4.311 1.00 1.29 H new ATOM 0 HZ3 LYS A1969 5.047 -10.814 -4.938 1.00 1.29 H new ATOM 1283 N LEU A1970 3.273 -6.037 0.529 1.00 0.42 N ATOM 1284 CA LEU A1970 2.508 -5.631 1.659 1.00 0.49 C ATOM 1285 C LEU A1970 1.098 -6.111 1.437 1.00 0.46 C ATOM 1286 O LEU A1970 0.623 -6.121 0.299 1.00 0.57 O ATOM 1287 CB LEU A1970 2.542 -4.122 1.779 1.00 0.60 C ATOM 1288 CG LEU A1970 1.709 -3.486 2.881 1.00 0.91 C ATOM 1289 CD1 LEU A1970 2.128 -3.979 4.251 1.00 1.11 C ATOM 1290 CD2 LEU A1970 1.849 -2.002 2.801 1.00 1.75 C ATOM 0 H LEU A1970 2.761 -5.970 -0.351 1.00 0.42 H new ATOM 0 HA LEU A1970 2.911 -6.051 2.581 1.00 0.49 H new ATOM 0 HB2 LEU A1970 3.579 -3.820 1.924 1.00 0.60 H new ATOM 0 HB3 LEU A1970 2.218 -3.702 0.827 1.00 0.60 H new ATOM 0 HG LEU A1970 0.667 -3.770 2.738 1.00 0.91 H new ATOM 0 HD11 LEU A1970 1.511 -3.503 5.013 1.00 1.11 H new ATOM 0 HD12 LEU A1970 2.000 -5.060 4.303 1.00 1.11 H new ATOM 0 HD13 LEU A1970 3.175 -3.729 4.423 1.00 1.11 H new ATOM 0 HD21 LEU A1970 1.255 -1.538 3.588 1.00 1.75 H new ATOM 0 HD22 LEU A1970 2.896 -1.728 2.928 1.00 1.75 H new ATOM 0 HD23 LEU A1970 1.498 -1.655 1.829 1.00 1.75 H new ATOM 1302 N VAL A1971 0.453 -6.547 2.485 1.00 0.46 N ATOM 1303 CA VAL A1971 -0.891 -7.055 2.389 1.00 0.48 C ATOM 1304 C VAL A1971 -1.803 -6.386 3.417 1.00 0.45 C ATOM 1305 O VAL A1971 -1.534 -6.407 4.625 1.00 0.60 O ATOM 1306 CB VAL A1971 -0.950 -8.619 2.551 1.00 0.64 C ATOM 1307 CG1 VAL A1971 -0.267 -9.307 1.390 1.00 0.73 C ATOM 1308 CG2 VAL A1971 -0.308 -9.079 3.855 1.00 0.74 C ATOM 0 H VAL A1971 0.842 -6.561 3.428 1.00 0.46 H new ATOM 0 HA VAL A1971 -1.247 -6.813 1.387 1.00 0.48 H new ATOM 0 HB VAL A1971 -2.005 -8.894 2.569 1.00 0.64 H new ATOM 0 HG11 VAL A1971 -0.321 -10.387 1.525 1.00 0.73 H new ATOM 0 HG12 VAL A1971 -0.765 -9.032 0.460 1.00 0.73 H new ATOM 0 HG13 VAL A1971 0.777 -8.998 1.347 1.00 0.73 H new ATOM 0 HG21 VAL A1971 -0.370 -10.165 3.928 1.00 0.74 H new ATOM 0 HG22 VAL A1971 0.738 -8.773 3.873 1.00 0.74 H new ATOM 0 HG23 VAL A1971 -0.833 -8.628 4.698 1.00 0.74 H new ATOM 1318 N TYR A1972 -2.832 -5.748 2.943 1.00 0.38 N ATOM 1319 CA TYR A1972 -3.823 -5.191 3.826 1.00 0.39 C ATOM 1320 C TYR A1972 -5.072 -6.020 3.780 1.00 0.45 C ATOM 1321 O TYR A1972 -5.865 -5.937 2.846 1.00 0.55 O ATOM 1322 CB TYR A1972 -4.085 -3.690 3.598 1.00 0.43 C ATOM 1323 CG TYR A1972 -2.941 -2.823 4.066 1.00 0.56 C ATOM 1324 CD1 TYR A1972 -2.445 -2.977 5.335 1.00 0.75 C ATOM 1325 CD2 TYR A1972 -2.347 -1.876 3.246 1.00 0.79 C ATOM 1326 CE1 TYR A1972 -1.402 -2.225 5.791 1.00 0.97 C ATOM 1327 CE2 TYR A1972 -1.285 -1.115 3.698 1.00 0.98 C ATOM 1328 CZ TYR A1972 -0.821 -1.305 4.983 1.00 1.04 C ATOM 1329 OH TYR A1972 0.251 -0.590 5.455 1.00 1.27 O ATOM 0 H TYR A1972 -3.010 -5.598 1.950 1.00 0.38 H new ATOM 0 HA TYR A1972 -3.421 -5.235 4.838 1.00 0.39 H new ATOM 0 HB2 TYR A1972 -4.260 -3.513 2.537 1.00 0.43 H new ATOM 0 HB3 TYR A1972 -4.995 -3.400 4.124 1.00 0.43 H new ATOM 0 HD1 TYR A1972 -2.891 -3.711 5.989 1.00 0.75 H new ATOM 0 HD2 TYR A1972 -2.718 -1.731 2.242 1.00 0.79 H new ATOM 0 HE1 TYR A1972 -1.038 -2.363 6.799 1.00 0.97 H new ATOM 0 HE2 TYR A1972 -0.825 -0.381 3.053 1.00 0.98 H new ATOM 0 HH TYR A1972 0.977 -1.205 5.690 1.00 1.27 H new ATOM 1339 N GLU A1973 -5.187 -6.867 4.758 1.00 0.57 N ATOM 1340 CA GLU A1973 -6.265 -7.812 4.871 1.00 0.73 C ATOM 1341 C GLU A1973 -7.383 -7.289 5.762 1.00 0.58 C ATOM 1342 O GLU A1973 -7.169 -6.362 6.567 1.00 0.57 O ATOM 1343 CB GLU A1973 -5.704 -9.140 5.399 1.00 1.09 C ATOM 1344 CG GLU A1973 -4.890 -9.011 6.684 1.00 1.33 C ATOM 1345 CD GLU A1973 -4.202 -10.298 7.073 1.00 1.89 C ATOM 1346 OE1 GLU A1973 -4.801 -11.113 7.801 1.00 2.75 O ATOM 1347 OE2 GLU A1973 -3.053 -10.515 6.658 1.00 2.17 O ATOM 0 H GLU A1973 -4.515 -6.924 5.524 1.00 0.57 H new ATOM 0 HA GLU A1973 -6.706 -7.969 3.886 1.00 0.73 H new ATOM 0 HB2 GLU A1973 -6.532 -9.827 5.575 1.00 1.09 H new ATOM 0 HB3 GLU A1973 -5.076 -9.588 4.629 1.00 1.09 H new ATOM 0 HG2 GLU A1973 -4.142 -8.228 6.558 1.00 1.33 H new ATOM 0 HG3 GLU A1973 -5.547 -8.696 7.495 1.00 1.33 H new ATOM 1354 N ASP A1974 -8.560 -7.886 5.598 1.00 0.73 N ATOM 1355 CA ASP A1974 -9.786 -7.570 6.358 1.00 0.79 C ATOM 1356 C ASP A1974 -10.361 -6.234 5.993 1.00 0.83 C ATOM 1357 O ASP A1974 -10.001 -5.197 6.568 1.00 1.13 O ATOM 1358 CB ASP A1974 -9.643 -7.683 7.890 1.00 1.03 C ATOM 1359 CG ASP A1974 -9.366 -9.076 8.372 1.00 1.29 C ATOM 1360 OD1 ASP A1974 -10.188 -9.975 8.108 1.00 1.56 O ATOM 1361 OD2 ASP A1974 -8.302 -9.313 8.976 1.00 1.57 O ATOM 0 H ASP A1974 -8.701 -8.628 4.913 1.00 0.73 H new ATOM 0 HA ASP A1974 -10.484 -8.351 6.054 1.00 0.79 H new ATOM 0 HB2 ASP A1974 -8.837 -7.028 8.219 1.00 1.03 H new ATOM 0 HB3 ASP A1974 -10.559 -7.322 8.358 1.00 1.03 H new ATOM 1366 N GLY A1975 -11.245 -6.248 5.043 1.00 1.18 N ATOM 1367 CA GLY A1975 -11.886 -5.043 4.618 1.00 1.43 C ATOM 1368 C GLY A1975 -13.374 -5.162 4.751 1.00 1.27 C ATOM 1369 O GLY A1975 -13.858 -6.037 5.472 1.00 1.57 O ATOM 0 H GLY A1975 -11.540 -7.087 4.544 1.00 1.18 H new ATOM 0 HA2 GLY A1975 -11.528 -4.204 5.215 1.00 1.43 H new ATOM 0 HA3 GLY A1975 -11.624 -4.831 3.581 1.00 1.43 H new ATOM 1373 N ASP A1976 -14.095 -4.310 4.069 1.00 0.96 N ATOM 1374 CA ASP A1976 -15.546 -4.352 4.080 1.00 0.90 C ATOM 1375 C ASP A1976 -15.999 -5.550 3.266 1.00 0.95 C ATOM 1376 O ASP A1976 -15.605 -5.700 2.105 1.00 1.08 O ATOM 1377 CB ASP A1976 -16.173 -3.051 3.533 1.00 0.95 C ATOM 1378 CG ASP A1976 -15.860 -1.818 4.368 1.00 1.57 C ATOM 1379 OD1 ASP A1976 -15.651 -1.947 5.597 1.00 2.24 O ATOM 1380 OD2 ASP A1976 -15.767 -0.695 3.806 1.00 2.08 O ATOM 0 H ASP A1976 -13.701 -3.568 3.491 1.00 0.96 H new ATOM 0 HA ASP A1976 -15.885 -4.446 5.112 1.00 0.90 H new ATOM 0 HB2 ASP A1976 -15.818 -2.888 2.515 1.00 0.95 H new ATOM 0 HB3 ASP A1976 -17.254 -3.176 3.478 1.00 0.95 H new ATOM 1385 N PRO A1977 -16.796 -6.435 3.870 1.00 1.16 N ATOM 1386 CA PRO A1977 -17.198 -7.684 3.244 1.00 1.39 C ATOM 1387 C PRO A1977 -18.163 -7.512 2.076 1.00 1.45 C ATOM 1388 O PRO A1977 -19.334 -7.142 2.254 1.00 1.66 O ATOM 1389 CB PRO A1977 -17.861 -8.467 4.381 1.00 1.68 C ATOM 1390 CG PRO A1977 -18.336 -7.429 5.337 1.00 1.68 C ATOM 1391 CD PRO A1977 -17.373 -6.283 5.222 1.00 1.41 C ATOM 0 HA PRO A1977 -16.338 -8.186 2.801 1.00 1.39 H new ATOM 0 HB2 PRO A1977 -18.689 -9.073 4.013 1.00 1.68 H new ATOM 0 HB3 PRO A1977 -17.154 -9.148 4.856 1.00 1.68 H new ATOM 0 HG2 PRO A1977 -19.350 -7.111 5.095 1.00 1.68 H new ATOM 0 HG3 PRO A1977 -18.359 -7.818 6.355 1.00 1.68 H new ATOM 0 HD2 PRO A1977 -17.879 -5.324 5.335 1.00 1.41 H new ATOM 0 HD3 PRO A1977 -16.603 -6.330 5.992 1.00 1.41 H new ATOM 1399 N CYS A1978 -17.662 -7.754 0.892 1.00 1.46 N ATOM 1400 CA CYS A1978 -18.462 -7.765 -0.305 1.00 1.62 C ATOM 1401 C CYS A1978 -19.307 -9.058 -0.295 1.00 1.87 C ATOM 1402 O CYS A1978 -19.005 -9.960 0.487 1.00 1.90 O ATOM 1403 CB CYS A1978 -17.522 -7.684 -1.521 1.00 1.58 C ATOM 1404 SG CYS A1978 -16.475 -6.177 -1.511 1.00 1.81 S ATOM 0 H CYS A1978 -16.674 -7.951 0.730 1.00 1.46 H new ATOM 0 HA CYS A1978 -19.141 -6.914 -0.357 1.00 1.62 H new ATOM 0 HB2 CYS A1978 -16.881 -8.566 -1.539 1.00 1.58 H new ATOM 0 HB3 CYS A1978 -18.115 -7.703 -2.435 1.00 1.58 H new ATOM 1409 N PRO A1979 -20.386 -9.167 -1.113 1.00 2.20 N ATOM 1410 CA PRO A1979 -21.287 -10.355 -1.120 1.00 2.55 C ATOM 1411 C PRO A1979 -20.542 -11.699 -1.277 1.00 2.56 C ATOM 1412 O PRO A1979 -20.952 -12.735 -0.732 1.00 2.76 O ATOM 1413 CB PRO A1979 -22.203 -10.109 -2.329 1.00 2.93 C ATOM 1414 CG PRO A1979 -21.574 -8.984 -3.087 1.00 2.90 C ATOM 1415 CD PRO A1979 -20.846 -8.157 -2.077 1.00 2.38 C ATOM 0 HA PRO A1979 -21.814 -10.448 -0.170 1.00 2.55 H new ATOM 0 HB2 PRO A1979 -22.283 -11.002 -2.948 1.00 2.93 H new ATOM 0 HB3 PRO A1979 -23.213 -9.851 -2.010 1.00 2.93 H new ATOM 0 HG2 PRO A1979 -20.890 -9.361 -3.847 1.00 2.90 H new ATOM 0 HG3 PRO A1979 -22.330 -8.392 -3.603 1.00 2.90 H new ATOM 0 HD2 PRO A1979 -20.014 -7.612 -2.522 1.00 2.38 H new ATOM 0 HD3 PRO A1979 -21.498 -7.418 -1.611 1.00 2.38 H new ATOM 1423 N THR A1980 -19.461 -11.664 -1.986 1.00 2.44 N ATOM 1424 CA THR A1980 -18.641 -12.768 -2.225 1.00 2.58 C ATOM 1425 C THR A1980 -17.703 -13.030 -1.021 1.00 2.52 C ATOM 1426 O THR A1980 -17.465 -14.176 -0.620 1.00 2.86 O ATOM 1427 CB THR A1980 -17.849 -12.379 -3.449 1.00 2.52 C ATOM 1428 OG1 THR A1980 -17.645 -10.944 -3.398 1.00 2.72 O ATOM 1429 CG2 THR A1980 -18.578 -12.752 -4.724 1.00 2.83 C ATOM 0 H THR A1980 -19.123 -10.810 -2.430 1.00 2.44 H new ATOM 0 HA THR A1980 -19.209 -13.687 -2.369 1.00 2.58 H new ATOM 0 HB THR A1980 -16.898 -12.912 -3.454 1.00 2.52 H new ATOM 0 HG1 THR A1980 -16.845 -10.709 -3.912 1.00 2.72 H new ATOM 0 HG21 THR A1980 -17.979 -12.457 -5.585 1.00 2.83 H new ATOM 0 HG22 THR A1980 -18.742 -13.829 -4.748 1.00 2.83 H new ATOM 0 HG23 THR A1980 -19.539 -12.238 -4.757 1.00 2.83 H new ATOM 1437 N ASP A1981 -17.273 -11.949 -0.393 1.00 2.25 N ATOM 1438 CA ASP A1981 -16.279 -11.963 0.703 1.00 2.32 C ATOM 1439 C ASP A1981 -16.892 -12.266 2.027 1.00 2.24 C ATOM 1440 O ASP A1981 -16.246 -12.159 3.074 1.00 2.36 O ATOM 1441 CB ASP A1981 -15.590 -10.643 0.821 1.00 2.46 C ATOM 1442 CG ASP A1981 -14.749 -10.303 -0.357 1.00 2.87 C ATOM 1443 OD1 ASP A1981 -14.027 -11.182 -0.823 1.00 3.20 O ATOM 1444 OD2 ASP A1981 -14.861 -9.193 -0.878 1.00 3.37 O ATOM 0 H ASP A1981 -17.602 -11.012 -0.624 1.00 2.25 H new ATOM 0 HA ASP A1981 -15.570 -12.750 0.444 1.00 2.32 H new ATOM 0 HB2 ASP A1981 -16.339 -9.863 0.960 1.00 2.46 H new ATOM 0 HB3 ASP A1981 -14.965 -10.647 1.714 1.00 2.46 H new ATOM 1449 N LEU A1982 -18.120 -12.596 2.005 1.00 2.24 N ATOM 1450 CA LEU A1982 -18.787 -13.060 3.182 1.00 2.35 C ATOM 1451 C LEU A1982 -18.358 -14.489 3.402 1.00 2.41 C ATOM 1452 O LEU A1982 -18.288 -14.978 4.522 1.00 2.56 O ATOM 1453 CB LEU A1982 -20.276 -12.993 2.954 1.00 2.55 C ATOM 1454 CG LEU A1982 -20.806 -11.619 2.629 1.00 2.64 C ATOM 1455 CD1 LEU A1982 -22.199 -11.733 2.105 1.00 2.83 C ATOM 1456 CD2 LEU A1982 -20.769 -10.736 3.856 1.00 2.91 C ATOM 0 H LEU A1982 -18.708 -12.557 1.172 1.00 2.24 H new ATOM 0 HA LEU A1982 -18.538 -12.452 4.052 1.00 2.35 H new ATOM 0 HB2 LEU A1982 -20.535 -13.669 2.139 1.00 2.55 H new ATOM 0 HB3 LEU A1982 -20.783 -13.361 3.846 1.00 2.55 H new ATOM 0 HG LEU A1982 -20.176 -11.163 1.865 1.00 2.64 H new ATOM 0 HD11 LEU A1982 -22.582 -10.740 1.870 1.00 2.83 H new ATOM 0 HD12 LEU A1982 -22.199 -12.345 1.203 1.00 2.83 H new ATOM 0 HD13 LEU A1982 -22.834 -12.198 2.859 1.00 2.83 H new ATOM 0 HD21 LEU A1982 -21.155 -9.748 3.605 1.00 2.91 H new ATOM 0 HD22 LEU A1982 -21.384 -11.177 4.640 1.00 2.91 H new ATOM 0 HD23 LEU A1982 -19.741 -10.646 4.208 1.00 2.91 H new ATOM 1468 N LYS A1983 -17.980 -15.119 2.316 1.00 2.40 N ATOM 1469 CA LYS A1983 -17.609 -16.483 2.310 1.00 2.57 C ATOM 1470 C LYS A1983 -16.125 -16.636 1.869 1.00 2.46 C ATOM 1471 O LYS A1983 -15.610 -17.748 1.681 1.00 2.62 O ATOM 1472 CB LYS A1983 -18.592 -17.202 1.386 1.00 2.75 C ATOM 1473 CG LYS A1983 -18.466 -18.702 1.358 1.00 2.91 C ATOM 1474 CD LYS A1983 -19.607 -19.337 0.577 1.00 3.23 C ATOM 1475 CE LYS A1983 -19.597 -18.917 -0.879 1.00 3.77 C ATOM 1476 NZ LYS A1983 -20.795 -19.389 -1.595 1.00 4.43 N ATOM 0 H LYS A1983 -17.926 -14.673 1.400 1.00 2.40 H new ATOM 0 HA LYS A1983 -17.663 -16.928 3.303 1.00 2.57 H new ATOM 0 HB2 LYS A1983 -19.606 -16.944 1.690 1.00 2.75 H new ATOM 0 HB3 LYS A1983 -18.457 -16.823 0.373 1.00 2.75 H new ATOM 0 HG2 LYS A1983 -17.514 -18.981 0.907 1.00 2.91 H new ATOM 0 HG3 LYS A1983 -18.461 -19.088 2.377 1.00 2.91 H new ATOM 0 HD2 LYS A1983 -19.532 -20.422 0.642 1.00 3.23 H new ATOM 0 HD3 LYS A1983 -20.558 -19.055 1.030 1.00 3.23 H new ATOM 0 HE2 LYS A1983 -19.540 -17.830 -0.943 1.00 3.77 H new ATOM 0 HE3 LYS A1983 -18.705 -19.312 -1.365 1.00 3.77 H new ATOM 0 HZ1 LYS A1983 -20.750 -19.081 -2.587 1.00 4.43 H new ATOM 0 HZ2 LYS A1983 -20.836 -20.427 -1.556 1.00 4.43 H new ATOM 0 HZ3 LYS A1983 -21.646 -18.992 -1.148 1.00 4.43 H new ATOM 1490 N MET A1984 -15.429 -15.511 1.769 1.00 2.32 N ATOM 1491 CA MET A1984 -14.072 -15.456 1.385 1.00 2.29 C ATOM 1492 C MET A1984 -13.408 -14.435 2.262 1.00 2.18 C ATOM 1493 O MET A1984 -14.049 -13.828 3.118 1.00 2.40 O ATOM 1494 CB MET A1984 -13.898 -15.071 -0.104 1.00 2.28 C ATOM 1495 CG MET A1984 -14.407 -16.105 -1.095 1.00 2.33 C ATOM 1496 SD MET A1984 -14.007 -15.702 -2.816 1.00 2.53 S ATOM 1497 CE MET A1984 -14.859 -14.147 -2.997 1.00 2.68 C ATOM 0 H MET A1984 -15.831 -14.594 1.965 1.00 2.32 H new ATOM 0 HA MET A1984 -13.622 -16.442 1.502 1.00 2.29 H new ATOM 0 HB2 MET A1984 -14.417 -14.130 -0.284 1.00 2.28 H new ATOM 0 HB3 MET A1984 -12.840 -14.893 -0.297 1.00 2.28 H new ATOM 0 HG2 MET A1984 -13.980 -17.077 -0.848 1.00 2.33 H new ATOM 0 HG3 MET A1984 -15.488 -16.196 -0.992 1.00 2.33 H new ATOM 0 HE1 MET A1984 -14.908 -13.879 -4.053 1.00 2.68 H new ATOM 0 HE2 MET A1984 -15.870 -14.237 -2.599 1.00 2.68 H new ATOM 0 HE3 MET A1984 -14.322 -13.372 -2.451 1.00 2.68 H new ATOM 1507 N LYS A1985 -12.166 -14.291 2.088 1.00 2.14 N ATOM 1508 CA LYS A1985 -11.357 -13.340 2.832 1.00 2.09 C ATOM 1509 C LYS A1985 -10.548 -12.538 1.832 1.00 1.89 C ATOM 1510 O LYS A1985 -9.920 -13.136 0.961 1.00 2.34 O ATOM 1511 CB LYS A1985 -10.376 -14.049 3.822 1.00 2.67 C ATOM 1512 CG LYS A1985 -11.000 -14.899 4.961 1.00 3.08 C ATOM 1513 CD LYS A1985 -11.587 -16.239 4.486 1.00 3.73 C ATOM 1514 CE LYS A1985 -10.536 -17.132 3.826 1.00 4.42 C ATOM 1515 NZ LYS A1985 -9.447 -17.511 4.749 1.00 4.89 N ATOM 0 H LYS A1985 -11.634 -14.834 1.408 1.00 2.14 H new ATOM 0 HA LYS A1985 -12.019 -12.706 3.422 1.00 2.09 H new ATOM 0 HB2 LYS A1985 -9.720 -14.696 3.240 1.00 2.67 H new ATOM 0 HB3 LYS A1985 -9.747 -13.284 4.278 1.00 2.67 H new ATOM 0 HG2 LYS A1985 -10.238 -15.094 5.715 1.00 3.08 H new ATOM 0 HG3 LYS A1985 -11.786 -14.320 5.445 1.00 3.08 H new ATOM 0 HD2 LYS A1985 -12.024 -16.763 5.336 1.00 3.73 H new ATOM 0 HD3 LYS A1985 -12.395 -16.049 3.779 1.00 3.73 H new ATOM 0 HE2 LYS A1985 -11.017 -18.034 3.449 1.00 4.42 H new ATOM 0 HE3 LYS A1985 -10.113 -16.613 2.966 1.00 4.42 H new ATOM 0 HZ1 LYS A1985 -8.809 -18.183 4.276 1.00 4.89 H new ATOM 0 HZ2 LYS A1985 -8.913 -16.662 5.024 1.00 4.89 H new ATOM 0 HZ3 LYS A1985 -9.851 -17.956 5.598 1.00 4.89 H new ATOM 1529 N HIS A1986 -10.536 -11.222 1.919 1.00 1.63 N ATOM 1530 CA HIS A1986 -9.753 -10.467 0.954 1.00 1.68 C ATOM 1531 C HIS A1986 -8.602 -9.717 1.576 1.00 1.14 C ATOM 1532 O HIS A1986 -8.733 -9.091 2.639 1.00 1.35 O ATOM 1533 CB HIS A1986 -10.579 -9.564 -0.006 1.00 2.46 C ATOM 1534 CG HIS A1986 -11.315 -8.369 0.577 1.00 3.48 C ATOM 1535 ND1 HIS A1986 -12.649 -8.131 0.349 1.00 4.38 N ATOM 1536 CD2 HIS A1986 -10.878 -7.303 1.289 1.00 4.21 C ATOM 1537 CE1 HIS A1986 -13.001 -6.998 0.888 1.00 5.37 C ATOM 1538 NE2 HIS A1986 -11.949 -6.466 1.467 1.00 5.32 N ATOM 0 H HIS A1986 -11.036 -10.670 2.616 1.00 1.63 H new ATOM 0 HA HIS A1986 -9.328 -11.243 0.317 1.00 1.68 H new ATOM 0 HB2 HIS A1986 -9.903 -9.193 -0.776 1.00 2.46 H new ATOM 0 HB3 HIS A1986 -11.314 -10.195 -0.504 1.00 2.46 H new ATOM 0 HD1 HIS A1986 -13.273 -8.751 -0.167 1.00 4.38 H new ATOM 0 HD2 HIS A1986 -9.873 -7.142 1.649 1.00 4.21 H new ATOM 0 HE1 HIS A1986 -13.992 -6.569 0.863 1.00 5.37 H new ATOM 1547 N LYS A1987 -7.487 -9.797 0.912 1.00 1.12 N ATOM 1548 CA LYS A1987 -6.280 -9.130 1.302 1.00 1.18 C ATOM 1549 C LYS A1987 -5.831 -8.313 0.111 1.00 1.02 C ATOM 1550 O LYS A1987 -5.811 -8.824 -1.003 1.00 1.30 O ATOM 1551 CB LYS A1987 -5.204 -10.172 1.649 1.00 1.91 C ATOM 1552 CG LYS A1987 -5.686 -11.243 2.615 1.00 2.70 C ATOM 1553 CD LYS A1987 -4.613 -12.255 2.946 1.00 3.34 C ATOM 1554 CE LYS A1987 -5.184 -13.362 3.819 1.00 3.96 C ATOM 1555 NZ LYS A1987 -4.161 -14.344 4.208 1.00 4.45 N ATOM 0 H LYS A1987 -7.389 -10.345 0.057 1.00 1.12 H new ATOM 0 HA LYS A1987 -6.442 -8.498 2.176 1.00 1.18 H new ATOM 0 HB2 LYS A1987 -4.862 -10.649 0.731 1.00 1.91 H new ATOM 0 HB3 LYS A1987 -4.343 -9.663 2.083 1.00 1.91 H new ATOM 0 HG2 LYS A1987 -6.029 -10.769 3.535 1.00 2.70 H new ATOM 0 HG3 LYS A1987 -6.544 -11.757 2.182 1.00 2.70 H new ATOM 0 HD2 LYS A1987 -4.208 -12.679 2.027 1.00 3.34 H new ATOM 0 HD3 LYS A1987 -3.788 -11.765 3.462 1.00 3.34 H new ATOM 0 HE2 LYS A1987 -5.625 -12.925 4.715 1.00 3.96 H new ATOM 0 HE3 LYS A1987 -5.986 -13.868 3.283 1.00 3.96 H new ATOM 0 HZ1 LYS A1987 -4.594 -15.080 4.802 1.00 4.45 H new ATOM 0 HZ2 LYS A1987 -3.757 -14.781 3.355 1.00 4.45 H new ATOM 0 HZ3 LYS A1987 -3.407 -13.867 4.743 1.00 4.45 H new ATOM 1569 N SER A1988 -5.515 -7.074 0.320 1.00 0.68 N ATOM 1570 CA SER A1988 -5.072 -6.231 -0.757 1.00 0.60 C ATOM 1571 C SER A1988 -3.549 -6.261 -0.842 1.00 0.50 C ATOM 1572 O SER A1988 -2.855 -6.042 0.159 1.00 0.57 O ATOM 1573 CB SER A1988 -5.606 -4.819 -0.552 1.00 0.64 C ATOM 1574 OG SER A1988 -7.033 -4.844 -0.501 1.00 1.41 O ATOM 0 H SER A1988 -5.554 -6.617 1.231 1.00 0.68 H new ATOM 0 HA SER A1988 -5.461 -6.599 -1.706 1.00 0.60 H new ATOM 0 HB2 SER A1988 -5.207 -4.400 0.372 1.00 0.64 H new ATOM 0 HB3 SER A1988 -5.273 -4.173 -1.364 1.00 0.64 H new ATOM 0 HG SER A1988 -7.329 -4.744 0.428 1.00 1.41 H new ATOM 1580 N TYR A1989 -3.051 -6.548 -2.022 1.00 0.51 N ATOM 1581 CA TYR A1989 -1.642 -6.743 -2.256 1.00 0.49 C ATOM 1582 C TYR A1989 -0.996 -5.513 -2.850 1.00 0.41 C ATOM 1583 O TYR A1989 -1.472 -4.938 -3.845 1.00 0.42 O ATOM 1584 CB TYR A1989 -1.405 -7.944 -3.172 1.00 0.63 C ATOM 1585 CG TYR A1989 -1.716 -9.295 -2.559 1.00 0.75 C ATOM 1586 CD1 TYR A1989 -3.009 -9.813 -2.556 1.00 1.18 C ATOM 1587 CD2 TYR A1989 -0.710 -10.054 -1.987 1.00 1.69 C ATOM 1588 CE1 TYR A1989 -3.281 -11.049 -1.993 1.00 1.40 C ATOM 1589 CE2 TYR A1989 -0.972 -11.288 -1.424 1.00 2.13 C ATOM 1590 CZ TYR A1989 -2.254 -11.780 -1.428 1.00 1.66 C ATOM 1591 OH TYR A1989 -2.510 -13.014 -0.863 1.00 2.20 O ATOM 0 H TYR A1989 -3.624 -6.654 -2.859 1.00 0.51 H new ATOM 0 HA TYR A1989 -1.181 -6.934 -1.287 1.00 0.49 H new ATOM 0 HB2 TYR A1989 -2.012 -7.822 -4.069 1.00 0.63 H new ATOM 0 HB3 TYR A1989 -0.362 -7.938 -3.489 1.00 0.63 H new ATOM 0 HD1 TYR A1989 -3.812 -9.242 -2.999 1.00 1.18 H new ATOM 0 HD2 TYR A1989 0.301 -9.674 -1.981 1.00 1.69 H new ATOM 0 HE1 TYR A1989 -4.288 -11.438 -1.996 1.00 1.40 H new ATOM 0 HE2 TYR A1989 -0.172 -11.863 -0.982 1.00 2.13 H new ATOM 0 HH TYR A1989 -1.677 -13.393 -0.513 1.00 2.20 H new ATOM 1601 N PHE A1990 0.063 -5.108 -2.234 1.00 0.40 N ATOM 1602 CA PHE A1990 0.844 -3.992 -2.677 1.00 0.40 C ATOM 1603 C PHE A1990 2.197 -4.479 -3.104 1.00 0.40 C ATOM 1604 O PHE A1990 2.900 -5.135 -2.323 1.00 0.51 O ATOM 1605 CB PHE A1990 1.006 -2.966 -1.556 1.00 0.49 C ATOM 1606 CG PHE A1990 -0.255 -2.272 -1.159 1.00 0.84 C ATOM 1607 CD1 PHE A1990 -1.202 -2.935 -0.407 1.00 1.45 C ATOM 1608 CD2 PHE A1990 -0.494 -0.962 -1.529 1.00 1.31 C ATOM 1609 CE1 PHE A1990 -2.364 -2.306 -0.035 1.00 2.10 C ATOM 1610 CE2 PHE A1990 -1.650 -0.329 -1.157 1.00 2.02 C ATOM 1611 CZ PHE A1990 -2.584 -0.978 -0.436 1.00 2.31 C ATOM 0 H PHE A1990 0.422 -5.551 -1.388 1.00 0.40 H new ATOM 0 HA PHE A1990 0.333 -3.515 -3.514 1.00 0.40 H new ATOM 0 HB2 PHE A1990 1.420 -3.467 -0.681 1.00 0.49 H new ATOM 0 HB3 PHE A1990 1.734 -2.217 -1.869 1.00 0.49 H new ATOM 0 HD1 PHE A1990 -1.028 -3.958 -0.108 1.00 1.45 H new ATOM 0 HD2 PHE A1990 0.239 -0.431 -2.118 1.00 1.31 H new ATOM 0 HE1 PHE A1990 -3.101 -2.826 0.559 1.00 2.10 H new ATOM 0 HE2 PHE A1990 -1.814 0.699 -1.444 1.00 2.02 H new ATOM 0 HZ PHE A1990 -3.502 -0.477 -0.166 1.00 2.31 H new ATOM 1621 N SER A1991 2.543 -4.199 -4.325 1.00 0.35 N ATOM 1622 CA SER A1991 3.813 -4.548 -4.864 1.00 0.36 C ATOM 1623 C SER A1991 4.643 -3.283 -5.013 1.00 0.40 C ATOM 1624 O SER A1991 4.399 -2.464 -5.898 1.00 0.55 O ATOM 1625 CB SER A1991 3.634 -5.245 -6.212 1.00 0.36 C ATOM 1626 OG SER A1991 2.811 -6.401 -6.082 1.00 1.09 O ATOM 0 H SER A1991 1.935 -3.712 -4.983 1.00 0.35 H new ATOM 0 HA SER A1991 4.328 -5.238 -4.196 1.00 0.36 H new ATOM 0 HB2 SER A1991 3.187 -4.554 -6.927 1.00 0.36 H new ATOM 0 HB3 SER A1991 4.608 -5.530 -6.611 1.00 0.36 H new ATOM 0 HG SER A1991 2.960 -6.996 -6.846 1.00 1.09 H new ATOM 1632 N PHE A1992 5.567 -3.100 -4.122 1.00 0.36 N ATOM 1633 CA PHE A1992 6.416 -1.944 -4.128 1.00 0.37 C ATOM 1634 C PHE A1992 7.651 -2.247 -4.933 1.00 0.39 C ATOM 1635 O PHE A1992 8.496 -3.069 -4.534 1.00 0.40 O ATOM 1636 CB PHE A1992 6.788 -1.536 -2.711 1.00 0.40 C ATOM 1637 CG PHE A1992 5.624 -1.213 -1.845 1.00 0.48 C ATOM 1638 CD1 PHE A1992 5.078 0.051 -1.846 1.00 0.56 C ATOM 1639 CD2 PHE A1992 5.076 -2.171 -1.025 1.00 0.58 C ATOM 1640 CE1 PHE A1992 4.011 0.350 -1.045 1.00 0.68 C ATOM 1641 CE2 PHE A1992 4.005 -1.875 -0.216 1.00 0.71 C ATOM 1642 CZ PHE A1992 3.455 -0.612 -0.248 1.00 0.74 C ATOM 0 H PHE A1992 5.757 -3.753 -3.362 1.00 0.36 H new ATOM 0 HA PHE A1992 5.881 -1.109 -4.581 1.00 0.37 H new ATOM 0 HB2 PHE A1992 7.357 -2.343 -2.250 1.00 0.40 H new ATOM 0 HB3 PHE A1992 7.446 -0.668 -2.756 1.00 0.40 H new ATOM 0 HD1 PHE A1992 5.497 0.814 -2.486 1.00 0.56 H new ATOM 0 HD2 PHE A1992 5.492 -3.168 -1.016 1.00 0.58 H new ATOM 0 HE1 PHE A1992 3.605 1.351 -1.042 1.00 0.68 H new ATOM 0 HE2 PHE A1992 3.597 -2.628 0.441 1.00 0.71 H new ATOM 0 HZ PHE A1992 2.588 -0.383 0.354 1.00 0.74 H new ATOM 1652 N VAL A1993 7.740 -1.623 -6.058 1.00 0.44 N ATOM 1653 CA VAL A1993 8.807 -1.842 -6.985 1.00 0.51 C ATOM 1654 C VAL A1993 9.668 -0.592 -7.148 1.00 0.53 C ATOM 1655 O VAL A1993 9.171 0.500 -7.468 1.00 0.58 O ATOM 1656 CB VAL A1993 8.274 -2.393 -8.354 1.00 0.59 C ATOM 1657 CG1 VAL A1993 7.077 -1.604 -8.835 1.00 0.76 C ATOM 1658 CG2 VAL A1993 9.360 -2.389 -9.421 1.00 0.91 C ATOM 0 H VAL A1993 7.059 -0.930 -6.369 1.00 0.44 H new ATOM 0 HA VAL A1993 9.456 -2.615 -6.573 1.00 0.51 H new ATOM 0 HB VAL A1993 7.966 -3.424 -8.182 1.00 0.59 H new ATOM 0 HG11 VAL A1993 6.731 -2.010 -9.786 1.00 0.76 H new ATOM 0 HG12 VAL A1993 6.276 -1.672 -8.099 1.00 0.76 H new ATOM 0 HG13 VAL A1993 7.359 -0.560 -8.968 1.00 0.76 H new ATOM 0 HG21 VAL A1993 8.954 -2.777 -10.355 1.00 0.91 H new ATOM 0 HG22 VAL A1993 9.715 -1.370 -9.575 1.00 0.91 H new ATOM 0 HG23 VAL A1993 10.190 -3.017 -9.098 1.00 0.91 H new ATOM 1668 N CYS A1994 10.930 -0.750 -6.853 1.00 0.59 N ATOM 1669 CA CYS A1994 11.901 0.302 -6.962 1.00 0.67 C ATOM 1670 C CYS A1994 12.115 0.767 -8.401 1.00 0.65 C ATOM 1671 O CYS A1994 12.566 0.003 -9.260 1.00 0.84 O ATOM 1672 CB CYS A1994 13.202 -0.145 -6.321 1.00 0.88 C ATOM 1673 SG CYS A1994 13.733 -1.809 -6.819 1.00 1.47 S ATOM 0 H CYS A1994 11.319 -1.633 -6.523 1.00 0.59 H new ATOM 0 HA CYS A1994 11.515 1.171 -6.429 1.00 0.67 H new ATOM 0 HB2 CYS A1994 13.986 0.568 -6.577 1.00 0.88 H new ATOM 0 HB3 CYS A1994 13.089 -0.119 -5.237 1.00 0.88 H new ATOM 1678 N LYS A1995 11.772 2.013 -8.668 1.00 0.77 N ATOM 1679 CA LYS A1995 11.977 2.582 -9.969 1.00 0.93 C ATOM 1680 C LYS A1995 12.619 3.948 -9.799 1.00 1.05 C ATOM 1681 O LYS A1995 11.999 4.855 -9.245 1.00 1.39 O ATOM 1682 CB LYS A1995 10.656 2.735 -10.737 1.00 1.37 C ATOM 1683 CG LYS A1995 10.871 3.003 -12.219 1.00 1.79 C ATOM 1684 CD LYS A1995 9.603 3.429 -12.941 1.00 2.03 C ATOM 1685 CE LYS A1995 9.842 3.427 -14.444 1.00 2.56 C ATOM 1686 NZ LYS A1995 8.791 4.123 -15.202 1.00 3.14 N ATOM 0 H LYS A1995 11.348 2.647 -7.991 1.00 0.77 H new ATOM 0 HA LYS A1995 12.620 1.915 -10.543 1.00 0.93 H new ATOM 0 HB2 LYS A1995 10.063 1.828 -10.617 1.00 1.37 H new ATOM 0 HB3 LYS A1995 10.080 3.552 -10.303 1.00 1.37 H new ATOM 0 HG2 LYS A1995 11.626 3.780 -12.335 1.00 1.79 H new ATOM 0 HG3 LYS A1995 11.265 2.103 -12.691 1.00 1.79 H new ATOM 0 HD2 LYS A1995 8.786 2.751 -12.692 1.00 2.03 H new ATOM 0 HD3 LYS A1995 9.303 4.424 -12.612 1.00 2.03 H new ATOM 0 HE2 LYS A1995 10.803 3.898 -14.653 1.00 2.56 H new ATOM 0 HE3 LYS A1995 9.910 2.396 -14.793 1.00 2.56 H new ATOM 0 HZ1 LYS A1995 8.802 3.798 -16.190 1.00 3.14 H new ATOM 0 HZ2 LYS A1995 7.863 3.915 -14.780 1.00 3.14 H new ATOM 0 HZ3 LYS A1995 8.963 5.148 -15.173 1.00 3.14 H new ATOM 1700 N SER A1996 13.837 4.089 -10.275 1.00 1.31 N ATOM 1701 CA SER A1996 14.607 5.330 -10.174 1.00 1.68 C ATOM 1702 C SER A1996 13.880 6.487 -10.874 1.00 1.67 C ATOM 1703 O SER A1996 13.945 7.637 -10.449 1.00 2.05 O ATOM 1704 CB SER A1996 15.955 5.092 -10.823 1.00 2.15 C ATOM 1705 OG SER A1996 16.494 3.872 -10.354 1.00 2.57 O ATOM 0 H SER A1996 14.336 3.338 -10.752 1.00 1.31 H new ATOM 0 HA SER A1996 14.728 5.606 -9.126 1.00 1.68 H new ATOM 0 HB2 SER A1996 15.848 5.062 -11.907 1.00 2.15 H new ATOM 0 HB3 SER A1996 16.632 5.914 -10.592 1.00 2.15 H new ATOM 0 HG SER A1996 16.863 4.001 -9.455 1.00 2.57 H new ATOM 1711 N ASP A1997 13.145 6.136 -11.908 1.00 1.56 N ATOM 1712 CA ASP A1997 12.356 7.073 -12.704 1.00 1.73 C ATOM 1713 C ASP A1997 11.219 7.702 -11.877 1.00 1.59 C ATOM 1714 O ASP A1997 10.739 8.796 -12.185 1.00 2.04 O ATOM 1715 CB ASP A1997 11.813 6.336 -13.931 1.00 1.99 C ATOM 1716 CG ASP A1997 10.868 7.144 -14.780 1.00 2.32 C ATOM 1717 OD1 ASP A1997 11.306 8.174 -15.349 1.00 2.65 O ATOM 1718 OD2 ASP A1997 9.678 6.796 -14.866 1.00 2.80 O ATOM 0 H ASP A1997 13.073 5.171 -12.232 1.00 1.56 H new ATOM 0 HA ASP A1997 12.993 7.896 -13.027 1.00 1.73 H new ATOM 0 HB2 ASP A1997 12.653 6.017 -14.548 1.00 1.99 H new ATOM 0 HB3 ASP A1997 11.301 5.433 -13.599 1.00 1.99 H new ATOM 1723 N ALA A1998 10.817 7.019 -10.818 1.00 1.32 N ATOM 1724 CA ALA A1998 9.784 7.529 -9.927 1.00 1.24 C ATOM 1725 C ALA A1998 10.430 8.166 -8.711 1.00 1.57 C ATOM 1726 O ALA A1998 9.832 9.005 -8.044 1.00 1.87 O ATOM 1727 CB ALA A1998 8.836 6.421 -9.501 1.00 1.44 C ATOM 0 H ALA A1998 11.190 6.108 -10.553 1.00 1.32 H new ATOM 0 HA ALA A1998 9.202 8.280 -10.462 1.00 1.24 H new ATOM 0 HB1 ALA A1998 8.075 6.829 -8.836 1.00 1.44 H new ATOM 0 HB2 ALA A1998 8.357 5.993 -10.382 1.00 1.44 H new ATOM 0 HB3 ALA A1998 9.395 5.645 -8.979 1.00 1.44 H new ATOM 1733 N GLY A1999 11.651 7.746 -8.430 1.00 2.05 N ATOM 1734 CA GLY A1999 12.407 8.284 -7.334 1.00 2.88 C ATOM 1735 C GLY A1999 11.828 7.894 -6.001 1.00 2.81 C ATOM 1736 O GLY A1999 11.076 6.894 -5.893 1.00 3.07 O ATOM 0 H GLY A1999 12.138 7.023 -8.960 1.00 2.05 H new ATOM 0 HA2 GLY A1999 13.437 7.933 -7.398 1.00 2.88 H new ATOM 0 HA3 GLY A1999 12.435 9.371 -7.413 1.00 2.88 H new ATOM 1740 N ASP A2000 12.146 8.665 -4.989 1.00 2.90 N ATOM 1741 CA ASP A2000 11.622 8.415 -3.654 1.00 3.13 C ATOM 1742 C ASP A2000 10.215 8.967 -3.548 1.00 2.60 C ATOM 1743 O ASP A2000 9.545 8.767 -2.542 1.00 2.99 O ATOM 1744 CB ASP A2000 12.500 9.026 -2.535 1.00 3.84 C ATOM 1745 CG ASP A2000 12.327 10.530 -2.351 1.00 3.99 C ATOM 1746 OD1 ASP A2000 12.968 11.308 -3.075 1.00 4.30 O ATOM 1747 OD2 ASP A2000 11.572 10.952 -1.457 1.00 4.11 O ATOM 0 H ASP A2000 12.765 9.473 -5.057 1.00 2.90 H new ATOM 0 HA ASP A2000 11.624 7.335 -3.510 1.00 3.13 H new ATOM 0 HB2 ASP A2000 12.267 8.528 -1.594 1.00 3.84 H new ATOM 0 HB3 ASP A2000 13.547 8.817 -2.756 1.00 3.84 H new ATOM 1752 N ASP A2001 9.757 9.641 -4.615 1.00 2.08 N ATOM 1753 CA ASP A2001 8.410 10.220 -4.673 1.00 1.96 C ATOM 1754 C ASP A2001 7.370 9.173 -4.420 1.00 1.77 C ATOM 1755 O ASP A2001 6.377 9.446 -3.781 1.00 2.29 O ATOM 1756 CB ASP A2001 8.125 10.913 -6.006 1.00 2.29 C ATOM 1757 CG ASP A2001 8.903 12.185 -6.191 1.00 2.96 C ATOM 1758 OD1 ASP A2001 8.414 13.265 -5.780 1.00 3.24 O ATOM 1759 OD2 ASP A2001 9.998 12.153 -6.760 1.00 3.70 O ATOM 0 H ASP A2001 10.310 9.798 -5.458 1.00 2.08 H new ATOM 0 HA ASP A2001 8.366 10.977 -3.890 1.00 1.96 H new ATOM 0 HB2 ASP A2001 8.361 10.229 -6.821 1.00 2.29 H new ATOM 0 HB3 ASP A2001 7.060 11.134 -6.073 1.00 2.29 H new ATOM 1764 N SER A2002 7.626 7.971 -4.920 1.00 1.56 N ATOM 1765 CA SER A2002 6.795 6.807 -4.665 1.00 1.44 C ATOM 1766 C SER A2002 5.360 6.974 -5.198 1.00 1.26 C ATOM 1767 O SER A2002 4.465 7.376 -4.455 1.00 1.36 O ATOM 1768 CB SER A2002 6.766 6.514 -3.144 1.00 1.64 C ATOM 1769 OG SER A2002 8.084 6.477 -2.604 1.00 1.88 O ATOM 0 H SER A2002 8.427 7.777 -5.521 1.00 1.56 H new ATOM 0 HA SER A2002 7.236 5.967 -5.201 1.00 1.44 H new ATOM 0 HB2 SER A2002 6.182 7.280 -2.634 1.00 1.64 H new ATOM 0 HB3 SER A2002 6.269 5.561 -2.963 1.00 1.64 H new ATOM 0 HG SER A2002 8.464 7.380 -2.607 1.00 1.88 H new ATOM 1775 N GLN A2003 5.124 6.658 -6.455 1.00 1.23 N ATOM 1776 CA GLN A2003 3.776 6.794 -6.959 1.00 1.09 C ATOM 1777 C GLN A2003 3.139 5.423 -7.192 1.00 0.88 C ATOM 1778 O GLN A2003 3.755 4.518 -7.792 1.00 1.00 O ATOM 1779 CB GLN A2003 3.665 7.692 -8.214 1.00 1.33 C ATOM 1780 CG GLN A2003 4.168 7.092 -9.512 1.00 1.53 C ATOM 1781 CD GLN A2003 3.889 7.998 -10.690 1.00 1.86 C ATOM 1782 OE1 GLN A2003 4.718 8.827 -11.071 1.00 2.51 O ATOM 1783 NE2 GLN A2003 2.705 7.897 -11.244 1.00 1.74 N ATOM 0 H GLN A2003 5.817 6.319 -7.122 1.00 1.23 H new ATOM 0 HA GLN A2003 3.214 7.312 -6.182 1.00 1.09 H new ATOM 0 HB2 GLN A2003 2.619 7.968 -8.347 1.00 1.33 H new ATOM 0 HB3 GLN A2003 4.216 8.613 -8.026 1.00 1.33 H new ATOM 0 HG2 GLN A2003 5.240 6.911 -9.438 1.00 1.53 H new ATOM 0 HG3 GLN A2003 3.692 6.125 -9.675 1.00 1.53 H new ATOM 0 HE21 GLN A2003 2.041 7.200 -10.906 1.00 1.74 H new ATOM 0 HE22 GLN A2003 2.448 8.515 -12.013 1.00 1.74 H new ATOM 1792 N PRO A2004 1.941 5.226 -6.672 1.00 0.72 N ATOM 1793 CA PRO A2004 1.207 3.998 -6.833 1.00 0.61 C ATOM 1794 C PRO A2004 0.460 3.948 -8.145 1.00 0.60 C ATOM 1795 O PRO A2004 -0.377 4.804 -8.443 1.00 0.74 O ATOM 1796 CB PRO A2004 0.204 3.997 -5.675 1.00 0.66 C ATOM 1797 CG PRO A2004 0.394 5.293 -4.962 1.00 0.77 C ATOM 1798 CD PRO A2004 1.209 6.178 -5.854 1.00 0.83 C ATOM 0 HA PRO A2004 1.878 3.139 -6.832 1.00 0.61 H new ATOM 0 HB2 PRO A2004 -0.817 3.901 -6.044 1.00 0.66 H new ATOM 0 HB3 PRO A2004 0.382 3.155 -5.006 1.00 0.66 H new ATOM 0 HG2 PRO A2004 -0.568 5.754 -4.740 1.00 0.77 H new ATOM 0 HG3 PRO A2004 0.900 5.137 -4.009 1.00 0.77 H new ATOM 0 HD2 PRO A2004 0.580 6.831 -6.459 1.00 0.83 H new ATOM 0 HD3 PRO A2004 1.880 6.820 -5.283 1.00 0.83 H new ATOM 1806 N VAL A2005 0.774 2.986 -8.930 1.00 0.57 N ATOM 1807 CA VAL A2005 0.071 2.758 -10.141 1.00 0.59 C ATOM 1808 C VAL A2005 -0.892 1.635 -9.860 1.00 0.59 C ATOM 1809 O VAL A2005 -0.468 0.537 -9.450 1.00 0.62 O ATOM 1810 CB VAL A2005 1.031 2.365 -11.298 1.00 0.66 C ATOM 1811 CG1 VAL A2005 0.262 2.137 -12.596 1.00 0.73 C ATOM 1812 CG2 VAL A2005 2.098 3.437 -11.496 1.00 0.69 C ATOM 0 H VAL A2005 1.532 2.328 -8.751 1.00 0.57 H new ATOM 0 HA VAL A2005 -0.442 3.665 -10.461 1.00 0.59 H new ATOM 0 HB VAL A2005 1.521 1.430 -11.024 1.00 0.66 H new ATOM 0 HG11 VAL A2005 0.959 1.863 -13.388 1.00 0.73 H new ATOM 0 HG12 VAL A2005 -0.461 1.333 -12.454 1.00 0.73 H new ATOM 0 HG13 VAL A2005 -0.262 3.051 -12.874 1.00 0.73 H new ATOM 0 HG21 VAL A2005 2.761 3.144 -12.310 1.00 0.69 H new ATOM 0 HG22 VAL A2005 1.620 4.386 -11.740 1.00 0.69 H new ATOM 0 HG23 VAL A2005 2.677 3.548 -10.579 1.00 0.69 H new ATOM 1822 N PHE A2006 -2.171 1.912 -9.978 1.00 0.62 N ATOM 1823 CA PHE A2006 -3.161 0.901 -9.743 1.00 0.65 C ATOM 1824 C PHE A2006 -3.059 -0.157 -10.824 1.00 0.63 C ATOM 1825 O PHE A2006 -3.349 0.090 -11.994 1.00 0.71 O ATOM 1826 CB PHE A2006 -4.588 1.490 -9.560 1.00 0.76 C ATOM 1827 CG PHE A2006 -5.142 2.303 -10.706 1.00 0.86 C ATOM 1828 CD1 PHE A2006 -4.769 3.625 -10.883 1.00 0.91 C ATOM 1829 CD2 PHE A2006 -6.053 1.747 -11.590 1.00 1.01 C ATOM 1830 CE1 PHE A2006 -5.288 4.372 -11.920 1.00 1.08 C ATOM 1831 CE2 PHE A2006 -6.577 2.492 -12.626 1.00 1.17 C ATOM 1832 CZ PHE A2006 -6.194 3.804 -12.790 1.00 1.21 C ATOM 0 H PHE A2006 -2.543 2.827 -10.234 1.00 0.62 H new ATOM 0 HA PHE A2006 -2.959 0.416 -8.788 1.00 0.65 H new ATOM 0 HB2 PHE A2006 -5.274 0.665 -9.366 1.00 0.76 H new ATOM 0 HB3 PHE A2006 -4.585 2.118 -8.669 1.00 0.76 H new ATOM 0 HD1 PHE A2006 -4.064 4.076 -10.201 1.00 0.91 H new ATOM 0 HD2 PHE A2006 -6.356 0.718 -11.466 1.00 1.01 H new ATOM 0 HE1 PHE A2006 -4.985 5.400 -12.050 1.00 1.08 H new ATOM 0 HE2 PHE A2006 -7.287 2.047 -13.307 1.00 1.17 H new ATOM 0 HZ PHE A2006 -6.603 4.389 -13.601 1.00 1.21 H new ATOM 1842 N LEU A2007 -2.569 -1.308 -10.430 1.00 0.62 N ATOM 1843 CA LEU A2007 -2.255 -2.345 -11.358 1.00 0.71 C ATOM 1844 C LEU A2007 -3.511 -3.029 -11.777 1.00 0.81 C ATOM 1845 O LEU A2007 -3.878 -3.034 -12.950 1.00 0.97 O ATOM 1846 CB LEU A2007 -1.332 -3.349 -10.689 1.00 0.81 C ATOM 1847 CG LEU A2007 -0.522 -4.237 -11.619 1.00 0.85 C ATOM 1848 CD1 LEU A2007 0.371 -3.382 -12.497 1.00 1.29 C ATOM 1849 CD2 LEU A2007 0.306 -5.216 -10.815 1.00 1.10 C ATOM 0 H LEU A2007 -2.380 -1.543 -9.456 1.00 0.62 H new ATOM 0 HA LEU A2007 -1.763 -1.920 -12.233 1.00 0.71 H new ATOM 0 HB2 LEU A2007 -0.640 -2.804 -10.047 1.00 0.81 H new ATOM 0 HB3 LEU A2007 -1.932 -3.988 -10.041 1.00 0.81 H new ATOM 0 HG LEU A2007 -1.202 -4.803 -12.256 1.00 0.85 H new ATOM 0 HD11 LEU A2007 0.949 -4.024 -13.162 1.00 1.29 H new ATOM 0 HD12 LEU A2007 -0.243 -2.705 -13.090 1.00 1.29 H new ATOM 0 HD13 LEU A2007 1.049 -2.802 -11.871 1.00 1.29 H new ATOM 0 HD21 LEU A2007 0.882 -5.847 -11.492 1.00 1.10 H new ATOM 0 HD22 LEU A2007 0.986 -4.668 -10.163 1.00 1.10 H new ATOM 0 HD23 LEU A2007 -0.353 -5.839 -10.210 1.00 1.10 H new ATOM 1861 N SER A2008 -4.178 -3.573 -10.816 1.00 0.80 N ATOM 1862 CA SER A2008 -5.383 -4.284 -11.067 1.00 0.99 C ATOM 1863 C SER A2008 -6.274 -4.214 -9.829 1.00 0.80 C ATOM 1864 O SER A2008 -5.787 -4.141 -8.695 1.00 0.64 O ATOM 1865 CB SER A2008 -5.040 -5.748 -11.443 1.00 1.31 C ATOM 1866 OG SER A2008 -6.169 -6.465 -11.922 1.00 1.75 O ATOM 0 H SER A2008 -3.902 -3.537 -9.835 1.00 0.80 H new ATOM 0 HA SER A2008 -5.926 -3.838 -11.900 1.00 0.99 H new ATOM 0 HB2 SER A2008 -4.261 -5.751 -12.206 1.00 1.31 H new ATOM 0 HB3 SER A2008 -4.633 -6.258 -10.570 1.00 1.31 H new ATOM 0 HG SER A2008 -5.903 -7.381 -12.147 1.00 1.75 H new ATOM 1872 N PHE A2009 -7.549 -4.191 -10.049 1.00 0.90 N ATOM 1873 CA PHE A2009 -8.507 -4.186 -8.991 1.00 0.77 C ATOM 1874 C PHE A2009 -9.533 -5.245 -9.302 1.00 0.80 C ATOM 1875 O PHE A2009 -10.243 -5.170 -10.322 1.00 0.93 O ATOM 1876 CB PHE A2009 -9.168 -2.802 -8.840 1.00 0.85 C ATOM 1877 CG PHE A2009 -10.153 -2.713 -7.696 1.00 0.77 C ATOM 1878 CD1 PHE A2009 -9.718 -2.508 -6.394 1.00 0.72 C ATOM 1879 CD2 PHE A2009 -11.513 -2.828 -7.928 1.00 1.14 C ATOM 1880 CE1 PHE A2009 -10.619 -2.420 -5.351 1.00 0.81 C ATOM 1881 CE2 PHE A2009 -12.419 -2.743 -6.887 1.00 1.16 C ATOM 1882 CZ PHE A2009 -11.959 -2.562 -5.585 1.00 0.87 C ATOM 0 H PHE A2009 -7.960 -4.175 -10.982 1.00 0.90 H new ATOM 0 HA PHE A2009 -8.017 -4.400 -8.041 1.00 0.77 H new ATOM 0 HB2 PHE A2009 -8.390 -2.053 -8.695 1.00 0.85 H new ATOM 0 HB3 PHE A2009 -9.682 -2.553 -9.769 1.00 0.85 H new ATOM 0 HD1 PHE A2009 -8.661 -2.416 -6.194 1.00 0.72 H new ATOM 0 HD2 PHE A2009 -11.871 -2.986 -8.935 1.00 1.14 H new ATOM 0 HE1 PHE A2009 -10.264 -2.238 -4.347 1.00 0.81 H new ATOM 0 HE2 PHE A2009 -13.479 -2.817 -7.083 1.00 1.16 H new ATOM 0 HZ PHE A2009 -12.658 -2.534 -4.763 1.00 0.87 H new ATOM 1892 N ASP A2010 -9.604 -6.214 -8.449 1.00 0.74 N ATOM 1893 CA ASP A2010 -10.498 -7.328 -8.616 1.00 0.83 C ATOM 1894 C ASP A2010 -11.826 -7.006 -7.967 1.00 0.88 C ATOM 1895 O ASP A2010 -11.880 -6.713 -6.777 1.00 0.97 O ATOM 1896 CB ASP A2010 -9.882 -8.591 -7.996 1.00 0.97 C ATOM 1897 CG ASP A2010 -10.798 -9.788 -8.046 1.00 1.63 C ATOM 1898 OD1 ASP A2010 -11.592 -9.954 -7.134 1.00 2.43 O ATOM 1899 OD2 ASP A2010 -10.710 -10.597 -9.003 1.00 2.01 O ATOM 0 H ASP A2010 -9.037 -6.261 -7.602 1.00 0.74 H new ATOM 0 HA ASP A2010 -10.660 -7.513 -9.678 1.00 0.83 H new ATOM 0 HB2 ASP A2010 -8.956 -8.829 -8.519 1.00 0.97 H new ATOM 0 HB3 ASP A2010 -9.619 -8.387 -6.958 1.00 0.97 H new ATOM 1904 N GLU A2011 -12.879 -7.032 -8.753 1.00 1.03 N ATOM 1905 CA GLU A2011 -14.218 -6.719 -8.273 1.00 1.24 C ATOM 1906 C GLU A2011 -14.848 -7.928 -7.578 1.00 1.30 C ATOM 1907 O GLU A2011 -15.714 -7.772 -6.713 1.00 1.46 O ATOM 1908 CB GLU A2011 -15.120 -6.289 -9.435 1.00 1.52 C ATOM 1909 CG GLU A2011 -15.258 -7.353 -10.517 1.00 1.76 C ATOM 1910 CD GLU A2011 -16.340 -7.068 -11.501 1.00 2.09 C ATOM 1911 OE1 GLU A2011 -17.520 -7.324 -11.199 1.00 2.23 O ATOM 1912 OE2 GLU A2011 -16.027 -6.569 -12.608 1.00 2.75 O ATOM 0 H GLU A2011 -12.837 -7.270 -9.744 1.00 1.03 H new ATOM 0 HA GLU A2011 -14.127 -5.901 -7.558 1.00 1.24 H new ATOM 0 HB2 GLU A2011 -16.109 -6.045 -9.047 1.00 1.52 H new ATOM 0 HB3 GLU A2011 -14.718 -5.378 -9.880 1.00 1.52 H new ATOM 0 HG2 GLU A2011 -14.310 -7.444 -11.048 1.00 1.76 H new ATOM 0 HG3 GLU A2011 -15.452 -8.316 -10.045 1.00 1.76 H new ATOM 1919 N GLN A2012 -14.392 -9.114 -7.967 1.00 1.32 N ATOM 1920 CA GLN A2012 -14.917 -10.391 -7.498 1.00 1.52 C ATOM 1921 C GLN A2012 -14.829 -10.494 -5.988 1.00 1.49 C ATOM 1922 O GLN A2012 -15.835 -10.619 -5.307 1.00 1.71 O ATOM 1923 CB GLN A2012 -14.123 -11.536 -8.146 1.00 1.75 C ATOM 1924 CG GLN A2012 -14.650 -12.930 -7.878 1.00 2.10 C ATOM 1925 CD GLN A2012 -16.030 -13.133 -8.442 1.00 2.62 C ATOM 1926 OE1 GLN A2012 -17.028 -12.916 -7.773 1.00 3.40 O ATOM 1927 NE2 GLN A2012 -16.099 -13.515 -9.678 1.00 2.81 N ATOM 0 H GLN A2012 -13.627 -9.216 -8.634 1.00 1.32 H new ATOM 0 HA GLN A2012 -15.967 -10.461 -7.782 1.00 1.52 H new ATOM 0 HB2 GLN A2012 -14.102 -11.376 -9.224 1.00 1.75 H new ATOM 0 HB3 GLN A2012 -13.092 -11.483 -7.796 1.00 1.75 H new ATOM 0 HG2 GLN A2012 -13.970 -13.663 -8.312 1.00 2.10 H new ATOM 0 HG3 GLN A2012 -14.668 -13.109 -6.803 1.00 2.10 H new ATOM 0 HE21 GLN A2012 -15.244 -13.687 -10.207 1.00 2.81 H new ATOM 0 HE22 GLN A2012 -17.008 -13.643 -10.122 1.00 2.81 H new ATOM 1936 N THR A2013 -13.643 -10.412 -5.488 1.00 1.37 N ATOM 1937 CA THR A2013 -13.394 -10.533 -4.084 1.00 1.47 C ATOM 1938 C THR A2013 -12.836 -9.204 -3.540 1.00 1.37 C ATOM 1939 O THR A2013 -12.206 -9.151 -2.496 1.00 1.57 O ATOM 1940 CB THR A2013 -12.459 -11.778 -3.812 1.00 1.72 C ATOM 1941 OG1 THR A2013 -12.116 -11.943 -2.433 1.00 1.95 O ATOM 1942 CG2 THR A2013 -11.203 -11.757 -4.655 1.00 1.76 C ATOM 0 H THR A2013 -12.804 -10.257 -6.047 1.00 1.37 H new ATOM 0 HA THR A2013 -14.321 -10.723 -3.542 1.00 1.47 H new ATOM 0 HB THR A2013 -13.059 -12.639 -4.106 1.00 1.72 H new ATOM 0 HG1 THR A2013 -12.813 -11.542 -1.872 1.00 1.95 H new ATOM 0 HG21 THR A2013 -10.598 -12.635 -4.428 1.00 1.76 H new ATOM 0 HG22 THR A2013 -11.473 -11.766 -5.711 1.00 1.76 H new ATOM 0 HG23 THR A2013 -10.632 -10.855 -4.434 1.00 1.76 H new ATOM 1950 N CYS A2014 -13.085 -8.124 -4.296 1.00 1.20 N ATOM 1951 CA CYS A2014 -12.733 -6.746 -3.891 1.00 1.22 C ATOM 1952 C CYS A2014 -11.251 -6.622 -3.480 1.00 1.19 C ATOM 1953 O CYS A2014 -10.892 -5.873 -2.563 1.00 1.49 O ATOM 1954 CB CYS A2014 -13.682 -6.285 -2.769 1.00 1.49 C ATOM 1955 SG CYS A2014 -15.451 -6.257 -3.266 1.00 1.65 S ATOM 0 H CYS A2014 -13.537 -8.177 -5.209 1.00 1.20 H new ATOM 0 HA CYS A2014 -12.860 -6.088 -4.751 1.00 1.22 H new ATOM 0 HB2 CYS A2014 -13.565 -6.947 -1.911 1.00 1.49 H new ATOM 0 HB3 CYS A2014 -13.389 -5.287 -2.444 1.00 1.49 H new ATOM 1960 N THR A2015 -10.399 -7.320 -4.204 1.00 1.02 N ATOM 1961 CA THR A2015 -8.986 -7.354 -3.921 1.00 1.04 C ATOM 1962 C THR A2015 -8.240 -6.290 -4.730 1.00 0.96 C ATOM 1963 O THR A2015 -8.417 -6.178 -5.946 1.00 1.08 O ATOM 1964 CB THR A2015 -8.427 -8.752 -4.242 1.00 1.15 C ATOM 1965 OG1 THR A2015 -9.131 -9.730 -3.459 1.00 1.56 O ATOM 1966 CG2 THR A2015 -6.936 -8.843 -3.941 1.00 1.39 C ATOM 0 H THR A2015 -10.674 -7.882 -5.010 1.00 1.02 H new ATOM 0 HA THR A2015 -8.839 -7.139 -2.863 1.00 1.04 H new ATOM 0 HB THR A2015 -8.567 -8.940 -5.306 1.00 1.15 H new ATOM 0 HG1 THR A2015 -8.681 -10.597 -3.537 1.00 1.56 H new ATOM 0 HG21 THR A2015 -6.577 -9.844 -4.180 1.00 1.39 H new ATOM 0 HG22 THR A2015 -6.398 -8.111 -4.543 1.00 1.39 H new ATOM 0 HG23 THR A2015 -6.765 -8.639 -2.884 1.00 1.39 H new ATOM 1974 N SER A2016 -7.440 -5.511 -4.059 1.00 0.87 N ATOM 1975 CA SER A2016 -6.662 -4.499 -4.702 1.00 0.83 C ATOM 1976 C SER A2016 -5.236 -5.010 -4.983 1.00 0.71 C ATOM 1977 O SER A2016 -4.651 -5.718 -4.157 1.00 0.74 O ATOM 1978 CB SER A2016 -6.615 -3.287 -3.789 1.00 0.87 C ATOM 1979 OG SER A2016 -7.924 -2.881 -3.431 1.00 1.36 O ATOM 0 H SER A2016 -7.311 -5.563 -3.049 1.00 0.87 H new ATOM 0 HA SER A2016 -7.115 -4.234 -5.657 1.00 0.83 H new ATOM 0 HB2 SER A2016 -6.044 -3.523 -2.891 1.00 0.87 H new ATOM 0 HB3 SER A2016 -6.099 -2.468 -4.289 1.00 0.87 H new ATOM 0 HG SER A2016 -8.472 -2.794 -4.239 1.00 1.36 H new ATOM 1985 N TYR A2017 -4.726 -4.708 -6.162 1.00 0.64 N ATOM 1986 CA TYR A2017 -3.348 -4.990 -6.539 1.00 0.57 C ATOM 1987 C TYR A2017 -2.714 -3.702 -7.020 1.00 0.49 C ATOM 1988 O TYR A2017 -3.096 -3.158 -8.078 1.00 0.56 O ATOM 1989 CB TYR A2017 -3.255 -6.034 -7.665 1.00 0.71 C ATOM 1990 CG TYR A2017 -3.598 -7.449 -7.277 1.00 0.86 C ATOM 1991 CD1 TYR A2017 -2.658 -8.288 -6.698 1.00 0.92 C ATOM 1992 CD2 TYR A2017 -4.885 -7.933 -7.462 1.00 1.01 C ATOM 1993 CE1 TYR A2017 -2.991 -9.573 -6.322 1.00 1.09 C ATOM 1994 CE2 TYR A2017 -5.227 -9.209 -7.084 1.00 1.18 C ATOM 1995 CZ TYR A2017 -4.178 -10.078 -6.611 1.00 1.20 C ATOM 1996 OH TYR A2017 -4.627 -11.306 -6.123 1.00 1.38 O ATOM 0 H TYR A2017 -5.264 -4.252 -6.899 1.00 0.64 H new ATOM 0 HA TYR A2017 -2.833 -5.393 -5.667 1.00 0.57 H new ATOM 0 HB2 TYR A2017 -3.918 -5.728 -8.474 1.00 0.71 H new ATOM 0 HB3 TYR A2017 -2.240 -6.022 -8.063 1.00 0.71 H new ATOM 0 HD1 TYR A2017 -1.651 -7.931 -6.539 1.00 0.92 H new ATOM 0 HD2 TYR A2017 -5.632 -7.295 -7.911 1.00 1.01 H new ATOM 0 HE1 TYR A2017 -2.273 -10.174 -5.785 1.00 1.09 H new ATOM 0 HE2 TYR A2017 -6.250 -9.551 -7.139 1.00 1.18 H new ATOM 0 HH TYR A2017 -5.530 -11.482 -6.461 1.00 1.38 H new ATOM 2006 N PHE A2018 -1.783 -3.188 -6.276 1.00 0.39 N ATOM 2007 CA PHE A2018 -1.172 -1.935 -6.648 1.00 0.39 C ATOM 2008 C PHE A2018 0.309 -2.089 -6.843 1.00 0.36 C ATOM 2009 O PHE A2018 0.971 -2.799 -6.090 1.00 0.40 O ATOM 2010 CB PHE A2018 -1.475 -0.836 -5.619 1.00 0.47 C ATOM 2011 CG PHE A2018 -2.948 -0.595 -5.407 1.00 0.57 C ATOM 2012 CD1 PHE A2018 -3.789 -0.387 -6.478 1.00 0.74 C ATOM 2013 CD2 PHE A2018 -3.483 -0.580 -4.133 1.00 0.74 C ATOM 2014 CE1 PHE A2018 -5.136 -0.169 -6.284 1.00 0.89 C ATOM 2015 CE2 PHE A2018 -4.825 -0.360 -3.929 1.00 0.87 C ATOM 2016 CZ PHE A2018 -5.657 -0.150 -5.029 1.00 0.87 C ATOM 0 H PHE A2018 -1.428 -3.606 -5.416 1.00 0.39 H new ATOM 0 HA PHE A2018 -1.608 -1.630 -7.600 1.00 0.39 H new ATOM 0 HB2 PHE A2018 -1.019 -1.106 -4.667 1.00 0.47 H new ATOM 0 HB3 PHE A2018 -1.007 0.093 -5.944 1.00 0.47 H new ATOM 0 HD1 PHE A2018 -3.388 -0.395 -7.481 1.00 0.74 H new ATOM 0 HD2 PHE A2018 -2.837 -0.744 -3.284 1.00 0.74 H new ATOM 0 HE1 PHE A2018 -5.782 -0.012 -7.135 1.00 0.89 H new ATOM 0 HE2 PHE A2018 -5.231 -0.350 -2.928 1.00 0.87 H new ATOM 0 HZ PHE A2018 -6.712 0.027 -4.884 1.00 0.87 H new ATOM 2026 N SER A2019 0.820 -1.440 -7.851 1.00 0.45 N ATOM 2027 CA SER A2019 2.211 -1.475 -8.147 1.00 0.47 C ATOM 2028 C SER A2019 2.761 -0.100 -7.811 1.00 0.45 C ATOM 2029 O SER A2019 2.464 0.890 -8.484 1.00 0.49 O ATOM 2030 CB SER A2019 2.419 -1.811 -9.627 1.00 0.51 C ATOM 2031 OG SER A2019 3.768 -2.137 -9.903 1.00 1.24 O ATOM 0 H SER A2019 0.271 -0.868 -8.493 1.00 0.45 H new ATOM 0 HA SER A2019 2.728 -2.241 -7.569 1.00 0.47 H new ATOM 0 HB2 SER A2019 1.778 -2.648 -9.904 1.00 0.51 H new ATOM 0 HB3 SER A2019 2.117 -0.961 -10.239 1.00 0.51 H new ATOM 0 HG SER A2019 3.865 -2.348 -10.855 1.00 1.24 H new ATOM 2037 N TRP A2020 3.502 -0.022 -6.767 1.00 0.52 N ATOM 2038 CA TRP A2020 3.961 1.237 -6.280 1.00 0.57 C ATOM 2039 C TRP A2020 5.396 1.442 -6.732 1.00 0.49 C ATOM 2040 O TRP A2020 6.294 0.717 -6.316 1.00 0.43 O ATOM 2041 CB TRP A2020 3.840 1.238 -4.759 1.00 0.69 C ATOM 2042 CG TRP A2020 3.676 2.571 -4.124 1.00 0.88 C ATOM 2043 CD1 TRP A2020 4.481 3.659 -4.217 1.00 0.81 C ATOM 2044 CD2 TRP A2020 2.618 2.928 -3.238 1.00 1.75 C ATOM 2045 NE1 TRP A2020 3.943 4.693 -3.492 1.00 1.00 N ATOM 2046 CE2 TRP A2020 2.812 4.260 -2.868 1.00 1.65 C ATOM 2047 CE3 TRP A2020 1.506 2.243 -2.737 1.00 2.75 C ATOM 2048 CZ2 TRP A2020 1.938 4.928 -2.016 1.00 2.41 C ATOM 2049 CZ3 TRP A2020 0.647 2.905 -1.892 1.00 3.55 C ATOM 2050 CH2 TRP A2020 0.867 4.237 -1.539 1.00 3.35 C ATOM 0 H TRP A2020 3.811 -0.827 -6.222 1.00 0.52 H new ATOM 0 HA TRP A2020 3.363 2.059 -6.673 1.00 0.57 H new ATOM 0 HB2 TRP A2020 2.989 0.617 -4.481 1.00 0.69 H new ATOM 0 HB3 TRP A2020 4.729 0.765 -4.342 1.00 0.69 H new ATOM 0 HD1 TRP A2020 5.404 3.705 -4.776 1.00 0.81 H new ATOM 0 HE1 TRP A2020 4.329 5.635 -3.430 1.00 1.00 H new ATOM 0 HE3 TRP A2020 1.326 1.213 -3.009 1.00 2.75 H new ATOM 0 HZ2 TRP A2020 2.104 5.960 -1.743 1.00 2.41 H new ATOM 0 HZ3 TRP A2020 -0.212 2.385 -1.495 1.00 3.55 H new ATOM 0 HH2 TRP A2020 0.173 4.730 -0.874 1.00 3.35 H new ATOM 2061 N HIS A2021 5.594 2.395 -7.616 1.00 0.61 N ATOM 2062 CA HIS A2021 6.912 2.694 -8.145 1.00 0.66 C ATOM 2063 C HIS A2021 7.637 3.609 -7.196 1.00 0.64 C ATOM 2064 O HIS A2021 7.362 4.808 -7.130 1.00 0.81 O ATOM 2065 CB HIS A2021 6.852 3.323 -9.554 1.00 0.86 C ATOM 2066 CG HIS A2021 6.315 2.417 -10.622 1.00 0.93 C ATOM 2067 ND1 HIS A2021 5.673 2.870 -11.746 1.00 1.53 N ATOM 2068 CD2 HIS A2021 6.355 1.077 -10.740 1.00 1.33 C ATOM 2069 CE1 HIS A2021 5.338 1.843 -12.499 1.00 1.61 C ATOM 2070 NE2 HIS A2021 5.742 0.753 -11.907 1.00 1.43 N ATOM 0 H HIS A2021 4.850 2.985 -7.989 1.00 0.61 H new ATOM 0 HA HIS A2021 7.453 1.753 -8.241 1.00 0.66 H new ATOM 0 HB2 HIS A2021 6.233 4.219 -9.511 1.00 0.86 H new ATOM 0 HB3 HIS A2021 7.855 3.642 -9.838 1.00 0.86 H new ATOM 0 HD2 HIS A2021 6.794 0.386 -10.036 1.00 1.33 H new ATOM 0 HE1 HIS A2021 4.818 1.894 -13.444 1.00 1.61 H new ATOM 0 HE2 HIS A2021 5.617 -0.194 -12.265 1.00 1.43 H new ATOM 2079 N THR A2022 8.487 3.033 -6.413 1.00 0.51 N ATOM 2080 CA THR A2022 9.238 3.750 -5.438 1.00 0.50 C ATOM 2081 C THR A2022 10.628 3.165 -5.264 1.00 0.48 C ATOM 2082 O THR A2022 10.767 1.993 -4.957 1.00 0.50 O ATOM 2083 CB THR A2022 8.496 3.780 -4.076 1.00 0.53 C ATOM 2084 OG1 THR A2022 9.369 4.228 -3.047 1.00 0.63 O ATOM 2085 CG2 THR A2022 7.886 2.434 -3.699 1.00 0.56 C ATOM 0 H THR A2022 8.683 2.032 -6.433 1.00 0.51 H new ATOM 0 HA THR A2022 9.344 4.773 -5.800 1.00 0.50 H new ATOM 0 HB THR A2022 7.669 4.481 -4.187 1.00 0.53 H new ATOM 0 HG1 THR A2022 9.133 5.145 -2.794 1.00 0.63 H new ATOM 0 HG21 THR A2022 7.381 2.520 -2.737 1.00 0.56 H new ATOM 0 HG22 THR A2022 7.166 2.135 -4.461 1.00 0.56 H new ATOM 0 HG23 THR A2022 8.674 1.684 -3.630 1.00 0.56 H new ATOM 2093 N SER A2023 11.663 3.966 -5.423 1.00 0.55 N ATOM 2094 CA SER A2023 13.015 3.482 -5.177 1.00 0.60 C ATOM 2095 C SER A2023 13.376 3.631 -3.683 1.00 0.59 C ATOM 2096 O SER A2023 14.539 3.650 -3.289 1.00 0.75 O ATOM 2097 CB SER A2023 14.010 4.174 -6.105 1.00 0.85 C ATOM 2098 OG SER A2023 13.792 5.560 -6.133 1.00 1.21 O ATOM 0 H SER A2023 11.601 4.941 -5.717 1.00 0.55 H new ATOM 0 HA SER A2023 13.066 2.418 -5.407 1.00 0.60 H new ATOM 0 HB2 SER A2023 15.027 3.969 -5.771 1.00 0.85 H new ATOM 0 HB3 SER A2023 13.917 3.767 -7.112 1.00 0.85 H new ATOM 0 HG SER A2023 14.438 6.005 -5.546 1.00 1.21 H new ATOM 2104 N LEU A2024 12.343 3.743 -2.880 1.00 0.61 N ATOM 2105 CA LEU A2024 12.439 3.746 -1.449 1.00 0.74 C ATOM 2106 C LEU A2024 11.972 2.342 -0.960 1.00 0.76 C ATOM 2107 O LEU A2024 12.187 1.948 0.180 1.00 0.93 O ATOM 2108 CB LEU A2024 11.584 4.960 -0.919 1.00 0.91 C ATOM 2109 CG LEU A2024 11.421 5.221 0.599 1.00 0.78 C ATOM 2110 CD1 LEU A2024 10.379 4.312 1.207 1.00 1.53 C ATOM 2111 CD2 LEU A2024 12.753 5.093 1.331 1.00 1.11 C ATOM 0 H LEU A2024 11.386 3.837 -3.221 1.00 0.61 H new ATOM 0 HA LEU A2024 13.448 3.894 -1.063 1.00 0.74 H new ATOM 0 HB2 LEU A2024 12.010 5.864 -1.354 1.00 0.91 H new ATOM 0 HB3 LEU A2024 10.582 4.849 -1.333 1.00 0.91 H new ATOM 0 HG LEU A2024 11.074 6.248 0.716 1.00 0.78 H new ATOM 0 HD11 LEU A2024 10.290 4.522 2.273 1.00 1.53 H new ATOM 0 HD12 LEU A2024 9.418 4.484 0.722 1.00 1.53 H new ATOM 0 HD13 LEU A2024 10.676 3.273 1.065 1.00 1.53 H new ATOM 0 HD21 LEU A2024 12.604 5.282 2.394 1.00 1.11 H new ATOM 0 HD22 LEU A2024 13.148 4.087 1.194 1.00 1.11 H new ATOM 0 HD23 LEU A2024 13.460 5.819 0.929 1.00 1.11 H new ATOM 2123 N ALA A2025 11.378 1.581 -1.891 1.00 0.66 N ATOM 2124 CA ALA A2025 10.900 0.216 -1.634 1.00 0.72 C ATOM 2125 C ALA A2025 12.043 -0.768 -1.680 1.00 0.85 C ATOM 2126 O ALA A2025 12.101 -1.704 -0.910 1.00 1.20 O ATOM 2127 CB ALA A2025 9.886 -0.170 -2.673 1.00 0.64 C ATOM 0 H ALA A2025 11.215 1.897 -2.847 1.00 0.66 H new ATOM 0 HA ALA A2025 10.449 0.194 -0.642 1.00 0.72 H new ATOM 0 HB1 ALA A2025 9.534 -1.183 -2.479 1.00 0.64 H new ATOM 0 HB2 ALA A2025 9.044 0.521 -2.634 1.00 0.64 H new ATOM 0 HB3 ALA A2025 10.344 -0.128 -3.661 1.00 0.64 H new ATOM 2133 N CYS A2026 12.915 -0.560 -2.611 1.00 0.90 N ATOM 2134 CA CYS A2026 14.093 -1.346 -2.760 1.00 1.05 C ATOM 2135 C CYS A2026 15.154 -0.367 -3.129 1.00 1.23 C ATOM 2136 O CYS A2026 14.807 0.733 -3.562 1.00 1.55 O ATOM 2137 CB CYS A2026 13.916 -2.480 -3.816 1.00 1.61 C ATOM 2138 SG CYS A2026 14.964 -2.376 -5.319 1.00 2.15 S ATOM 0 H CYS A2026 12.825 0.181 -3.306 1.00 0.90 H new ATOM 0 HA CYS A2026 14.348 -1.883 -1.846 1.00 1.05 H new ATOM 0 HB2 CYS A2026 14.115 -3.434 -3.328 1.00 1.61 H new ATOM 0 HB3 CYS A2026 12.872 -2.494 -4.129 1.00 1.61 H new ATOM 2143 N GLU A2027 16.401 -0.710 -2.978 1.00 1.51 N ATOM 2144 CA GLU A2027 17.435 0.252 -3.199 1.00 2.04 C ATOM 2145 C GLU A2027 17.660 0.424 -4.688 1.00 2.41 C ATOM 2146 O GLU A2027 17.380 1.487 -5.241 1.00 2.90 O ATOM 2147 CB GLU A2027 18.705 -0.168 -2.471 1.00 2.28 C ATOM 2148 CG GLU A2027 19.798 0.869 -2.516 1.00 2.97 C ATOM 2149 CD GLU A2027 20.973 0.494 -1.682 1.00 3.42 C ATOM 2150 OE1 GLU A2027 20.919 0.664 -0.447 1.00 3.72 O ATOM 2151 OE2 GLU A2027 21.982 0.028 -2.229 1.00 3.85 O ATOM 0 H GLU A2027 16.722 -1.639 -2.706 1.00 1.51 H new ATOM 0 HA GLU A2027 17.135 1.219 -2.794 1.00 2.04 H new ATOM 0 HB2 GLU A2027 18.463 -0.383 -1.430 1.00 2.28 H new ATOM 0 HB3 GLU A2027 19.076 -1.094 -2.910 1.00 2.28 H new ATOM 0 HG2 GLU A2027 20.119 1.010 -3.548 1.00 2.97 H new ATOM 0 HG3 GLU A2027 19.402 1.825 -2.172 1.00 2.97 H new ATOM 2158 N GLU A2028 18.087 -0.663 -5.322 1.00 2.55 N ATOM 2159 CA GLU A2028 18.350 -0.745 -6.742 1.00 3.01 C ATOM 2160 C GLU A2028 19.307 0.366 -7.211 1.00 3.22 C ATOM 2161 O GLU A2028 20.530 0.228 -7.126 1.00 3.86 O ATOM 2162 CB GLU A2028 17.025 -0.744 -7.514 1.00 3.98 C ATOM 2163 CG GLU A2028 17.136 -1.082 -8.966 1.00 4.60 C ATOM 2164 CD GLU A2028 17.746 -2.434 -9.190 1.00 5.42 C ATOM 2165 OE1 GLU A2028 17.076 -3.468 -8.947 1.00 5.87 O ATOM 2166 OE2 GLU A2028 18.905 -2.493 -9.628 1.00 5.90 O ATOM 0 H GLU A2028 18.264 -1.542 -4.836 1.00 2.55 H new ATOM 0 HA GLU A2028 18.862 -1.684 -6.951 1.00 3.01 H new ATOM 0 HB2 GLU A2028 16.347 -1.455 -7.042 1.00 3.98 H new ATOM 0 HB3 GLU A2028 16.569 0.241 -7.420 1.00 3.98 H new ATOM 0 HG2 GLU A2028 16.146 -1.053 -9.420 1.00 4.60 H new ATOM 0 HG3 GLU A2028 17.740 -0.326 -9.468 1.00 4.60 H new ATOM 2173 N GLU A2029 18.751 1.475 -7.616 1.00 3.21 N ATOM 2174 CA GLU A2029 19.493 2.603 -8.063 1.00 3.93 C ATOM 2175 C GLU A2029 18.833 3.819 -7.490 1.00 4.11 C ATOM 2176 O GLU A2029 17.854 4.316 -8.056 1.00 3.96 O ATOM 2177 CB GLU A2029 19.523 2.700 -9.595 1.00 4.45 C ATOM 2178 CG GLU A2029 20.166 1.519 -10.291 1.00 5.45 C ATOM 2179 CD GLU A2029 20.151 1.658 -11.781 1.00 6.38 C ATOM 2180 OE1 GLU A2029 21.070 2.292 -12.345 1.00 6.91 O ATOM 2181 OE2 GLU A2029 19.215 1.148 -12.428 1.00 6.80 O ATOM 0 H GLU A2029 17.741 1.614 -7.642 1.00 3.21 H new ATOM 0 HA GLU A2029 20.528 2.513 -7.733 1.00 3.93 H new ATOM 0 HB2 GLU A2029 18.501 2.807 -9.959 1.00 4.45 H new ATOM 0 HB3 GLU A2029 20.058 3.607 -9.878 1.00 4.45 H new ATOM 0 HG2 GLU A2029 21.196 1.415 -9.949 1.00 5.45 H new ATOM 0 HG3 GLU A2029 19.643 0.605 -10.009 1.00 5.45 H new ATOM 2188 N VAL A2030 19.286 4.226 -6.326 1.00 4.83 N ATOM 2189 CA VAL A2030 18.762 5.404 -5.663 1.00 5.43 C ATOM 2190 C VAL A2030 19.115 6.629 -6.496 1.00 6.11 C ATOM 2191 O VAL A2030 20.286 6.992 -6.606 1.00 6.82 O ATOM 2192 CB VAL A2030 19.330 5.553 -4.218 1.00 6.26 C ATOM 2193 CG1 VAL A2030 18.803 6.811 -3.538 1.00 7.15 C ATOM 2194 CG2 VAL A2030 18.989 4.329 -3.385 1.00 6.37 C ATOM 0 H VAL A2030 20.027 3.752 -5.810 1.00 4.83 H new ATOM 0 HA VAL A2030 17.680 5.305 -5.575 1.00 5.43 H new ATOM 0 HB VAL A2030 20.414 5.641 -4.297 1.00 6.26 H new ATOM 0 HG11 VAL A2030 19.219 6.883 -2.533 1.00 7.15 H new ATOM 0 HG12 VAL A2030 19.097 7.687 -4.116 1.00 7.15 H new ATOM 0 HG13 VAL A2030 17.716 6.764 -3.478 1.00 7.15 H new ATOM 0 HG21 VAL A2030 19.393 4.449 -2.380 1.00 6.37 H new ATOM 0 HG22 VAL A2030 17.906 4.216 -3.330 1.00 6.37 H new ATOM 0 HG23 VAL A2030 19.423 3.442 -3.847 1.00 6.37 H new ATOM 2204 N PRO A2031 18.114 7.276 -7.091 1.00 6.17 N ATOM 2205 CA PRO A2031 18.310 8.392 -8.000 1.00 7.02 C ATOM 2206 C PRO A2031 18.405 9.723 -7.275 1.00 7.96 C ATOM 2207 O PRO A2031 18.262 10.773 -7.894 1.00 8.70 O ATOM 2208 CB PRO A2031 17.045 8.345 -8.845 1.00 6.96 C ATOM 2209 CG PRO A2031 15.992 7.872 -7.900 1.00 6.35 C ATOM 2210 CD PRO A2031 16.679 6.971 -6.912 1.00 5.74 C ATOM 0 HA PRO A2031 19.240 8.312 -8.564 1.00 7.02 H new ATOM 0 HB2 PRO A2031 16.802 9.326 -9.254 1.00 6.96 H new ATOM 0 HB3 PRO A2031 17.156 7.666 -9.690 1.00 6.96 H new ATOM 0 HG2 PRO A2031 15.519 8.713 -7.394 1.00 6.35 H new ATOM 0 HG3 PRO A2031 15.206 7.337 -8.432 1.00 6.35 H new ATOM 0 HD2 PRO A2031 16.352 7.173 -5.892 1.00 5.74 H new ATOM 0 HD3 PRO A2031 16.466 5.921 -7.113 1.00 5.74 H new ATOM 2218 N ARG A2032 18.697 9.656 -5.976 1.00 8.09 N ATOM 2219 CA ARG A2032 18.794 10.820 -5.103 1.00 9.10 C ATOM 2220 C ARG A2032 17.433 11.478 -4.983 1.00 9.66 C ATOM 2221 O ARG A2032 17.156 12.450 -5.702 1.00 10.08 O ATOM 2222 CB ARG A2032 19.872 11.841 -5.572 1.00 9.37 C ATOM 2223 CG ARG A2032 21.348 11.449 -5.353 1.00 9.14 C ATOM 2224 CD ARG A2032 21.780 10.171 -6.080 1.00 9.28 C ATOM 2225 NE ARG A2032 21.590 10.240 -7.545 1.00 9.46 N ATOM 2226 CZ ARG A2032 21.916 9.251 -8.400 1.00 9.76 C ATOM 2227 NH1 ARG A2032 22.646 8.226 -7.987 1.00 9.89 N ATOM 2228 NH2 ARG A2032 21.552 9.323 -9.681 1.00 10.17 N ATOM 0 H ARG A2032 18.875 8.774 -5.495 1.00 8.09 H new ATOM 0 HA ARG A2032 19.119 10.472 -4.122 1.00 9.10 H new ATOM 0 HB2 ARG A2032 19.724 12.025 -6.636 1.00 9.37 H new ATOM 0 HB3 ARG A2032 19.692 12.785 -5.057 1.00 9.37 H new ATOM 0 HG2 ARG A2032 21.982 12.272 -5.683 1.00 9.14 H new ATOM 0 HG3 ARG A2032 21.522 11.321 -4.285 1.00 9.14 H new ATOM 0 HD2 ARG A2032 22.831 9.977 -5.865 1.00 9.28 H new ATOM 0 HD3 ARG A2032 21.213 9.328 -5.686 1.00 9.28 H new ATOM 0 HE ARG A2032 21.186 11.092 -7.934 1.00 9.46 H new ATOM 0 HH11 ARG A2032 22.963 8.183 -7.019 1.00 9.89 H new ATOM 0 HH12 ARG A2032 22.891 7.479 -8.637 1.00 9.89 H new ATOM 0 HH21 ARG A2032 21.025 10.129 -10.017 1.00 10.17 H new ATOM 0 HH22 ARG A2032 21.801 8.572 -10.325 1.00 10.17 H new TER 2242 ARG A2032