USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1026 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A2002 SER OG : rot 43:sc= 1.65 USER MOD Set 1.2: A2022 THR OG1 : rot 97:sc= 1.11 USER MOD Set 2.1: A2003 GLN : amide:sc= -1.18 K(o=-1.7,f=-2.5) USER MOD Set 2.2: A2021 HIS : no HE2:sc= -0.5 K(o=-1.7,f=-3.1) USER MOD Set 3.1: A1991 SER OG : rot -170:sc= 1.01 USER MOD Set 3.2: A2019 SER OG : rot -42:sc= 1.12 USER MOD Set 4.1: A1984 MET CE :methyl -139:sc= -0.073 (180deg=-0.497) USER MOD Set 4.2: A2013 THR OG1 : rot 22:sc= 0.666 USER MOD Set 4.3: A2015 THR OG1 : rot 180:sc= -0.315 USER MOD Set 5.1: A1913 SER OG : rot 130:sc= 1.15 USER MOD Set 5.2: A1935 SER OG : rot 150:sc= 1.11 USER MOD Set 6.1: A1897 ASN : amide:sc= -2.19 X(o=-0.49,f=-0.48) USER MOD Set 6.2: A1900 THR OG1 : rot -46:sc= 1 USER MOD Set 6.3: A1966 GLN : amide:sc= 0.693 K(o=-0.49,f=-1.5) USER MOD Single : A1887 SER OG : rot 180:sc= 0 USER MOD Single : A1888 ASN : amide:sc= -0.675 K(o=-0.68,f=-4.1!) USER MOD Single : A1890 GLN : amide:sc= -1.9! C(o=-1.9!,f=-6.1!) 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 HD1:sc= 0 X(o=0,f=-0.3) USER MOD Single : A1907 THR OG1 : rot -98:sc= 1.26 USER MOD Single : A1908 SER OG : rot -160:sc= 0.0667 USER MOD Single : A1910 LYS NZ :NH3+ 175:sc= 2.33 (180deg=2.14) USER MOD Single : A1915 TYR OH : rot -140:sc= 1.35 USER MOD Single : A1916 THR OG1 : rot 95:sc= 0.423 USER MOD Single : A1918 THR OG1 : rot 180:sc= 0 USER MOD Single : A1920 SER OG : rot 180:sc= 0 USER MOD Single : A1921 HIS : no HE2:sc= 1.13 K(o=1.1,f=-4.1!) USER MOD Single : A1922 ASN : amide:sc= -0.637 K(o=-0.64,f=0) USER MOD Single : A1924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1928 ASN : amide:sc= 1.06 K(o=1.1,f=-6.8!) USER MOD Single : A1934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1936 SER OG : rot 121:sc= 0.528 USER MOD Single : A1939 ASN : amide:sc= -0.674 K(o=-0.67,f=0) USER MOD Single : A1946 THR OG1 : rot 180:sc= 0 USER MOD Single : A1950 LYS NZ :NH3+ 171:sc= -0.0175 (180deg=-0.142) USER MOD Single : A1951 THR OG1 : rot 180:sc= -0.0351 USER MOD Single : A1953 ASN : amide:sc= -0.102 K(o=-0.1,f=-7.9!) USER MOD Single : A1956 LYS NZ :NH3+ 164:sc= -0.0418 (180deg=-0.314) USER MOD Single : A1958 SER OG : rot 64:sc= 0.651 USER MOD Single : A1959 LYS NZ :NH3+ -138:sc= -0.107 (180deg=-0.291!) USER MOD Single : A1960 THR OG1 : rot 180:sc= 0 USER MOD Single : A1962 THR OG1 : rot 180:sc= 0 USER MOD Single : A1963 TYR OH : rot 180:sc= 0 USER MOD Single : A1969 LYS NZ :NH3+ -148:sc= 1.25 (180deg=-1.21!) USER MOD Single : A1972 TYR OH : rot 49:sc= -3.83! USER MOD Single : A1980 THR OG1 : rot 164:sc= 0.325 USER MOD Single : A1983 LYS NZ :NH3+ -166:sc= -0.0372 (180deg=-0.293) USER MOD Single : A1985 LYS NZ :NH3+ 177:sc= 1.27 (180deg=1.2) USER MOD Single : A1986 HIS : no HD1:sc= -5! C(o=-4.6!,f=-7.6!) USER MOD Single : A1987 LYS NZ :NH3+ -157:sc= -0.14 (180deg=-1.15!) USER MOD Single : A1988 SER OG : rot 99:sc= 0.785 USER MOD Single : A1989 TYR OH : rot 180:sc= 0 USER MOD Single : A1995 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1996 SER OG : rot 180:sc= 0 USER MOD Single : A2008 SER OG : rot -3:sc= 0.306 USER MOD Single : A2012 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2016 SER OG : rot -135:sc= 1.38 USER MOD Single : A2017 TYR OH : rot 180:sc= 0 USER MOD Single : A2023 SER OG : rot -160:sc= -1.78! USER MOD ----------------------------------------------------------------- ATOM 42 N SER A1887 9.996 9.600 6.312 1.00 1.11 N ATOM 43 CA SER A1887 8.863 10.378 6.746 1.00 1.23 C ATOM 44 C SER A1887 8.406 9.909 8.146 1.00 1.05 C ATOM 45 O SER A1887 8.810 10.493 9.159 1.00 1.33 O ATOM 46 CB SER A1887 7.705 10.354 5.716 1.00 1.99 C ATOM 47 OG SER A1887 6.634 11.214 6.102 1.00 2.83 O ATOM 0 HA SER A1887 9.174 11.420 6.819 1.00 1.23 H new ATOM 0 HB2 SER A1887 8.081 10.658 4.739 1.00 1.99 H new ATOM 0 HB3 SER A1887 7.333 9.335 5.611 1.00 1.99 H new ATOM 0 HG SER A1887 5.923 11.174 5.428 1.00 2.83 H new ATOM 53 N ASN A1888 7.620 8.838 8.221 1.00 0.86 N ATOM 54 CA ASN A1888 7.137 8.338 9.513 1.00 0.91 C ATOM 55 C ASN A1888 7.974 7.161 9.927 1.00 0.87 C ATOM 56 O ASN A1888 8.005 6.124 9.250 1.00 1.23 O ATOM 57 CB ASN A1888 5.651 7.931 9.445 1.00 1.19 C ATOM 58 CG ASN A1888 5.014 7.595 10.803 1.00 1.37 C ATOM 59 OD1 ASN A1888 5.665 7.146 11.736 1.00 1.91 O ATOM 60 ND2 ASN A1888 3.724 7.801 10.909 1.00 1.53 N ATOM 0 H ASN A1888 7.304 8.301 7.413 1.00 0.86 H new ATOM 0 HA ASN A1888 7.224 9.138 10.248 1.00 0.91 H new ATOM 0 HB2 ASN A1888 5.087 8.742 8.985 1.00 1.19 H new ATOM 0 HB3 ASN A1888 5.555 7.065 8.790 1.00 1.19 H new ATOM 0 HD21 ASN A1888 3.243 7.586 11.783 1.00 1.53 H new ATOM 0 HD22 ASN A1888 3.201 8.176 10.118 1.00 1.53 H new ATOM 67 N VAL A1889 8.652 7.308 11.020 1.00 0.91 N ATOM 68 CA VAL A1889 9.512 6.275 11.509 1.00 1.02 C ATOM 69 C VAL A1889 8.767 5.271 12.390 1.00 1.13 C ATOM 70 O VAL A1889 8.767 5.327 13.627 1.00 1.41 O ATOM 71 CB VAL A1889 10.830 6.823 12.149 1.00 1.34 C ATOM 72 CG1 VAL A1889 10.556 7.790 13.295 1.00 1.98 C ATOM 73 CG2 VAL A1889 11.767 5.690 12.578 1.00 2.12 C ATOM 0 H VAL A1889 8.626 8.147 11.600 1.00 0.91 H new ATOM 0 HA VAL A1889 9.845 5.711 10.638 1.00 1.02 H new ATOM 0 HB VAL A1889 11.342 7.391 11.372 1.00 1.34 H new ATOM 0 HG11 VAL A1889 11.501 8.143 13.707 1.00 1.98 H new ATOM 0 HG12 VAL A1889 9.982 8.639 12.925 1.00 1.98 H new ATOM 0 HG13 VAL A1889 9.989 7.280 14.074 1.00 1.98 H new ATOM 0 HG21 VAL A1889 12.671 6.112 13.018 1.00 2.12 H new ATOM 0 HG22 VAL A1889 11.265 5.062 13.314 1.00 2.12 H new ATOM 0 HG23 VAL A1889 12.033 5.089 11.708 1.00 2.12 H new ATOM 83 N GLN A1890 8.049 4.426 11.726 1.00 1.17 N ATOM 84 CA GLN A1890 7.416 3.317 12.359 1.00 1.48 C ATOM 85 C GLN A1890 8.460 2.251 12.487 1.00 1.69 C ATOM 86 O GLN A1890 9.142 1.939 11.496 1.00 2.49 O ATOM 87 CB GLN A1890 6.227 2.821 11.520 1.00 1.71 C ATOM 88 CG GLN A1890 5.074 3.817 11.416 1.00 1.52 C ATOM 89 CD GLN A1890 4.357 4.037 12.741 1.00 2.03 C ATOM 90 OE1 GLN A1890 4.938 3.927 13.812 1.00 2.63 O ATOM 91 NE2 GLN A1890 3.088 4.330 12.682 1.00 2.40 N ATOM 0 H GLN A1890 7.884 4.487 10.721 1.00 1.17 H new ATOM 0 HA GLN A1890 7.019 3.594 13.336 1.00 1.48 H new ATOM 0 HB2 GLN A1890 6.579 2.584 10.516 1.00 1.71 H new ATOM 0 HB3 GLN A1890 5.853 1.894 11.954 1.00 1.71 H new ATOM 0 HG2 GLN A1890 5.457 4.771 11.053 1.00 1.52 H new ATOM 0 HG3 GLN A1890 4.358 3.459 10.676 1.00 1.52 H new ATOM 0 HE21 GLN A1890 2.626 4.416 11.777 1.00 2.40 H new ATOM 0 HE22 GLN A1890 2.557 4.473 13.541 1.00 2.40 H new ATOM 100 N ASN A1891 8.614 1.709 13.679 1.00 1.59 N ATOM 101 CA ASN A1891 9.653 0.712 13.946 1.00 1.88 C ATOM 102 C ASN A1891 9.242 -0.636 13.361 1.00 1.48 C ATOM 103 O ASN A1891 10.027 -1.577 13.274 1.00 1.86 O ATOM 104 CB ASN A1891 9.931 0.600 15.458 1.00 2.50 C ATOM 105 CG ASN A1891 11.258 -0.091 15.773 1.00 3.17 C ATOM 106 OD1 ASN A1891 12.298 0.563 15.846 1.00 3.82 O ATOM 107 ND2 ASN A1891 11.238 -1.377 15.995 1.00 3.53 N ATOM 0 H ASN A1891 8.034 1.938 14.486 1.00 1.59 H new ATOM 0 HA ASN A1891 10.578 1.031 13.465 1.00 1.88 H new ATOM 0 HB2 ASN A1891 9.935 1.598 15.896 1.00 2.50 H new ATOM 0 HB3 ASN A1891 9.119 0.048 15.931 1.00 2.50 H new ATOM 0 HD21 ASN A1891 12.100 -1.866 16.236 1.00 3.53 H new ATOM 0 HD22 ASN A1891 10.361 -1.893 15.927 1.00 3.53 H new ATOM 114 N ASP A1892 8.006 -0.723 12.953 1.00 1.00 N ATOM 115 CA ASP A1892 7.513 -1.896 12.282 1.00 1.01 C ATOM 116 C ASP A1892 7.368 -1.530 10.835 1.00 1.00 C ATOM 117 O ASP A1892 7.652 -0.372 10.463 1.00 1.59 O ATOM 118 CB ASP A1892 6.164 -2.359 12.832 1.00 1.40 C ATOM 119 CG ASP A1892 6.178 -2.658 14.298 1.00 2.05 C ATOM 120 OD1 ASP A1892 6.619 -3.756 14.690 1.00 2.61 O ATOM 121 OD2 ASP A1892 5.741 -1.798 15.090 1.00 2.66 O ATOM 0 H ASP A1892 7.313 0.015 13.075 1.00 1.00 H new ATOM 0 HA ASP A1892 8.208 -2.722 12.433 1.00 1.01 H new ATOM 0 HB2 ASP A1892 5.419 -1.588 12.635 1.00 1.40 H new ATOM 0 HB3 ASP A1892 5.849 -3.252 12.292 1.00 1.40 H new ATOM 126 N CYS A1893 6.890 -2.457 10.026 1.00 0.74 N ATOM 127 CA CYS A1893 6.797 -2.252 8.582 1.00 0.87 C ATOM 128 C CYS A1893 8.186 -1.901 8.030 1.00 0.75 C ATOM 129 O CYS A1893 8.434 -0.788 7.523 1.00 0.80 O ATOM 130 CB CYS A1893 5.748 -1.171 8.266 1.00 1.17 C ATOM 131 SG CYS A1893 5.551 -0.720 6.520 1.00 1.58 S ATOM 0 H CYS A1893 6.556 -3.368 10.342 1.00 0.74 H new ATOM 0 HA CYS A1893 6.465 -3.167 8.092 1.00 0.87 H new ATOM 0 HB2 CYS A1893 4.783 -1.512 8.641 1.00 1.17 H new ATOM 0 HB3 CYS A1893 6.007 -0.271 8.824 1.00 1.17 H new ATOM 136 N ARG A1894 9.107 -2.831 8.249 1.00 0.73 N ATOM 137 CA ARG A1894 10.505 -2.735 7.844 1.00 0.73 C ATOM 138 C ARG A1894 11.172 -4.064 8.088 1.00 0.72 C ATOM 139 O ARG A1894 11.141 -4.587 9.205 1.00 0.92 O ATOM 140 CB ARG A1894 11.236 -1.576 8.568 1.00 0.85 C ATOM 141 CG ARG A1894 11.015 -1.511 10.071 1.00 1.21 C ATOM 142 CD ARG A1894 11.479 -0.179 10.644 1.00 1.35 C ATOM 143 NE ARG A1894 12.930 -0.048 10.756 1.00 1.45 N ATOM 144 CZ ARG A1894 13.626 1.066 10.455 1.00 1.80 C ATOM 145 NH1 ARG A1894 13.091 2.004 9.671 1.00 2.09 N ATOM 146 NH2 ARG A1894 14.884 1.184 10.847 1.00 2.57 N ATOM 0 H ARG A1894 8.894 -3.704 8.731 1.00 0.73 H new ATOM 0 HA ARG A1894 10.557 -2.501 6.781 1.00 0.73 H new ATOM 0 HB2 ARG A1894 12.305 -1.667 8.378 1.00 0.85 H new ATOM 0 HB3 ARG A1894 10.913 -0.633 8.128 1.00 0.85 H new ATOM 0 HG2 ARG A1894 9.957 -1.655 10.291 1.00 1.21 H new ATOM 0 HG3 ARG A1894 11.555 -2.325 10.555 1.00 1.21 H new ATOM 0 HD2 ARG A1894 11.100 0.626 10.014 1.00 1.35 H new ATOM 0 HD3 ARG A1894 11.036 -0.047 11.631 1.00 1.35 H new ATOM 0 HE ARG A1894 13.454 -0.858 11.086 1.00 1.45 H new ATOM 0 HH11 ARG A1894 12.151 1.880 9.296 1.00 2.09 H new ATOM 0 HH12 ARG A1894 13.623 2.845 9.447 1.00 2.09 H new ATOM 0 HH21 ARG A1894 15.326 0.432 11.376 1.00 2.57 H new ATOM 0 HH22 ARG A1894 15.412 2.027 10.620 1.00 2.57 H new ATOM 160 N VAL A1895 11.710 -4.638 7.058 1.00 0.58 N ATOM 161 CA VAL A1895 12.310 -5.949 7.147 1.00 0.60 C ATOM 162 C VAL A1895 13.592 -5.989 6.321 1.00 0.52 C ATOM 163 O VAL A1895 13.668 -5.393 5.255 1.00 0.47 O ATOM 164 CB VAL A1895 11.300 -7.064 6.695 1.00 0.63 C ATOM 165 CG1 VAL A1895 10.860 -6.893 5.240 1.00 0.57 C ATOM 166 CG2 VAL A1895 11.861 -8.460 6.943 1.00 0.72 C ATOM 0 H VAL A1895 11.750 -4.219 6.129 1.00 0.58 H new ATOM 0 HA VAL A1895 12.565 -6.149 8.188 1.00 0.60 H new ATOM 0 HB VAL A1895 10.409 -6.948 7.312 1.00 0.63 H new ATOM 0 HG11 VAL A1895 10.163 -7.688 4.975 1.00 0.57 H new ATOM 0 HG12 VAL A1895 10.372 -5.926 5.119 1.00 0.57 H new ATOM 0 HG13 VAL A1895 11.732 -6.943 4.588 1.00 0.57 H new ATOM 0 HG21 VAL A1895 11.136 -9.206 6.619 1.00 0.72 H new ATOM 0 HG22 VAL A1895 12.787 -8.585 6.381 1.00 0.72 H new ATOM 0 HG23 VAL A1895 12.062 -8.588 8.007 1.00 0.72 H new ATOM 176 N THR A1896 14.591 -6.642 6.817 1.00 0.63 N ATOM 177 CA THR A1896 15.848 -6.714 6.135 1.00 0.69 C ATOM 178 C THR A1896 15.816 -7.910 5.214 1.00 0.69 C ATOM 179 O THR A1896 15.397 -8.996 5.623 1.00 0.76 O ATOM 180 CB THR A1896 16.990 -6.907 7.151 1.00 0.89 C ATOM 181 OG1 THR A1896 16.762 -6.050 8.274 1.00 0.98 O ATOM 182 CG2 THR A1896 18.338 -6.557 6.526 1.00 1.02 C ATOM 0 H THR A1896 14.562 -7.142 7.706 1.00 0.63 H new ATOM 0 HA THR A1896 16.016 -5.793 5.577 1.00 0.69 H new ATOM 0 HB THR A1896 17.009 -7.951 7.462 1.00 0.89 H new ATOM 0 HG1 THR A1896 17.483 -6.167 8.927 1.00 0.98 H new ATOM 0 HG21 THR A1896 19.129 -6.701 7.262 1.00 1.02 H new ATOM 0 HG22 THR A1896 18.520 -7.203 5.667 1.00 1.02 H new ATOM 0 HG23 THR A1896 18.329 -5.516 6.202 1.00 1.02 H new ATOM 190 N ASN A1897 16.189 -7.717 3.982 1.00 0.75 N ATOM 191 CA ASN A1897 16.262 -8.814 3.058 1.00 0.88 C ATOM 192 C ASN A1897 17.710 -9.186 2.873 1.00 1.04 C ATOM 193 O ASN A1897 18.438 -8.481 2.168 1.00 1.06 O ATOM 194 CB ASN A1897 15.633 -8.467 1.708 1.00 0.95 C ATOM 195 CG ASN A1897 15.735 -9.616 0.713 1.00 1.17 C ATOM 196 OD1 ASN A1897 15.754 -10.774 1.089 1.00 1.65 O ATOM 197 ND2 ASN A1897 15.830 -9.303 -0.545 1.00 1.21 N ATOM 0 H ASN A1897 16.448 -6.810 3.593 1.00 0.75 H new ATOM 0 HA ASN A1897 15.699 -9.653 3.467 1.00 0.88 H new ATOM 0 HB2 ASN A1897 14.585 -8.207 1.854 1.00 0.95 H new ATOM 0 HB3 ASN A1897 16.125 -7.586 1.295 1.00 0.95 H new ATOM 0 HD21 ASN A1897 15.923 -10.037 -1.247 1.00 1.21 H new ATOM 0 HD22 ASN A1897 15.811 -8.324 -0.830 1.00 1.21 H new ATOM 204 N PRO A1898 18.158 -10.284 3.502 1.00 1.26 N ATOM 205 CA PRO A1898 19.559 -10.717 3.457 1.00 1.47 C ATOM 206 C PRO A1898 20.001 -11.132 2.059 1.00 1.54 C ATOM 207 O PRO A1898 21.191 -11.173 1.767 1.00 1.71 O ATOM 208 CB PRO A1898 19.617 -11.898 4.427 1.00 1.73 C ATOM 209 CG PRO A1898 18.217 -12.385 4.536 1.00 1.69 C ATOM 210 CD PRO A1898 17.334 -11.198 4.320 1.00 1.40 C ATOM 0 HA PRO A1898 20.236 -9.908 3.730 1.00 1.47 H new ATOM 0 HB2 PRO A1898 20.278 -12.681 4.055 1.00 1.73 H new ATOM 0 HB3 PRO A1898 20.003 -11.590 5.399 1.00 1.73 H new ATOM 0 HG2 PRO A1898 18.016 -13.157 3.793 1.00 1.69 H new ATOM 0 HG3 PRO A1898 18.036 -12.829 5.515 1.00 1.69 H new ATOM 0 HD2 PRO A1898 16.413 -11.474 3.806 1.00 1.40 H new ATOM 0 HD3 PRO A1898 17.046 -10.738 5.265 1.00 1.40 H new ATOM 218 N ALA A1899 19.031 -11.403 1.189 1.00 1.48 N ATOM 219 CA ALA A1899 19.316 -11.755 -0.187 1.00 1.62 C ATOM 220 C ALA A1899 19.934 -10.566 -0.913 1.00 1.54 C ATOM 221 O ALA A1899 20.756 -10.728 -1.801 1.00 1.69 O ATOM 222 CB ALA A1899 18.053 -12.209 -0.890 1.00 1.72 C ATOM 0 H ALA A1899 18.038 -11.384 1.421 1.00 1.48 H new ATOM 0 HA ALA A1899 20.028 -12.580 -0.198 1.00 1.62 H new ATOM 0 HB1 ALA A1899 18.285 -12.470 -1.923 1.00 1.72 H new ATOM 0 HB2 ALA A1899 17.645 -13.081 -0.379 1.00 1.72 H new ATOM 0 HB3 ALA A1899 17.319 -11.403 -0.875 1.00 1.72 H new ATOM 228 N THR A1900 19.532 -9.374 -0.523 1.00 1.37 N ATOM 229 CA THR A1900 20.086 -8.168 -1.086 1.00 1.38 C ATOM 230 C THR A1900 21.130 -7.603 -0.116 1.00 1.36 C ATOM 231 O THR A1900 22.219 -7.171 -0.518 1.00 1.53 O ATOM 232 CB THR A1900 18.984 -7.108 -1.277 1.00 1.31 C ATOM 233 OG1 THR A1900 17.821 -7.728 -1.838 1.00 1.45 O ATOM 234 CG2 THR A1900 19.452 -6.026 -2.229 1.00 1.46 C ATOM 0 H THR A1900 18.817 -9.218 0.188 1.00 1.37 H new ATOM 0 HA THR A1900 20.535 -8.404 -2.051 1.00 1.38 H new ATOM 0 HB THR A1900 18.754 -6.668 -0.307 1.00 1.31 H new ATOM 0 HG1 THR A1900 18.087 -8.310 -2.580 1.00 1.45 H new ATOM 0 HG21 THR A1900 18.663 -5.285 -2.354 1.00 1.46 H new ATOM 0 HG22 THR A1900 20.341 -5.544 -1.823 1.00 1.46 H new ATOM 0 HG23 THR A1900 19.689 -6.470 -3.196 1.00 1.46 H new ATOM 242 N GLY A1901 20.785 -7.648 1.162 1.00 1.23 N ATOM 243 CA GLY A1901 21.607 -7.090 2.191 1.00 1.29 C ATOM 244 C GLY A1901 21.105 -5.719 2.585 1.00 1.27 C ATOM 245 O GLY A1901 21.735 -5.016 3.374 1.00 1.46 O ATOM 0 H GLY A1901 19.923 -8.076 1.501 1.00 1.23 H new ATOM 0 HA2 GLY A1901 21.608 -7.747 3.061 1.00 1.29 H new ATOM 0 HA3 GLY A1901 22.638 -7.020 1.843 1.00 1.29 H new ATOM 249 N HIS A1902 19.965 -5.351 2.043 1.00 1.12 N ATOM 250 CA HIS A1902 19.389 -4.035 2.261 1.00 1.15 C ATOM 251 C HIS A1902 18.126 -4.155 3.118 1.00 0.91 C ATOM 252 O HIS A1902 17.377 -5.147 3.008 1.00 0.84 O ATOM 253 CB HIS A1902 19.058 -3.384 0.891 1.00 1.34 C ATOM 254 CG HIS A1902 18.622 -1.932 0.944 1.00 2.00 C ATOM 255 ND1 HIS A1902 17.300 -1.525 0.837 1.00 2.46 N ATOM 256 CD2 HIS A1902 19.348 -0.791 1.057 1.00 2.87 C ATOM 257 CE1 HIS A1902 17.248 -0.207 0.881 1.00 3.18 C ATOM 258 NE2 HIS A1902 18.465 0.254 1.015 1.00 3.41 N ATOM 0 H HIS A1902 19.408 -5.954 1.437 1.00 1.12 H new ATOM 0 HA HIS A1902 20.105 -3.405 2.788 1.00 1.15 H new ATOM 0 HB2 HIS A1902 19.938 -3.457 0.252 1.00 1.34 H new ATOM 0 HB3 HIS A1902 18.268 -3.965 0.414 1.00 1.34 H new ATOM 0 HD2 HIS A1902 20.421 -0.721 1.161 1.00 2.87 H new ATOM 0 HE1 HIS A1902 16.351 0.391 0.817 1.00 3.18 H new ATOM 0 HE2 HIS A1902 18.717 1.240 1.078 1.00 3.41 H new ATOM 267 N LEU A1903 17.908 -3.171 3.952 1.00 0.87 N ATOM 268 CA LEU A1903 16.720 -3.083 4.781 1.00 0.75 C ATOM 269 C LEU A1903 15.592 -2.517 3.952 1.00 0.70 C ATOM 270 O LEU A1903 15.731 -1.454 3.345 1.00 0.88 O ATOM 271 CB LEU A1903 16.978 -2.165 5.993 1.00 0.94 C ATOM 272 CG LEU A1903 15.777 -1.863 6.913 1.00 0.99 C ATOM 273 CD1 LEU A1903 15.269 -3.115 7.597 1.00 1.34 C ATOM 274 CD2 LEU A1903 16.141 -0.805 7.940 1.00 1.48 C ATOM 0 H LEU A1903 18.556 -2.394 4.081 1.00 0.87 H new ATOM 0 HA LEU A1903 16.459 -4.076 5.146 1.00 0.75 H new ATOM 0 HB2 LEU A1903 17.763 -2.617 6.599 1.00 0.94 H new ATOM 0 HB3 LEU A1903 17.367 -1.217 5.623 1.00 0.94 H new ATOM 0 HG LEU A1903 14.972 -1.479 6.286 1.00 0.99 H new ATOM 0 HD11 LEU A1903 14.423 -2.863 8.236 1.00 1.34 H new ATOM 0 HD12 LEU A1903 14.952 -3.838 6.845 1.00 1.34 H new ATOM 0 HD13 LEU A1903 16.065 -3.547 8.203 1.00 1.34 H new ATOM 0 HD21 LEU A1903 15.280 -0.607 8.579 1.00 1.48 H new ATOM 0 HD22 LEU A1903 16.971 -1.161 8.550 1.00 1.48 H new ATOM 0 HD23 LEU A1903 16.433 0.113 7.429 1.00 1.48 H new ATOM 286 N PHE A1904 14.512 -3.218 3.895 1.00 0.53 N ATOM 287 CA PHE A1904 13.366 -2.767 3.174 1.00 0.51 C ATOM 288 C PHE A1904 12.454 -2.064 4.153 1.00 0.48 C ATOM 289 O PHE A1904 11.800 -2.699 4.994 1.00 0.49 O ATOM 290 CB PHE A1904 12.642 -3.940 2.478 1.00 0.51 C ATOM 291 CG PHE A1904 13.415 -4.628 1.352 1.00 0.58 C ATOM 292 CD1 PHE A1904 14.680 -4.195 0.957 1.00 1.01 C ATOM 293 CD2 PHE A1904 12.850 -5.698 0.678 1.00 0.71 C ATOM 294 CE1 PHE A1904 15.353 -4.821 -0.075 1.00 1.17 C ATOM 295 CE2 PHE A1904 13.512 -6.321 -0.354 1.00 0.79 C ATOM 296 CZ PHE A1904 14.767 -5.884 -0.733 1.00 0.86 C ATOM 0 H PHE A1904 14.396 -4.124 4.348 1.00 0.53 H new ATOM 0 HA PHE A1904 13.669 -2.080 2.384 1.00 0.51 H new ATOM 0 HB2 PHE A1904 12.394 -4.687 3.232 1.00 0.51 H new ATOM 0 HB3 PHE A1904 11.700 -3.571 2.073 1.00 0.51 H new ATOM 0 HD1 PHE A1904 15.140 -3.360 1.464 1.00 1.01 H new ATOM 0 HD2 PHE A1904 11.871 -6.050 0.968 1.00 0.71 H new ATOM 0 HE1 PHE A1904 16.335 -4.479 -0.366 1.00 1.17 H new ATOM 0 HE2 PHE A1904 13.051 -7.152 -0.868 1.00 0.79 H new ATOM 0 HZ PHE A1904 15.289 -6.373 -1.542 1.00 0.86 H new ATOM 306 N ASP A1905 12.472 -0.767 4.085 1.00 0.57 N ATOM 307 CA ASP A1905 11.708 0.095 4.954 1.00 0.61 C ATOM 308 C ASP A1905 11.160 1.226 4.147 1.00 0.55 C ATOM 309 O ASP A1905 11.860 1.814 3.333 1.00 0.71 O ATOM 310 CB ASP A1905 12.561 0.628 6.114 1.00 0.88 C ATOM 311 CG ASP A1905 11.900 1.784 6.847 1.00 1.37 C ATOM 312 OD1 ASP A1905 11.083 1.510 7.736 1.00 1.97 O ATOM 313 OD2 ASP A1905 12.178 2.993 6.538 1.00 1.95 O ATOM 0 H ASP A1905 13.035 -0.258 3.404 1.00 0.57 H new ATOM 0 HA ASP A1905 10.893 -0.480 5.393 1.00 0.61 H new ATOM 0 HB2 ASP A1905 12.754 -0.181 6.819 1.00 0.88 H new ATOM 0 HB3 ASP A1905 13.528 0.953 5.729 1.00 0.88 H new ATOM 318 N LEU A1906 9.928 1.534 4.375 1.00 0.48 N ATOM 319 CA LEU A1906 9.238 2.505 3.582 1.00 0.48 C ATOM 320 C LEU A1906 8.896 3.732 4.406 1.00 0.52 C ATOM 321 O LEU A1906 7.799 4.265 4.271 1.00 0.71 O ATOM 322 CB LEU A1906 7.955 1.867 3.039 1.00 0.50 C ATOM 323 CG LEU A1906 8.137 0.593 2.208 1.00 0.47 C ATOM 324 CD1 LEU A1906 6.796 0.027 1.810 1.00 0.53 C ATOM 325 CD2 LEU A1906 8.989 0.863 0.974 1.00 0.54 C ATOM 0 H LEU A1906 9.366 1.120 5.118 1.00 0.48 H new ATOM 0 HA LEU A1906 9.880 2.821 2.760 1.00 0.48 H new ATOM 0 HB2 LEU A1906 7.303 1.637 3.881 1.00 0.50 H new ATOM 0 HB3 LEU A1906 7.437 2.605 2.427 1.00 0.50 H new ATOM 0 HG LEU A1906 8.656 -0.141 2.824 1.00 0.47 H new ATOM 0 HD11 LEU A1906 6.943 -0.878 1.220 1.00 0.53 H new ATOM 0 HD12 LEU A1906 6.222 -0.213 2.705 1.00 0.53 H new ATOM 0 HD13 LEU A1906 6.252 0.762 1.217 1.00 0.53 H new ATOM 0 HD21 LEU A1906 9.103 -0.058 0.402 1.00 0.54 H new ATOM 0 HD22 LEU A1906 8.504 1.618 0.355 1.00 0.54 H new ATOM 0 HD23 LEU A1906 9.971 1.223 1.281 1.00 0.54 H new ATOM 337 N THR A1907 9.845 4.208 5.226 1.00 0.66 N ATOM 338 CA THR A1907 9.635 5.395 6.085 1.00 0.74 C ATOM 339 C THR A1907 9.062 6.595 5.340 1.00 0.69 C ATOM 340 O THR A1907 8.247 7.308 5.871 1.00 0.70 O ATOM 341 CB THR A1907 10.924 5.817 6.814 1.00 1.11 C ATOM 342 OG1 THR A1907 12.057 5.462 6.027 1.00 1.59 O ATOM 343 CG2 THR A1907 11.020 5.201 8.202 1.00 1.13 C ATOM 0 H THR A1907 10.771 3.790 5.316 1.00 0.66 H new ATOM 0 HA THR A1907 8.893 5.076 6.817 1.00 0.74 H new ATOM 0 HB THR A1907 10.899 6.899 6.947 1.00 1.11 H new ATOM 0 HG1 THR A1907 12.430 4.617 6.354 1.00 1.59 H new ATOM 0 HG21 THR A1907 11.944 5.525 8.681 1.00 1.13 H new ATOM 0 HG22 THR A1907 10.169 5.522 8.802 1.00 1.13 H new ATOM 0 HG23 THR A1907 11.016 4.114 8.119 1.00 1.13 H new ATOM 351 N SER A1908 9.523 6.813 4.140 1.00 0.83 N ATOM 352 CA SER A1908 9.067 7.898 3.287 1.00 1.00 C ATOM 353 C SER A1908 7.590 7.726 2.871 1.00 0.94 C ATOM 354 O SER A1908 6.829 8.701 2.777 1.00 1.16 O ATOM 355 CB SER A1908 9.927 7.850 2.059 1.00 1.28 C ATOM 356 OG SER A1908 11.239 7.475 2.431 1.00 1.36 O ATOM 0 H SER A1908 10.243 6.233 3.709 1.00 0.83 H new ATOM 0 HA SER A1908 9.141 8.845 3.821 1.00 1.00 H new ATOM 0 HB2 SER A1908 9.520 7.137 1.342 1.00 1.28 H new ATOM 0 HB3 SER A1908 9.938 8.823 1.569 1.00 1.28 H new ATOM 0 HG SER A1908 11.867 7.741 1.727 1.00 1.36 H new ATOM 362 N LEU A1909 7.198 6.492 2.645 1.00 0.76 N ATOM 363 CA LEU A1909 5.916 6.159 2.170 1.00 0.87 C ATOM 364 C LEU A1909 4.901 6.167 3.289 1.00 0.82 C ATOM 365 O LEU A1909 3.792 6.682 3.132 1.00 1.00 O ATOM 366 CB LEU A1909 5.982 4.798 1.541 1.00 0.89 C ATOM 367 CG LEU A1909 6.517 4.679 0.108 1.00 1.28 C ATOM 368 CD1 LEU A1909 8.000 5.015 0.004 1.00 2.03 C ATOM 369 CD2 LEU A1909 6.243 3.296 -0.417 1.00 1.67 C ATOM 0 H LEU A1909 7.798 5.682 2.799 1.00 0.76 H new ATOM 0 HA LEU A1909 5.600 6.900 1.436 1.00 0.87 H new ATOM 0 HB2 LEU A1909 6.601 4.167 2.179 1.00 0.89 H new ATOM 0 HB3 LEU A1909 4.977 4.377 1.556 1.00 0.89 H new ATOM 0 HG LEU A1909 5.994 5.414 -0.504 1.00 1.28 H new ATOM 0 HD11 LEU A1909 8.324 4.914 -1.032 1.00 2.03 H new ATOM 0 HD12 LEU A1909 8.165 6.039 0.338 1.00 2.03 H new ATOM 0 HD13 LEU A1909 8.573 4.332 0.632 1.00 2.03 H new ATOM 0 HD21 LEU A1909 6.623 3.211 -1.435 1.00 1.67 H new ATOM 0 HD22 LEU A1909 6.738 2.561 0.218 1.00 1.67 H new ATOM 0 HD23 LEU A1909 5.169 3.112 -0.414 1.00 1.67 H new ATOM 381 N LYS A1910 5.264 5.568 4.404 1.00 0.69 N ATOM 382 CA LYS A1910 4.428 5.613 5.570 1.00 0.78 C ATOM 383 C LYS A1910 4.451 7.023 6.116 1.00 0.81 C ATOM 384 O LYS A1910 5.493 7.548 6.473 1.00 0.92 O ATOM 385 CB LYS A1910 4.811 4.528 6.623 1.00 0.85 C ATOM 386 CG LYS A1910 6.291 4.440 6.971 1.00 1.10 C ATOM 387 CD LYS A1910 6.601 3.271 7.914 1.00 1.40 C ATOM 388 CE LYS A1910 8.114 3.004 7.947 1.00 2.20 C ATOM 389 NZ LYS A1910 8.528 1.764 8.665 1.00 2.72 N ATOM 0 H LYS A1910 6.133 5.046 4.521 1.00 0.69 H new ATOM 0 HA LYS A1910 3.403 5.363 5.298 1.00 0.78 H new ATOM 0 HB2 LYS A1910 4.252 4.723 7.538 1.00 0.85 H new ATOM 0 HB3 LYS A1910 4.485 3.556 6.252 1.00 0.85 H new ATOM 0 HG2 LYS A1910 6.871 4.328 6.055 1.00 1.10 H new ATOM 0 HG3 LYS A1910 6.608 5.373 7.437 1.00 1.10 H new ATOM 0 HD2 LYS A1910 6.242 3.499 8.918 1.00 1.40 H new ATOM 0 HD3 LYS A1910 6.073 2.377 7.582 1.00 1.40 H new ATOM 0 HE2 LYS A1910 8.479 2.949 6.921 1.00 2.20 H new ATOM 0 HE3 LYS A1910 8.606 3.856 8.415 1.00 2.20 H new ATOM 0 HZ1 LYS A1910 9.554 1.628 8.560 1.00 2.72 H new ATOM 0 HZ2 LYS A1910 8.292 1.852 9.674 1.00 2.72 H new ATOM 0 HZ3 LYS A1910 8.027 0.946 8.262 1.00 2.72 H new ATOM 403 N ARG A1911 3.315 7.642 6.111 1.00 0.82 N ATOM 404 CA ARG A1911 3.192 9.021 6.482 1.00 0.91 C ATOM 405 C ARG A1911 1.907 9.239 7.247 1.00 0.98 C ATOM 406 O ARG A1911 1.004 8.409 7.171 1.00 1.03 O ATOM 407 CB ARG A1911 3.273 9.886 5.222 1.00 0.99 C ATOM 408 CG ARG A1911 2.335 9.442 4.114 1.00 1.05 C ATOM 409 CD ARG A1911 2.580 10.212 2.838 1.00 1.26 C ATOM 410 NE ARG A1911 3.946 10.041 2.327 1.00 1.50 N ATOM 411 CZ ARG A1911 4.407 10.583 1.189 1.00 1.86 C ATOM 412 NH1 ARG A1911 3.587 11.273 0.396 1.00 1.90 N ATOM 413 NH2 ARG A1911 5.678 10.411 0.844 1.00 2.60 N ATOM 0 H ARG A1911 2.434 7.202 5.846 1.00 0.82 H new ATOM 0 HA ARG A1911 4.009 9.311 7.143 1.00 0.91 H new ATOM 0 HB2 ARG A1911 3.046 10.919 5.486 1.00 0.99 H new ATOM 0 HB3 ARG A1911 4.296 9.871 4.847 1.00 0.99 H new ATOM 0 HG2 ARG A1911 2.469 8.376 3.928 1.00 1.05 H new ATOM 0 HG3 ARG A1911 1.302 9.583 4.432 1.00 1.05 H new ATOM 0 HD2 ARG A1911 1.869 9.886 2.079 1.00 1.26 H new ATOM 0 HD3 ARG A1911 2.393 11.271 3.016 1.00 1.26 H new ATOM 0 HE ARG A1911 4.590 9.470 2.875 1.00 1.50 H new ATOM 0 HH11 ARG A1911 2.607 11.390 0.654 1.00 1.90 H new ATOM 0 HH12 ARG A1911 3.940 11.684 -0.468 1.00 1.90 H new ATOM 0 HH21 ARG A1911 6.300 9.868 1.443 1.00 2.60 H new ATOM 0 HH22 ARG A1911 6.032 10.821 -0.020 1.00 2.60 H new ATOM 427 N GLU A1912 1.850 10.323 7.993 1.00 1.18 N ATOM 428 CA GLU A1912 0.723 10.640 8.880 1.00 1.43 C ATOM 429 C GLU A1912 -0.643 10.666 8.178 1.00 1.27 C ATOM 430 O GLU A1912 -1.578 10.017 8.639 1.00 1.48 O ATOM 431 CB GLU A1912 0.962 11.958 9.605 1.00 1.83 C ATOM 432 CG GLU A1912 2.180 11.958 10.509 1.00 2.47 C ATOM 433 CD GLU A1912 2.355 13.272 11.220 1.00 2.80 C ATOM 434 OE1 GLU A1912 1.817 13.443 12.330 1.00 3.16 O ATOM 435 OE2 GLU A1912 3.053 14.165 10.687 1.00 3.25 O ATOM 0 H GLU A1912 2.590 11.025 8.009 1.00 1.18 H new ATOM 0 HA GLU A1912 0.680 9.821 9.598 1.00 1.43 H new ATOM 0 HB2 GLU A1912 1.072 12.752 8.866 1.00 1.83 H new ATOM 0 HB3 GLU A1912 0.081 12.197 10.201 1.00 1.83 H new ATOM 0 HG2 GLU A1912 2.086 11.158 11.244 1.00 2.47 H new ATOM 0 HG3 GLU A1912 3.070 11.745 9.917 1.00 2.47 H new ATOM 442 N SER A1913 -0.755 11.381 7.083 1.00 1.09 N ATOM 443 CA SER A1913 -2.019 11.466 6.380 1.00 1.05 C ATOM 444 C SER A1913 -2.203 10.216 5.532 1.00 0.93 C ATOM 445 O SER A1913 -3.127 9.406 5.758 1.00 1.08 O ATOM 446 CB SER A1913 -2.056 12.752 5.508 1.00 1.25 C ATOM 447 OG SER A1913 -3.273 12.900 4.774 1.00 1.86 O ATOM 0 H SER A1913 0.007 11.910 6.660 1.00 1.09 H new ATOM 0 HA SER A1913 -2.840 11.525 7.094 1.00 1.05 H new ATOM 0 HB2 SER A1913 -1.918 13.622 6.150 1.00 1.25 H new ATOM 0 HB3 SER A1913 -1.219 12.734 4.811 1.00 1.25 H new ATOM 0 HG SER A1913 -3.634 13.800 4.916 1.00 1.86 H new ATOM 453 N GLY A1914 -1.298 10.030 4.612 1.00 0.88 N ATOM 454 CA GLY A1914 -1.379 8.934 3.713 1.00 0.88 C ATOM 455 C GLY A1914 -1.308 9.445 2.317 1.00 0.86 C ATOM 456 O GLY A1914 -0.949 10.610 2.105 1.00 1.14 O ATOM 0 H GLY A1914 -0.490 10.636 4.472 1.00 0.88 H new ATOM 0 HA2 GLY A1914 -0.565 8.234 3.899 1.00 0.88 H new ATOM 0 HA3 GLY A1914 -2.310 8.389 3.867 1.00 0.88 H new ATOM 460 N TYR A1915 -1.655 8.640 1.377 1.00 0.70 N ATOM 461 CA TYR A1915 -1.587 9.025 0.003 1.00 0.82 C ATOM 462 C TYR A1915 -2.875 8.723 -0.694 1.00 0.65 C ATOM 463 O TYR A1915 -3.690 7.924 -0.209 1.00 0.66 O ATOM 464 CB TYR A1915 -0.368 8.407 -0.707 1.00 1.06 C ATOM 465 CG TYR A1915 -0.254 6.914 -0.566 1.00 1.50 C ATOM 466 CD1 TYR A1915 0.355 6.344 0.534 1.00 2.32 C ATOM 467 CD2 TYR A1915 -0.766 6.073 -1.542 1.00 1.97 C ATOM 468 CE1 TYR A1915 0.452 4.980 0.661 1.00 3.26 C ATOM 469 CE2 TYR A1915 -0.669 4.715 -1.424 1.00 2.95 C ATOM 470 CZ TYR A1915 -0.028 4.175 -0.292 1.00 3.50 C ATOM 471 OH TYR A1915 0.031 2.812 -0.200 1.00 4.60 O ATOM 0 H TYR A1915 -1.996 7.692 1.534 1.00 0.70 H new ATOM 0 HA TYR A1915 -1.442 10.104 -0.040 1.00 0.82 H new ATOM 0 HB2 TYR A1915 -0.416 8.656 -1.767 1.00 1.06 H new ATOM 0 HB3 TYR A1915 0.538 8.867 -0.312 1.00 1.06 H new ATOM 0 HD1 TYR A1915 0.761 6.980 1.306 1.00 2.32 H new ATOM 0 HD2 TYR A1915 -1.249 6.498 -2.409 1.00 1.97 H new ATOM 0 HE1 TYR A1915 0.919 4.555 1.537 1.00 3.26 H new ATOM 0 HE2 TYR A1915 -1.077 4.067 -2.186 1.00 2.95 H new ATOM 0 HH TYR A1915 0.258 2.435 -1.075 1.00 4.60 H new ATOM 481 N THR A1916 -3.082 9.360 -1.789 1.00 0.65 N ATOM 482 CA THR A1916 -4.288 9.204 -2.508 1.00 0.60 C ATOM 483 C THR A1916 -4.003 9.154 -3.962 1.00 0.60 C ATOM 484 O THR A1916 -3.050 9.772 -4.476 1.00 0.76 O ATOM 485 CB THR A1916 -5.314 10.321 -2.149 1.00 0.79 C ATOM 486 OG1 THR A1916 -6.588 10.066 -2.751 1.00 1.21 O ATOM 487 CG2 THR A1916 -4.808 11.689 -2.599 1.00 1.26 C ATOM 0 H THR A1916 -2.415 10.006 -2.211 1.00 0.65 H new ATOM 0 HA THR A1916 -4.750 8.259 -2.220 1.00 0.60 H new ATOM 0 HB THR A1916 -5.429 10.319 -1.065 1.00 0.79 H new ATOM 0 HG1 THR A1916 -7.167 9.605 -2.109 1.00 1.21 H new ATOM 0 HG21 THR A1916 -5.541 12.452 -2.338 1.00 1.26 H new ATOM 0 HG22 THR A1916 -3.863 11.909 -2.103 1.00 1.26 H new ATOM 0 HG23 THR A1916 -4.658 11.684 -3.679 1.00 1.26 H new ATOM 495 N ILE A1917 -4.782 8.369 -4.579 1.00 0.52 N ATOM 496 CA ILE A1917 -4.742 8.113 -5.962 1.00 0.56 C ATOM 497 C ILE A1917 -6.161 7.981 -6.467 1.00 0.57 C ATOM 498 O ILE A1917 -7.102 7.978 -5.676 1.00 0.59 O ATOM 499 CB ILE A1917 -3.957 6.828 -6.265 1.00 0.59 C ATOM 500 CG1 ILE A1917 -4.308 5.693 -5.277 1.00 0.69 C ATOM 501 CG2 ILE A1917 -2.461 7.083 -6.357 1.00 0.74 C ATOM 502 CD1 ILE A1917 -3.585 4.392 -5.546 1.00 0.74 C ATOM 0 H ILE A1917 -5.519 7.849 -4.102 1.00 0.52 H new ATOM 0 HA ILE A1917 -4.235 8.937 -6.464 1.00 0.56 H new ATOM 0 HB ILE A1917 -4.269 6.485 -7.251 1.00 0.59 H new ATOM 0 HG12 ILE A1917 -4.075 6.023 -4.265 1.00 0.69 H new ATOM 0 HG13 ILE A1917 -5.382 5.513 -5.314 1.00 0.69 H new ATOM 0 HG21 ILE A1917 -1.945 6.147 -6.572 1.00 0.74 H new ATOM 0 HG22 ILE A1917 -2.262 7.799 -7.154 1.00 0.74 H new ATOM 0 HG23 ILE A1917 -2.102 7.486 -5.410 1.00 0.74 H new ATOM 0 HD11 ILE A1917 -3.887 3.648 -4.809 1.00 0.74 H new ATOM 0 HD12 ILE A1917 -3.837 4.036 -6.545 1.00 0.74 H new ATOM 0 HD13 ILE A1917 -2.509 4.553 -5.479 1.00 0.74 H new ATOM 514 N THR A1918 -6.325 7.908 -7.739 1.00 0.65 N ATOM 515 CA THR A1918 -7.630 7.772 -8.310 1.00 0.72 C ATOM 516 C THR A1918 -7.938 6.283 -8.487 1.00 0.68 C ATOM 517 O THR A1918 -7.028 5.479 -8.698 1.00 0.76 O ATOM 518 CB THR A1918 -7.671 8.483 -9.678 1.00 0.94 C ATOM 519 OG1 THR A1918 -6.996 9.762 -9.558 1.00 1.07 O ATOM 520 CG2 THR A1918 -9.110 8.728 -10.118 1.00 1.06 C ATOM 0 H THR A1918 -5.565 7.940 -8.418 1.00 0.65 H new ATOM 0 HA THR A1918 -8.374 8.225 -7.654 1.00 0.72 H new ATOM 0 HB THR A1918 -7.180 7.852 -10.418 1.00 0.94 H new ATOM 0 HG1 THR A1918 -7.014 10.224 -10.422 1.00 1.07 H new ATOM 0 HG21 THR A1918 -9.114 9.230 -11.085 1.00 1.06 H new ATOM 0 HG22 THR A1918 -9.632 7.775 -10.202 1.00 1.06 H new ATOM 0 HG23 THR A1918 -9.614 9.354 -9.382 1.00 1.06 H new ATOM 528 N ASP A1919 -9.188 5.923 -8.351 1.00 0.69 N ATOM 529 CA ASP A1919 -9.622 4.557 -8.569 1.00 0.74 C ATOM 530 C ASP A1919 -9.838 4.344 -10.069 1.00 0.99 C ATOM 531 O ASP A1919 -9.612 5.256 -10.865 1.00 1.30 O ATOM 532 CB ASP A1919 -10.919 4.287 -7.729 1.00 0.76 C ATOM 533 CG ASP A1919 -11.596 2.950 -7.994 1.00 0.99 C ATOM 534 OD1 ASP A1919 -10.941 1.904 -7.819 1.00 1.28 O ATOM 535 OD2 ASP A1919 -12.789 2.910 -8.276 1.00 1.62 O ATOM 0 H ASP A1919 -9.937 6.563 -8.087 1.00 0.69 H new ATOM 0 HA ASP A1919 -8.867 3.845 -8.237 1.00 0.74 H new ATOM 0 HB2 ASP A1919 -10.665 4.344 -6.670 1.00 0.76 H new ATOM 0 HB3 ASP A1919 -11.635 5.084 -7.929 1.00 0.76 H new ATOM 540 N SER A1920 -10.258 3.165 -10.453 1.00 1.06 N ATOM 541 CA SER A1920 -10.583 2.854 -11.821 1.00 1.32 C ATOM 542 C SER A1920 -11.925 3.541 -12.217 1.00 1.30 C ATOM 543 O SER A1920 -12.411 3.418 -13.339 1.00 1.75 O ATOM 544 CB SER A1920 -10.700 1.346 -11.929 1.00 1.64 C ATOM 545 OG SER A1920 -9.529 0.722 -11.388 1.00 2.13 O ATOM 0 H SER A1920 -10.386 2.382 -9.812 1.00 1.06 H new ATOM 0 HA SER A1920 -9.811 3.220 -12.498 1.00 1.32 H new ATOM 0 HB2 SER A1920 -11.585 1.003 -11.393 1.00 1.64 H new ATOM 0 HB3 SER A1920 -10.827 1.057 -12.972 1.00 1.64 H new ATOM 0 HG SER A1920 -9.614 -0.252 -11.460 1.00 2.13 H new ATOM 551 N HIS A1921 -12.505 4.255 -11.263 1.00 1.22 N ATOM 552 CA HIS A1921 -13.738 4.990 -11.434 1.00 1.77 C ATOM 553 C HIS A1921 -13.468 6.449 -11.055 1.00 1.73 C ATOM 554 O HIS A1921 -12.315 6.863 -10.980 1.00 2.31 O ATOM 555 CB HIS A1921 -14.841 4.406 -10.529 1.00 2.44 C ATOM 556 CG HIS A1921 -15.156 2.961 -10.781 1.00 3.25 C ATOM 557 ND1 HIS A1921 -14.552 1.944 -10.095 1.00 4.13 N ATOM 558 CD2 HIS A1921 -16.013 2.368 -11.640 1.00 3.75 C ATOM 559 CE1 HIS A1921 -15.017 0.790 -10.514 1.00 4.85 C ATOM 560 NE2 HIS A1921 -15.904 1.019 -11.448 1.00 4.66 N ATOM 0 H HIS A1921 -12.115 4.338 -10.324 1.00 1.22 H new ATOM 0 HA HIS A1921 -14.078 4.919 -12.467 1.00 1.77 H new ATOM 0 HB2 HIS A1921 -14.538 4.522 -9.488 1.00 2.44 H new ATOM 0 HB3 HIS A1921 -15.751 4.991 -10.663 1.00 2.44 H new ATOM 0 HD1 HIS A1921 -13.847 2.064 -9.368 1.00 4.13 H new ATOM 0 HD2 HIS A1921 -16.662 2.866 -12.345 1.00 3.75 H new ATOM 0 HE1 HIS A1921 -14.718 -0.182 -10.150 1.00 4.85 H new ATOM 569 N ASN A1922 -14.517 7.217 -10.847 1.00 1.59 N ATOM 570 CA ASN A1922 -14.408 8.639 -10.454 1.00 1.80 C ATOM 571 C ASN A1922 -13.866 8.763 -9.046 1.00 1.38 C ATOM 572 O ASN A1922 -13.121 9.694 -8.712 1.00 1.72 O ATOM 573 CB ASN A1922 -15.787 9.259 -10.468 1.00 2.28 C ATOM 574 CG ASN A1922 -15.799 10.784 -10.291 1.00 3.05 C ATOM 575 OD1 ASN A1922 -16.734 11.337 -9.717 1.00 3.29 O ATOM 576 ND2 ASN A1922 -14.799 11.472 -10.800 1.00 3.89 N ATOM 0 H ASN A1922 -15.478 6.889 -10.941 1.00 1.59 H new ATOM 0 HA ASN A1922 -13.738 9.140 -11.153 1.00 1.80 H new ATOM 0 HB2 ASN A1922 -16.274 9.011 -11.411 1.00 2.28 H new ATOM 0 HB3 ASN A1922 -16.383 8.809 -9.674 1.00 2.28 H new ATOM 0 HD21 ASN A1922 -14.788 12.489 -10.723 1.00 3.89 H new ATOM 0 HD22 ASN A1922 -14.035 10.988 -11.272 1.00 3.89 H new ATOM 583 N ARG A1923 -14.318 7.859 -8.225 1.00 0.98 N ATOM 584 CA ARG A1923 -13.913 7.764 -6.811 1.00 0.97 C ATOM 585 C ARG A1923 -12.385 7.675 -6.623 1.00 0.83 C ATOM 586 O ARG A1923 -11.642 7.310 -7.542 1.00 0.99 O ATOM 587 CB ARG A1923 -14.601 6.587 -6.135 1.00 1.46 C ATOM 588 CG ARG A1923 -14.292 5.235 -6.742 1.00 1.89 C ATOM 589 CD ARG A1923 -15.088 4.145 -6.059 1.00 2.66 C ATOM 590 NE ARG A1923 -14.833 2.821 -6.632 1.00 2.93 N ATOM 591 CZ ARG A1923 -15.652 1.766 -6.501 1.00 3.73 C ATOM 592 NH1 ARG A1923 -16.778 1.883 -5.799 1.00 4.35 N ATOM 593 NH2 ARG A1923 -15.311 0.586 -7.018 1.00 4.26 N ATOM 0 H ARG A1923 -14.991 7.145 -8.503 1.00 0.98 H new ATOM 0 HA ARG A1923 -14.232 8.691 -6.335 1.00 0.97 H new ATOM 0 HB2 ARG A1923 -14.314 6.572 -5.084 1.00 1.46 H new ATOM 0 HB3 ARG A1923 -15.679 6.747 -6.168 1.00 1.46 H new ATOM 0 HG2 ARG A1923 -14.524 5.248 -7.807 1.00 1.89 H new ATOM 0 HG3 ARG A1923 -13.226 5.025 -6.650 1.00 1.89 H new ATOM 0 HD2 ARG A1923 -14.842 4.131 -4.997 1.00 2.66 H new ATOM 0 HD3 ARG A1923 -16.151 4.373 -6.137 1.00 2.66 H new ATOM 0 HE ARG A1923 -13.974 2.692 -7.167 1.00 2.93 H new ATOM 0 HH11 ARG A1923 -17.016 2.773 -5.362 1.00 4.35 H new ATOM 0 HH12 ARG A1923 -17.402 1.082 -5.698 1.00 4.35 H new ATOM 0 HH21 ARG A1923 -14.426 0.483 -7.514 1.00 4.26 H new ATOM 0 HH22 ARG A1923 -15.935 -0.214 -6.917 1.00 4.26 H new ATOM 607 N LYS A1924 -11.930 8.011 -5.438 1.00 0.68 N ATOM 608 CA LYS A1924 -10.515 8.014 -5.135 1.00 0.67 C ATOM 609 C LYS A1924 -10.157 6.852 -4.229 1.00 0.53 C ATOM 610 O LYS A1924 -11.014 6.316 -3.490 1.00 0.55 O ATOM 611 CB LYS A1924 -10.123 9.322 -4.454 1.00 0.87 C ATOM 612 CG LYS A1924 -10.331 10.567 -5.303 1.00 1.32 C ATOM 613 CD LYS A1924 -10.169 11.838 -4.477 1.00 1.59 C ATOM 614 CE LYS A1924 -8.787 11.956 -3.849 1.00 2.07 C ATOM 615 NZ LYS A1924 -8.702 13.110 -2.933 1.00 2.72 N ATOM 0 H LYS A1924 -12.527 8.289 -4.659 1.00 0.68 H new ATOM 0 HA LYS A1924 -9.970 7.914 -6.073 1.00 0.67 H new ATOM 0 HB2 LYS A1924 -10.700 9.425 -3.535 1.00 0.87 H new ATOM 0 HB3 LYS A1924 -9.073 9.266 -4.166 1.00 0.87 H new ATOM 0 HG2 LYS A1924 -9.615 10.572 -6.125 1.00 1.32 H new ATOM 0 HG3 LYS A1924 -11.326 10.544 -5.747 1.00 1.32 H new ATOM 0 HD2 LYS A1924 -10.351 12.705 -5.112 1.00 1.59 H new ATOM 0 HD3 LYS A1924 -10.924 11.855 -3.691 1.00 1.59 H new ATOM 0 HE2 LYS A1924 -8.555 11.041 -3.304 1.00 2.07 H new ATOM 0 HE3 LYS A1924 -8.038 12.058 -4.634 1.00 2.07 H new ATOM 0 HZ1 LYS A1924 -7.747 13.159 -2.524 1.00 2.72 H new ATOM 0 HZ2 LYS A1924 -8.899 13.986 -3.459 1.00 2.72 H new ATOM 0 HZ3 LYS A1924 -9.400 13.000 -2.170 1.00 2.72 H new ATOM 629 N ILE A1925 -8.912 6.474 -4.277 1.00 0.49 N ATOM 630 CA ILE A1925 -8.396 5.421 -3.467 1.00 0.44 C ATOM 631 C ILE A1925 -7.494 6.028 -2.411 1.00 0.44 C ATOM 632 O ILE A1925 -6.451 6.617 -2.723 1.00 0.51 O ATOM 633 CB ILE A1925 -7.591 4.380 -4.292 1.00 0.51 C ATOM 634 CG1 ILE A1925 -8.442 3.791 -5.411 1.00 0.53 C ATOM 635 CG2 ILE A1925 -7.104 3.270 -3.389 1.00 0.56 C ATOM 636 CD1 ILE A1925 -7.702 2.782 -6.295 1.00 0.64 C ATOM 0 H ILE A1925 -8.219 6.900 -4.893 1.00 0.49 H new ATOM 0 HA ILE A1925 -9.238 4.896 -3.016 1.00 0.44 H new ATOM 0 HB ILE A1925 -6.737 4.890 -4.738 1.00 0.51 H new ATOM 0 HG12 ILE A1925 -9.313 3.304 -4.972 1.00 0.53 H new ATOM 0 HG13 ILE A1925 -8.813 4.603 -6.037 1.00 0.53 H new ATOM 0 HG21 ILE A1925 -6.541 2.544 -3.976 1.00 0.56 H new ATOM 0 HG22 ILE A1925 -6.461 3.687 -2.614 1.00 0.56 H new ATOM 0 HG23 ILE A1925 -7.958 2.777 -2.926 1.00 0.56 H new ATOM 0 HD11 ILE A1925 -8.377 2.410 -7.066 1.00 0.64 H new ATOM 0 HD12 ILE A1925 -6.847 3.268 -6.765 1.00 0.64 H new ATOM 0 HD13 ILE A1925 -7.355 1.949 -5.684 1.00 0.64 H new ATOM 648 N GLU A1926 -7.916 5.921 -1.199 1.00 0.43 N ATOM 649 CA GLU A1926 -7.168 6.415 -0.069 1.00 0.48 C ATOM 650 C GLU A1926 -6.353 5.264 0.482 1.00 0.46 C ATOM 651 O GLU A1926 -6.928 4.249 0.895 1.00 0.56 O ATOM 652 CB GLU A1926 -8.132 6.893 1.014 1.00 0.67 C ATOM 653 CG GLU A1926 -9.098 7.979 0.577 1.00 1.40 C ATOM 654 CD GLU A1926 -8.426 9.297 0.290 1.00 1.65 C ATOM 655 OE1 GLU A1926 -7.854 9.908 1.214 1.00 2.28 O ATOM 656 OE2 GLU A1926 -8.412 9.728 -0.884 1.00 1.95 O ATOM 0 H GLU A1926 -8.803 5.483 -0.949 1.00 0.43 H new ATOM 0 HA GLU A1926 -6.527 7.242 -0.373 1.00 0.48 H new ATOM 0 HB2 GLU A1926 -8.707 6.038 1.371 1.00 0.67 H new ATOM 0 HB3 GLU A1926 -7.551 7.262 1.859 1.00 0.67 H new ATOM 0 HG2 GLU A1926 -9.627 7.647 -0.317 1.00 1.40 H new ATOM 0 HG3 GLU A1926 -9.847 8.123 1.355 1.00 1.40 H new ATOM 663 N LEU A1927 -5.041 5.376 0.457 1.00 0.44 N ATOM 664 CA LEU A1927 -4.203 4.308 0.975 1.00 0.51 C ATOM 665 C LEU A1927 -3.131 4.890 1.864 1.00 0.46 C ATOM 666 O LEU A1927 -2.703 6.035 1.684 1.00 0.61 O ATOM 667 CB LEU A1927 -3.492 3.527 -0.150 1.00 0.68 C ATOM 668 CG LEU A1927 -4.324 3.034 -1.308 1.00 0.87 C ATOM 669 CD1 LEU A1927 -3.426 2.491 -2.396 1.00 1.54 C ATOM 670 CD2 LEU A1927 -5.239 1.956 -0.841 1.00 1.48 C ATOM 0 H LEU A1927 -4.535 6.182 0.090 1.00 0.44 H new ATOM 0 HA LEU A1927 -4.858 3.630 1.523 1.00 0.51 H new ATOM 0 HB2 LEU A1927 -2.705 4.165 -0.553 1.00 0.68 H new ATOM 0 HB3 LEU A1927 -3.003 2.663 0.301 1.00 0.68 H new ATOM 0 HG LEU A1927 -4.907 3.865 -1.705 1.00 0.87 H new ATOM 0 HD11 LEU A1927 -4.035 2.137 -3.228 1.00 1.54 H new ATOM 0 HD12 LEU A1927 -2.759 3.279 -2.744 1.00 1.54 H new ATOM 0 HD13 LEU A1927 -2.836 1.664 -2.001 1.00 1.54 H new ATOM 0 HD21 LEU A1927 -5.840 1.601 -1.678 1.00 1.48 H new ATOM 0 HD22 LEU A1927 -4.653 1.130 -0.439 1.00 1.48 H new ATOM 0 HD23 LEU A1927 -5.896 2.347 -0.064 1.00 1.48 H new ATOM 682 N ASN A1928 -2.710 4.134 2.810 1.00 0.51 N ATOM 683 CA ASN A1928 -1.581 4.491 3.619 1.00 0.51 C ATOM 684 C ASN A1928 -0.800 3.236 3.820 1.00 0.64 C ATOM 685 O ASN A1928 -1.376 2.225 4.207 1.00 0.81 O ATOM 686 CB ASN A1928 -1.999 5.115 4.961 1.00 0.55 C ATOM 687 CG ASN A1928 -0.822 5.707 5.746 1.00 0.54 C ATOM 688 OD1 ASN A1928 0.313 5.215 5.706 1.00 0.88 O ATOM 689 ND2 ASN A1928 -1.072 6.770 6.441 1.00 0.80 N ATOM 0 H ASN A1928 -3.136 3.240 3.055 1.00 0.51 H new ATOM 0 HA ASN A1928 -0.983 5.256 3.124 1.00 0.51 H new ATOM 0 HB2 ASN A1928 -2.735 5.898 4.777 1.00 0.55 H new ATOM 0 HB3 ASN A1928 -2.488 4.355 5.571 1.00 0.55 H new ATOM 0 HD21 ASN A1928 -0.326 7.220 6.971 1.00 0.80 H new ATOM 0 HD22 ASN A1928 -2.015 7.158 6.459 1.00 0.80 H new ATOM 696 N VAL A1929 0.489 3.293 3.505 1.00 0.65 N ATOM 697 CA VAL A1929 1.352 2.115 3.555 1.00 0.82 C ATOM 698 C VAL A1929 1.321 1.387 4.900 1.00 0.87 C ATOM 699 O VAL A1929 0.958 0.226 4.967 1.00 1.69 O ATOM 700 CB VAL A1929 2.820 2.390 3.096 1.00 0.99 C ATOM 701 CG1 VAL A1929 3.696 1.158 3.281 1.00 1.51 C ATOM 702 CG2 VAL A1929 2.835 2.781 1.641 1.00 1.73 C ATOM 0 H VAL A1929 0.963 4.147 3.210 1.00 0.65 H new ATOM 0 HA VAL A1929 0.914 1.440 2.820 1.00 0.82 H new ATOM 0 HB VAL A1929 3.215 3.199 3.710 1.00 0.99 H new ATOM 0 HG11 VAL A1929 4.711 1.381 2.953 1.00 1.51 H new ATOM 0 HG12 VAL A1929 3.709 0.875 4.334 1.00 1.51 H new ATOM 0 HG13 VAL A1929 3.296 0.335 2.689 1.00 1.51 H new ATOM 0 HG21 VAL A1929 3.861 2.972 1.326 1.00 1.73 H new ATOM 0 HG22 VAL A1929 2.416 1.972 1.043 1.00 1.73 H new ATOM 0 HG23 VAL A1929 2.239 3.683 1.500 1.00 1.73 H new ATOM 712 N CYS A1930 1.682 2.063 5.941 1.00 0.74 N ATOM 713 CA CYS A1930 1.735 1.440 7.254 1.00 0.83 C ATOM 714 C CYS A1930 1.899 2.476 8.341 1.00 0.74 C ATOM 715 O CYS A1930 2.599 2.261 9.328 1.00 0.97 O ATOM 716 CB CYS A1930 2.863 0.392 7.297 1.00 1.01 C ATOM 717 SG CYS A1930 4.464 0.977 6.647 1.00 1.20 S ATOM 0 H CYS A1930 1.948 3.048 5.924 1.00 0.74 H new ATOM 0 HA CYS A1930 0.789 0.930 7.437 1.00 0.83 H new ATOM 0 HB2 CYS A1930 3.001 0.067 8.328 1.00 1.01 H new ATOM 0 HB3 CYS A1930 2.551 -0.483 6.726 1.00 1.01 H new ATOM 722 N ALA A1931 1.228 3.590 8.177 1.00 0.63 N ATOM 723 CA ALA A1931 1.275 4.642 9.164 1.00 0.65 C ATOM 724 C ALA A1931 -0.128 5.092 9.511 1.00 0.75 C ATOM 725 O ALA A1931 -0.337 6.195 10.029 1.00 1.31 O ATOM 726 CB ALA A1931 2.100 5.775 8.657 1.00 0.62 C ATOM 0 H ALA A1931 0.641 3.792 7.367 1.00 0.63 H new ATOM 0 HA ALA A1931 1.740 4.265 10.075 1.00 0.65 H new ATOM 0 HB1 ALA A1931 2.132 6.566 9.406 1.00 0.62 H new ATOM 0 HB2 ALA A1931 3.113 5.426 8.455 1.00 0.62 H new ATOM 0 HB3 ALA A1931 1.660 6.163 7.738 1.00 0.62 H new ATOM 732 N GLU A1932 -1.054 4.167 9.294 1.00 0.53 N ATOM 733 CA GLU A1932 -2.470 4.290 9.554 1.00 0.58 C ATOM 734 C GLU A1932 -3.160 5.358 8.703 1.00 0.48 C ATOM 735 O GLU A1932 -2.779 6.532 8.718 1.00 0.49 O ATOM 736 CB GLU A1932 -2.773 4.481 11.044 1.00 0.84 C ATOM 737 CG GLU A1932 -2.374 3.319 11.974 1.00 0.82 C ATOM 738 CD GLU A1932 -0.864 3.129 12.137 1.00 1.32 C ATOM 739 OE1 GLU A1932 -0.261 3.747 13.010 1.00 1.72 O ATOM 740 OE2 GLU A1932 -0.258 2.359 11.374 1.00 2.07 O ATOM 0 H GLU A1932 -0.813 3.255 8.907 1.00 0.53 H new ATOM 0 HA GLU A1932 -2.899 3.336 9.248 1.00 0.58 H new ATOM 0 HB2 GLU A1932 -2.264 5.383 11.384 1.00 0.84 H new ATOM 0 HB3 GLU A1932 -3.843 4.658 11.156 1.00 0.84 H new ATOM 0 HG2 GLU A1932 -2.815 3.488 12.956 1.00 0.82 H new ATOM 0 HG3 GLU A1932 -2.804 2.396 11.587 1.00 0.82 H new ATOM 747 N ALA A1933 -4.181 4.946 7.953 1.00 0.51 N ATOM 748 CA ALA A1933 -4.927 5.873 7.122 1.00 0.57 C ATOM 749 C ALA A1933 -5.748 6.783 8.009 1.00 0.59 C ATOM 750 O ALA A1933 -6.776 6.390 8.562 1.00 0.77 O ATOM 751 CB ALA A1933 -5.799 5.144 6.113 1.00 0.74 C ATOM 0 H ALA A1933 -4.505 3.980 7.908 1.00 0.51 H new ATOM 0 HA ALA A1933 -4.225 6.475 6.545 1.00 0.57 H new ATOM 0 HB1 ALA A1933 -6.342 5.871 5.509 1.00 0.74 H new ATOM 0 HB2 ALA A1933 -5.172 4.531 5.466 1.00 0.74 H new ATOM 0 HB3 ALA A1933 -6.509 4.507 6.639 1.00 0.74 H new ATOM 757 N LYS A1934 -5.239 7.965 8.190 1.00 0.62 N ATOM 758 CA LYS A1934 -5.810 8.937 9.079 1.00 0.76 C ATOM 759 C LYS A1934 -6.808 9.802 8.336 1.00 0.88 C ATOM 760 O LYS A1934 -7.778 10.289 8.909 1.00 1.28 O ATOM 761 CB LYS A1934 -4.657 9.770 9.623 1.00 0.98 C ATOM 762 CG LYS A1934 -4.971 10.726 10.748 1.00 1.65 C ATOM 763 CD LYS A1934 -3.672 11.323 11.245 1.00 2.13 C ATOM 764 CE LYS A1934 -3.839 12.150 12.493 1.00 2.78 C ATOM 765 NZ LYS A1934 -2.520 12.546 13.018 1.00 3.10 N ATOM 0 H LYS A1934 -4.397 8.289 7.714 1.00 0.62 H new ATOM 0 HA LYS A1934 -6.349 8.458 9.896 1.00 0.76 H new ATOM 0 HB2 LYS A1934 -3.879 9.088 9.966 1.00 0.98 H new ATOM 0 HB3 LYS A1934 -4.236 10.345 8.798 1.00 0.98 H new ATOM 0 HG2 LYS A1934 -5.641 11.512 10.401 1.00 1.65 H new ATOM 0 HG3 LYS A1934 -5.483 10.205 11.557 1.00 1.65 H new ATOM 0 HD2 LYS A1934 -2.962 10.520 11.441 1.00 2.13 H new ATOM 0 HD3 LYS A1934 -3.241 11.944 10.460 1.00 2.13 H new ATOM 0 HE2 LYS A1934 -4.433 13.037 12.274 1.00 2.78 H new ATOM 0 HE3 LYS A1934 -4.383 11.580 13.246 1.00 2.78 H new ATOM 0 HZ1 LYS A1934 -2.646 13.116 13.879 1.00 3.10 H new ATOM 0 HZ2 LYS A1934 -1.967 11.695 13.244 1.00 3.10 H new ATOM 0 HZ3 LYS A1934 -2.016 13.107 12.302 1.00 3.10 H new ATOM 779 N SER A1935 -6.574 9.972 7.065 1.00 0.93 N ATOM 780 CA SER A1935 -7.410 10.788 6.235 1.00 1.23 C ATOM 781 C SER A1935 -8.445 9.933 5.503 1.00 1.17 C ATOM 782 O SER A1935 -8.130 8.821 5.059 1.00 2.00 O ATOM 783 CB SER A1935 -6.522 11.553 5.274 1.00 1.67 C ATOM 784 OG SER A1935 -5.553 12.303 6.016 1.00 2.17 O ATOM 0 H SER A1935 -5.790 9.543 6.573 1.00 0.93 H new ATOM 0 HA SER A1935 -7.971 11.498 6.843 1.00 1.23 H new ATOM 0 HB2 SER A1935 -6.022 10.862 4.596 1.00 1.67 H new ATOM 0 HB3 SER A1935 -7.124 12.223 4.660 1.00 1.67 H new ATOM 0 HG SER A1935 -4.732 12.390 5.488 1.00 2.17 H new ATOM 790 N SER A1936 -9.689 10.441 5.447 1.00 0.99 N ATOM 791 CA SER A1936 -10.861 9.792 4.822 1.00 1.20 C ATOM 792 C SER A1936 -11.369 8.598 5.640 1.00 0.95 C ATOM 793 O SER A1936 -12.576 8.446 5.868 1.00 1.08 O ATOM 794 CB SER A1936 -10.586 9.404 3.372 1.00 1.80 C ATOM 795 OG SER A1936 -10.171 10.538 2.617 1.00 2.28 O ATOM 0 H SER A1936 -9.917 11.350 5.851 1.00 0.99 H new ATOM 0 HA SER A1936 -11.661 10.532 4.815 1.00 1.20 H new ATOM 0 HB2 SER A1936 -9.814 8.635 3.336 1.00 1.80 H new ATOM 0 HB3 SER A1936 -11.484 8.975 2.929 1.00 1.80 H new ATOM 0 HG SER A1936 -9.283 10.371 2.238 1.00 2.28 H new ATOM 801 N CYS A1937 -10.460 7.778 6.080 1.00 0.87 N ATOM 802 CA CYS A1937 -10.764 6.644 6.904 1.00 0.93 C ATOM 803 C CYS A1937 -10.726 7.132 8.374 1.00 1.22 C ATOM 804 O CYS A1937 -10.750 8.350 8.626 1.00 1.98 O ATOM 805 CB CYS A1937 -9.680 5.590 6.689 1.00 1.06 C ATOM 806 SG CYS A1937 -9.196 5.364 4.946 1.00 1.44 S ATOM 0 H CYS A1937 -9.467 7.881 5.872 1.00 0.87 H new ATOM 0 HA CYS A1937 -11.738 6.217 6.664 1.00 0.93 H new ATOM 0 HB2 CYS A1937 -8.798 5.868 7.266 1.00 1.06 H new ATOM 0 HB3 CYS A1937 -10.032 4.637 7.084 1.00 1.06 H new ATOM 811 N ALA A1938 -10.686 6.234 9.332 1.00 0.97 N ATOM 812 CA ALA A1938 -10.551 6.655 10.708 1.00 1.24 C ATOM 813 C ALA A1938 -9.183 6.333 11.272 1.00 1.13 C ATOM 814 O ALA A1938 -8.266 7.169 11.251 1.00 1.32 O ATOM 815 CB ALA A1938 -11.615 6.052 11.608 1.00 1.48 C ATOM 0 H ALA A1938 -10.744 5.226 9.189 1.00 0.97 H new ATOM 0 HA ALA A1938 -10.682 7.737 10.692 1.00 1.24 H new ATOM 0 HB1 ALA A1938 -11.467 6.401 12.630 1.00 1.48 H new ATOM 0 HB2 ALA A1938 -12.602 6.357 11.260 1.00 1.48 H new ATOM 0 HB3 ALA A1938 -11.541 4.965 11.581 1.00 1.48 H new ATOM 821 N ASN A1939 -9.032 5.123 11.766 1.00 0.94 N ATOM 822 CA ASN A1939 -7.870 4.771 12.476 1.00 0.94 C ATOM 823 C ASN A1939 -7.111 3.580 11.877 1.00 0.69 C ATOM 824 O ASN A1939 -6.077 3.749 11.232 1.00 0.89 O ATOM 825 CB ASN A1939 -8.202 4.547 13.953 1.00 1.19 C ATOM 826 CG ASN A1939 -6.990 4.307 14.825 1.00 1.51 C ATOM 827 OD1 ASN A1939 -7.060 3.559 15.803 1.00 2.13 O ATOM 828 ND2 ASN A1939 -5.899 4.952 14.529 1.00 2.10 N ATOM 0 H ASN A1939 -9.720 4.375 11.676 1.00 0.94 H new ATOM 0 HA ASN A1939 -7.183 5.613 12.388 1.00 0.94 H new ATOM 0 HB2 ASN A1939 -8.742 5.416 14.330 1.00 1.19 H new ATOM 0 HB3 ASN A1939 -8.874 3.693 14.039 1.00 1.19 H new ATOM 0 HD21 ASN A1939 -5.070 4.846 15.113 1.00 2.10 H new ATOM 0 HD22 ASN A1939 -5.873 5.563 13.713 1.00 2.10 H new ATOM 835 N GLY A1940 -7.665 2.401 12.058 1.00 0.57 N ATOM 836 CA GLY A1940 -6.993 1.162 11.717 1.00 0.70 C ATOM 837 C GLY A1940 -7.191 0.705 10.295 1.00 0.61 C ATOM 838 O GLY A1940 -6.869 -0.430 9.965 1.00 0.79 O ATOM 0 H GLY A1940 -8.599 2.272 12.448 1.00 0.57 H new ATOM 0 HA2 GLY A1940 -5.925 1.282 11.899 1.00 0.70 H new ATOM 0 HA3 GLY A1940 -7.345 0.378 12.388 1.00 0.70 H new ATOM 842 N ALA A1941 -7.739 1.539 9.463 1.00 0.47 N ATOM 843 CA ALA A1941 -7.905 1.196 8.068 1.00 0.46 C ATOM 844 C ALA A1941 -6.660 1.608 7.304 1.00 0.42 C ATOM 845 O ALA A1941 -5.841 2.389 7.817 1.00 0.62 O ATOM 846 CB ALA A1941 -9.139 1.861 7.489 1.00 0.52 C ATOM 0 H ALA A1941 -8.082 2.465 9.719 1.00 0.47 H new ATOM 0 HA ALA A1941 -8.043 0.119 7.978 1.00 0.46 H new ATOM 0 HB1 ALA A1941 -9.241 1.587 6.439 1.00 0.52 H new ATOM 0 HB2 ALA A1941 -10.021 1.531 8.038 1.00 0.52 H new ATOM 0 HB3 ALA A1941 -9.043 2.943 7.574 1.00 0.52 H new ATOM 852 N ALA A1942 -6.483 1.070 6.119 1.00 0.36 N ATOM 853 CA ALA A1942 -5.345 1.440 5.300 1.00 0.38 C ATOM 854 C ALA A1942 -5.758 1.642 3.867 1.00 0.40 C ATOM 855 O ALA A1942 -5.176 2.453 3.161 1.00 0.49 O ATOM 856 CB ALA A1942 -4.245 0.412 5.381 1.00 0.44 C ATOM 0 H ALA A1942 -7.106 0.379 5.700 1.00 0.36 H new ATOM 0 HA ALA A1942 -4.959 2.381 5.691 1.00 0.38 H new ATOM 0 HB1 ALA A1942 -3.409 0.723 4.754 1.00 0.44 H new ATOM 0 HB2 ALA A1942 -3.909 0.319 6.414 1.00 0.44 H new ATOM 0 HB3 ALA A1942 -4.620 -0.551 5.033 1.00 0.44 H new ATOM 862 N VAL A1943 -6.735 0.875 3.427 1.00 0.41 N ATOM 863 CA VAL A1943 -7.251 0.991 2.089 1.00 0.42 C ATOM 864 C VAL A1943 -8.698 1.393 2.150 1.00 0.39 C ATOM 865 O VAL A1943 -9.543 0.638 2.653 1.00 0.43 O ATOM 866 CB VAL A1943 -7.155 -0.357 1.323 1.00 0.52 C ATOM 867 CG1 VAL A1943 -7.691 -0.233 -0.097 1.00 0.73 C ATOM 868 CG2 VAL A1943 -5.740 -0.862 1.304 1.00 0.75 C ATOM 0 H VAL A1943 -7.189 0.156 3.990 1.00 0.41 H new ATOM 0 HA VAL A1943 -6.656 1.739 1.565 1.00 0.42 H new ATOM 0 HB VAL A1943 -7.776 -1.078 1.855 1.00 0.52 H new ATOM 0 HG11 VAL A1943 -7.608 -1.195 -0.603 1.00 0.73 H new ATOM 0 HG12 VAL A1943 -8.737 0.071 -0.066 1.00 0.73 H new ATOM 0 HG13 VAL A1943 -7.112 0.514 -0.641 1.00 0.73 H new ATOM 0 HG21 VAL A1943 -5.698 -1.807 0.762 1.00 0.75 H new ATOM 0 HG22 VAL A1943 -5.100 -0.132 0.810 1.00 0.75 H new ATOM 0 HG23 VAL A1943 -5.394 -1.014 2.326 1.00 0.75 H new ATOM 878 N CYS A1944 -8.992 2.541 1.634 1.00 0.41 N ATOM 879 CA CYS A1944 -10.337 3.012 1.592 1.00 0.49 C ATOM 880 C CYS A1944 -10.692 3.462 0.199 1.00 0.47 C ATOM 881 O CYS A1944 -10.194 4.485 -0.295 1.00 0.54 O ATOM 882 CB CYS A1944 -10.556 4.160 2.569 1.00 0.70 C ATOM 883 SG CYS A1944 -10.243 3.756 4.315 1.00 1.15 S ATOM 0 H CYS A1944 -8.306 3.179 1.230 1.00 0.41 H new ATOM 0 HA CYS A1944 -10.984 2.184 1.883 1.00 0.49 H new ATOM 0 HB2 CYS A1944 -9.909 4.989 2.282 1.00 0.70 H new ATOM 0 HB3 CYS A1944 -11.584 4.509 2.471 1.00 0.70 H new ATOM 888 N ILE A1945 -11.505 2.691 -0.453 1.00 0.46 N ATOM 889 CA ILE A1945 -12.024 3.077 -1.732 1.00 0.49 C ATOM 890 C ILE A1945 -13.199 3.965 -1.392 1.00 0.49 C ATOM 891 O ILE A1945 -14.220 3.488 -0.907 1.00 0.54 O ATOM 892 CB ILE A1945 -12.509 1.852 -2.550 1.00 0.56 C ATOM 893 CG1 ILE A1945 -11.438 0.739 -2.577 1.00 0.54 C ATOM 894 CG2 ILE A1945 -12.856 2.279 -3.965 1.00 0.68 C ATOM 895 CD1 ILE A1945 -10.115 1.139 -3.206 1.00 0.56 C ATOM 0 H ILE A1945 -11.827 1.783 -0.119 1.00 0.46 H new ATOM 0 HA ILE A1945 -11.268 3.567 -2.345 1.00 0.49 H new ATOM 0 HB ILE A1945 -13.400 1.450 -2.067 1.00 0.56 H new ATOM 0 HG12 ILE A1945 -11.252 0.409 -1.555 1.00 0.54 H new ATOM 0 HG13 ILE A1945 -11.838 -0.117 -3.121 1.00 0.54 H new ATOM 0 HG21 ILE A1945 -13.196 1.413 -4.533 1.00 0.68 H new ATOM 0 HG22 ILE A1945 -13.648 3.027 -3.935 1.00 0.68 H new ATOM 0 HG23 ILE A1945 -11.974 2.704 -4.444 1.00 0.68 H new ATOM 0 HD11 ILE A1945 -9.429 0.293 -3.179 1.00 0.56 H new ATOM 0 HD12 ILE A1945 -10.280 1.439 -4.241 1.00 0.56 H new ATOM 0 HD13 ILE A1945 -9.685 1.973 -2.651 1.00 0.56 H new ATOM 907 N THR A1946 -13.046 5.233 -1.569 1.00 0.48 N ATOM 908 CA THR A1946 -14.015 6.135 -1.057 1.00 0.51 C ATOM 909 C THR A1946 -14.780 6.800 -2.198 1.00 0.53 C ATOM 910 O THR A1946 -14.217 7.566 -2.977 1.00 0.61 O ATOM 911 CB THR A1946 -13.291 7.169 -0.149 1.00 0.61 C ATOM 912 OG1 THR A1946 -12.299 6.458 0.624 1.00 0.91 O ATOM 913 CG2 THR A1946 -14.253 7.815 0.846 1.00 0.79 C ATOM 0 H THR A1946 -12.264 5.665 -2.061 1.00 0.48 H new ATOM 0 HA THR A1946 -14.754 5.603 -0.458 1.00 0.51 H new ATOM 0 HB THR A1946 -12.860 7.943 -0.784 1.00 0.61 H new ATOM 0 HG1 THR A1946 -11.825 7.088 1.206 1.00 0.91 H new ATOM 0 HG21 THR A1946 -13.711 8.532 1.463 1.00 0.79 H new ATOM 0 HG22 THR A1946 -15.046 8.330 0.304 1.00 0.79 H new ATOM 0 HG23 THR A1946 -14.689 7.045 1.482 1.00 0.79 H new ATOM 921 N ASP A1947 -16.032 6.446 -2.325 1.00 0.58 N ATOM 922 CA ASP A1947 -16.901 7.025 -3.314 1.00 0.74 C ATOM 923 C ASP A1947 -17.977 7.819 -2.653 1.00 0.78 C ATOM 924 O ASP A1947 -18.952 7.282 -2.116 1.00 0.77 O ATOM 925 CB ASP A1947 -17.464 6.015 -4.352 1.00 0.91 C ATOM 926 CG ASP A1947 -18.154 4.782 -3.797 1.00 1.21 C ATOM 927 OD1 ASP A1947 -19.342 4.879 -3.425 1.00 1.24 O ATOM 928 OD2 ASP A1947 -17.495 3.733 -3.618 1.00 1.94 O ATOM 0 H ASP A1947 -16.481 5.741 -1.739 1.00 0.58 H new ATOM 0 HA ASP A1947 -16.283 7.696 -3.911 1.00 0.74 H new ATOM 0 HB2 ASP A1947 -18.172 6.543 -4.991 1.00 0.91 H new ATOM 0 HB3 ASP A1947 -16.642 5.688 -4.989 1.00 0.91 H new ATOM 933 N GLY A1948 -17.751 9.102 -2.625 1.00 0.91 N ATOM 934 CA GLY A1948 -18.683 10.006 -2.016 1.00 1.03 C ATOM 935 C GLY A1948 -18.753 9.782 -0.522 1.00 1.03 C ATOM 936 O GLY A1948 -17.727 9.869 0.156 1.00 1.07 O ATOM 0 H GLY A1948 -16.923 9.547 -3.020 1.00 0.91 H new ATOM 0 HA2 GLY A1948 -18.385 11.034 -2.220 1.00 1.03 H new ATOM 0 HA3 GLY A1948 -19.671 9.867 -2.455 1.00 1.03 H new ATOM 940 N PRO A1949 -19.928 9.456 0.018 1.00 1.06 N ATOM 941 CA PRO A1949 -20.085 9.199 1.439 1.00 1.15 C ATOM 942 C PRO A1949 -19.721 7.749 1.819 1.00 1.00 C ATOM 943 O PRO A1949 -19.658 7.399 3.005 1.00 1.12 O ATOM 944 CB PRO A1949 -21.571 9.462 1.671 1.00 1.37 C ATOM 945 CG PRO A1949 -22.231 9.106 0.379 1.00 1.27 C ATOM 946 CD PRO A1949 -21.213 9.342 -0.712 1.00 1.09 C ATOM 0 HA PRO A1949 -19.425 9.818 2.047 1.00 1.15 H new ATOM 0 HB2 PRO A1949 -21.956 8.856 2.491 1.00 1.37 H new ATOM 0 HB3 PRO A1949 -21.752 10.505 1.933 1.00 1.37 H new ATOM 0 HG2 PRO A1949 -22.557 8.066 0.385 1.00 1.27 H new ATOM 0 HG3 PRO A1949 -23.119 9.717 0.218 1.00 1.27 H new ATOM 0 HD2 PRO A1949 -21.195 8.519 -1.426 1.00 1.09 H new ATOM 0 HD3 PRO A1949 -21.434 10.248 -1.276 1.00 1.09 H new ATOM 954 N LYS A1950 -19.475 6.912 0.824 1.00 0.86 N ATOM 955 CA LYS A1950 -19.153 5.530 1.075 1.00 0.83 C ATOM 956 C LYS A1950 -17.657 5.334 1.113 1.00 0.66 C ATOM 957 O LYS A1950 -16.945 5.669 0.178 1.00 0.71 O ATOM 958 CB LYS A1950 -19.785 4.603 0.033 1.00 0.95 C ATOM 959 CG LYS A1950 -19.467 3.127 0.247 1.00 1.31 C ATOM 960 CD LYS A1950 -20.135 2.258 -0.795 1.00 1.91 C ATOM 961 CE LYS A1950 -19.796 0.784 -0.609 1.00 2.18 C ATOM 962 NZ LYS A1950 -20.217 0.258 0.710 1.00 2.52 N ATOM 0 H LYS A1950 -19.494 7.172 -0.162 1.00 0.86 H new ATOM 0 HA LYS A1950 -19.569 5.268 2.048 1.00 0.83 H new ATOM 0 HB2 LYS A1950 -20.867 4.738 0.049 1.00 0.95 H new ATOM 0 HB3 LYS A1950 -19.442 4.899 -0.958 1.00 0.95 H new ATOM 0 HG2 LYS A1950 -18.388 2.977 0.209 1.00 1.31 H new ATOM 0 HG3 LYS A1950 -19.796 2.823 1.241 1.00 1.31 H new ATOM 0 HD2 LYS A1950 -21.215 2.392 -0.740 1.00 1.91 H new ATOM 0 HD3 LYS A1950 -19.824 2.579 -1.789 1.00 1.91 H new ATOM 0 HE2 LYS A1950 -20.277 0.204 -1.396 1.00 2.18 H new ATOM 0 HE3 LYS A1950 -18.721 0.646 -0.723 1.00 2.18 H new ATOM 0 HZ1 LYS A1950 -20.102 -0.776 0.724 1.00 2.52 H new ATOM 0 HZ2 LYS A1950 -19.630 0.682 1.456 1.00 2.52 H new ATOM 0 HZ3 LYS A1950 -21.215 0.497 0.877 1.00 2.52 H new ATOM 976 N THR A1951 -17.195 4.823 2.195 1.00 0.68 N ATOM 977 CA THR A1951 -15.823 4.539 2.389 1.00 0.60 C ATOM 978 C THR A1951 -15.690 3.019 2.483 1.00 0.57 C ATOM 979 O THR A1951 -16.162 2.402 3.441 1.00 0.72 O ATOM 980 CB THR A1951 -15.365 5.224 3.686 1.00 0.73 C ATOM 981 OG1 THR A1951 -15.858 6.579 3.650 1.00 1.05 O ATOM 982 CG2 THR A1951 -13.845 5.255 3.788 1.00 1.07 C ATOM 0 H THR A1951 -17.781 4.584 2.995 1.00 0.68 H new ATOM 0 HA THR A1951 -15.202 4.908 1.573 1.00 0.60 H new ATOM 0 HB THR A1951 -15.748 4.673 4.545 1.00 0.73 H new ATOM 0 HG1 THR A1951 -15.585 7.048 4.466 1.00 1.05 H new ATOM 0 HG21 THR A1951 -13.553 5.746 4.716 1.00 1.07 H new ATOM 0 HG22 THR A1951 -13.459 4.236 3.779 1.00 1.07 H new ATOM 0 HG23 THR A1951 -13.435 5.806 2.942 1.00 1.07 H new ATOM 990 N LEU A1952 -15.153 2.419 1.457 1.00 0.52 N ATOM 991 CA LEU A1952 -15.033 0.985 1.389 1.00 0.52 C ATOM 992 C LEU A1952 -13.667 0.534 1.868 1.00 0.47 C ATOM 993 O LEU A1952 -12.651 0.790 1.210 1.00 0.52 O ATOM 994 CB LEU A1952 -15.286 0.499 -0.048 1.00 0.57 C ATOM 995 CG LEU A1952 -15.210 -1.015 -0.284 1.00 0.63 C ATOM 996 CD1 LEU A1952 -16.262 -1.746 0.535 1.00 1.14 C ATOM 997 CD2 LEU A1952 -15.370 -1.329 -1.765 1.00 1.15 C ATOM 0 H LEU A1952 -14.785 2.909 0.642 1.00 0.52 H new ATOM 0 HA LEU A1952 -15.784 0.546 2.046 1.00 0.52 H new ATOM 0 HB2 LEU A1952 -16.274 0.843 -0.355 1.00 0.57 H new ATOM 0 HB3 LEU A1952 -14.562 0.983 -0.704 1.00 0.57 H new ATOM 0 HG LEU A1952 -14.229 -1.362 0.041 1.00 0.63 H new ATOM 0 HD11 LEU A1952 -16.187 -2.818 0.350 1.00 1.14 H new ATOM 0 HD12 LEU A1952 -16.100 -1.549 1.595 1.00 1.14 H new ATOM 0 HD13 LEU A1952 -17.254 -1.397 0.248 1.00 1.14 H new ATOM 0 HD21 LEU A1952 -15.314 -2.407 -1.917 1.00 1.15 H new ATOM 0 HD22 LEU A1952 -16.337 -0.964 -2.112 1.00 1.15 H new ATOM 0 HD23 LEU A1952 -14.574 -0.842 -2.328 1.00 1.15 H new ATOM 1009 N ASN A1953 -13.645 -0.099 3.012 1.00 0.48 N ATOM 1010 CA ASN A1953 -12.423 -0.649 3.570 1.00 0.45 C ATOM 1011 C ASN A1953 -12.030 -1.879 2.766 1.00 0.46 C ATOM 1012 O ASN A1953 -12.663 -2.933 2.856 1.00 0.64 O ATOM 1013 CB ASN A1953 -12.614 -0.997 5.077 1.00 0.59 C ATOM 1014 CG ASN A1953 -11.382 -1.619 5.774 1.00 1.20 C ATOM 1015 OD1 ASN A1953 -10.589 -2.334 5.180 1.00 1.86 O ATOM 1016 ND2 ASN A1953 -11.229 -1.345 7.043 1.00 1.93 N ATOM 0 H ASN A1953 -14.472 -0.251 3.589 1.00 0.48 H new ATOM 0 HA ASN A1953 -11.624 0.090 3.509 1.00 0.45 H new ATOM 0 HB2 ASN A1953 -12.892 -0.088 5.610 1.00 0.59 H new ATOM 0 HB3 ASN A1953 -13.451 -1.689 5.170 1.00 0.59 H new ATOM 0 HD21 ASN A1953 -10.436 -1.730 7.556 1.00 1.93 H new ATOM 0 HD22 ASN A1953 -11.903 -0.746 7.520 1.00 1.93 H new ATOM 1023 N ALA A1954 -11.012 -1.741 1.966 1.00 0.43 N ATOM 1024 CA ALA A1954 -10.562 -2.833 1.149 1.00 0.58 C ATOM 1025 C ALA A1954 -9.284 -3.426 1.707 1.00 0.70 C ATOM 1026 O ALA A1954 -8.625 -4.245 1.062 1.00 1.17 O ATOM 1027 CB ALA A1954 -10.403 -2.403 -0.300 1.00 0.69 C ATOM 0 H ALA A1954 -10.475 -0.880 1.861 1.00 0.43 H new ATOM 0 HA ALA A1954 -11.322 -3.614 1.169 1.00 0.58 H new ATOM 0 HB1 ALA A1954 -10.061 -3.250 -0.895 1.00 0.69 H new ATOM 0 HB2 ALA A1954 -11.362 -2.053 -0.683 1.00 0.69 H new ATOM 0 HB3 ALA A1954 -9.672 -1.597 -0.362 1.00 0.69 H new ATOM 1033 N GLY A1955 -8.981 -3.044 2.919 1.00 0.42 N ATOM 1034 CA GLY A1955 -7.817 -3.509 3.597 1.00 0.51 C ATOM 1035 C GLY A1955 -7.548 -2.655 4.805 1.00 0.43 C ATOM 1036 O GLY A1955 -7.538 -1.405 4.716 1.00 0.47 O ATOM 0 H GLY A1955 -9.547 -2.393 3.463 1.00 0.42 H new ATOM 0 HA2 GLY A1955 -7.953 -4.548 3.899 1.00 0.51 H new ATOM 0 HA3 GLY A1955 -6.960 -3.482 2.925 1.00 0.51 H new ATOM 1040 N LYS A1956 -7.363 -3.271 5.939 1.00 0.43 N ATOM 1041 CA LYS A1956 -7.087 -2.511 7.110 1.00 0.45 C ATOM 1042 C LYS A1956 -5.599 -2.306 7.206 1.00 0.38 C ATOM 1043 O LYS A1956 -4.834 -2.857 6.383 1.00 0.40 O ATOM 1044 CB LYS A1956 -7.636 -3.163 8.390 1.00 0.61 C ATOM 1045 CG LYS A1956 -6.931 -4.430 8.832 1.00 0.70 C ATOM 1046 CD LYS A1956 -7.465 -4.890 10.179 1.00 0.97 C ATOM 1047 CE LYS A1956 -6.729 -6.108 10.705 1.00 1.54 C ATOM 1048 NZ LYS A1956 -5.277 -5.867 10.839 1.00 2.43 N ATOM 0 H LYS A1956 -7.399 -4.282 6.070 1.00 0.43 H new ATOM 0 HA LYS A1956 -7.598 -1.552 7.025 1.00 0.45 H new ATOM 0 HB2 LYS A1956 -7.580 -2.436 9.200 1.00 0.61 H new ATOM 0 HB3 LYS A1956 -8.691 -3.390 8.237 1.00 0.61 H new ATOM 0 HG2 LYS A1956 -7.077 -5.214 8.089 1.00 0.70 H new ATOM 0 HG3 LYS A1956 -5.858 -4.252 8.900 1.00 0.70 H new ATOM 0 HD2 LYS A1956 -7.377 -4.076 10.899 1.00 0.97 H new ATOM 0 HD3 LYS A1956 -8.526 -5.121 10.087 1.00 0.97 H new ATOM 0 HE2 LYS A1956 -7.140 -6.388 11.675 1.00 1.54 H new ATOM 0 HE3 LYS A1956 -6.896 -6.950 10.033 1.00 1.54 H new ATOM 0 HZ1 LYS A1956 -4.857 -6.603 11.442 1.00 2.43 H new ATOM 0 HZ2 LYS A1956 -4.832 -5.894 9.899 1.00 2.43 H new ATOM 0 HZ3 LYS A1956 -5.118 -4.934 11.271 1.00 2.43 H new ATOM 1062 N LEU A1957 -5.186 -1.534 8.174 1.00 0.42 N ATOM 1063 CA LEU A1957 -3.809 -1.232 8.376 1.00 0.45 C ATOM 1064 C LEU A1957 -3.034 -2.506 8.618 1.00 0.45 C ATOM 1065 O LEU A1957 -3.250 -3.221 9.605 1.00 0.53 O ATOM 1066 CB LEU A1957 -3.652 -0.169 9.500 1.00 0.57 C ATOM 1067 CG LEU A1957 -2.235 0.332 9.858 1.00 0.77 C ATOM 1068 CD1 LEU A1957 -1.458 -0.677 10.690 1.00 1.24 C ATOM 1069 CD2 LEU A1957 -1.456 0.698 8.597 1.00 1.30 C ATOM 0 H LEU A1957 -5.811 -1.095 8.850 1.00 0.42 H new ATOM 0 HA LEU A1957 -3.382 -0.782 7.480 1.00 0.45 H new ATOM 0 HB2 LEU A1957 -4.248 0.699 9.219 1.00 0.57 H new ATOM 0 HB3 LEU A1957 -4.096 -0.580 10.407 1.00 0.57 H new ATOM 0 HG LEU A1957 -2.359 1.226 10.469 1.00 0.77 H new ATOM 0 HD11 LEU A1957 -0.469 -0.278 10.915 1.00 1.24 H new ATOM 0 HD12 LEU A1957 -1.992 -0.870 11.620 1.00 1.24 H new ATOM 0 HD13 LEU A1957 -1.355 -1.607 10.131 1.00 1.24 H new ATOM 0 HD21 LEU A1957 -0.461 1.048 8.873 1.00 1.30 H new ATOM 0 HD22 LEU A1957 -1.367 -0.180 7.957 1.00 1.30 H new ATOM 0 HD23 LEU A1957 -1.983 1.487 8.060 1.00 1.30 H new ATOM 1081 N SER A1958 -2.208 -2.809 7.674 1.00 0.56 N ATOM 1082 CA SER A1958 -1.379 -3.941 7.715 1.00 0.67 C ATOM 1083 C SER A1958 0.055 -3.434 7.743 1.00 0.65 C ATOM 1084 O SER A1958 0.537 -2.871 6.775 1.00 0.84 O ATOM 1085 CB SER A1958 -1.659 -4.801 6.480 1.00 0.96 C ATOM 1086 OG SER A1958 -3.069 -5.074 6.371 1.00 1.62 O ATOM 0 H SER A1958 -2.096 -2.249 6.829 1.00 0.56 H new ATOM 0 HA SER A1958 -1.561 -4.561 8.593 1.00 0.67 H new ATOM 0 HB2 SER A1958 -1.311 -4.287 5.584 1.00 0.96 H new ATOM 0 HB3 SER A1958 -1.104 -5.737 6.547 1.00 0.96 H new ATOM 0 HG SER A1958 -3.555 -4.235 6.228 1.00 1.62 H new ATOM 1092 N LYS A1959 0.690 -3.571 8.874 1.00 0.59 N ATOM 1093 CA LYS A1959 2.013 -3.090 9.080 1.00 0.71 C ATOM 1094 C LYS A1959 2.981 -4.267 8.929 1.00 0.76 C ATOM 1095 O LYS A1959 4.175 -4.167 9.214 1.00 1.04 O ATOM 1096 CB LYS A1959 2.024 -2.461 10.478 1.00 0.86 C ATOM 1097 CG LYS A1959 3.243 -1.669 10.859 1.00 0.96 C ATOM 1098 CD LYS A1959 2.968 -0.794 12.102 1.00 1.10 C ATOM 1099 CE LYS A1959 2.063 0.383 11.764 1.00 0.98 C ATOM 1100 NZ LYS A1959 1.555 1.095 12.956 1.00 1.48 N ATOM 0 H LYS A1959 0.287 -4.031 9.690 1.00 0.59 H new ATOM 0 HA LYS A1959 2.327 -2.337 8.357 1.00 0.71 H new ATOM 0 HB2 LYS A1959 1.155 -1.808 10.563 1.00 0.86 H new ATOM 0 HB3 LYS A1959 1.896 -3.259 11.210 1.00 0.86 H new ATOM 0 HG2 LYS A1959 4.072 -2.346 11.063 1.00 0.96 H new ATOM 0 HG3 LYS A1959 3.546 -1.037 10.024 1.00 0.96 H new ATOM 0 HD2 LYS A1959 2.504 -1.400 12.880 1.00 1.10 H new ATOM 0 HD3 LYS A1959 3.911 -0.426 12.505 1.00 1.10 H new ATOM 0 HE2 LYS A1959 2.612 1.086 11.137 1.00 0.98 H new ATOM 0 HE3 LYS A1959 1.218 0.025 11.176 1.00 0.98 H new ATOM 0 HZ1 LYS A1959 0.550 1.327 12.820 1.00 1.48 H new ATOM 0 HZ2 LYS A1959 1.660 0.488 13.794 1.00 1.48 H new ATOM 0 HZ3 LYS A1959 2.097 1.972 13.094 1.00 1.48 H new ATOM 1114 N THR A1960 2.434 -5.377 8.453 1.00 0.74 N ATOM 1115 CA THR A1960 3.179 -6.565 8.175 1.00 0.81 C ATOM 1116 C THR A1960 3.815 -6.389 6.804 1.00 0.77 C ATOM 1117 O THR A1960 3.103 -6.195 5.803 1.00 1.05 O ATOM 1118 CB THR A1960 2.228 -7.769 8.117 1.00 0.92 C ATOM 1119 OG1 THR A1960 1.271 -7.678 9.186 1.00 1.63 O ATOM 1120 CG2 THR A1960 3.002 -9.070 8.249 1.00 1.27 C ATOM 0 H THR A1960 1.438 -5.463 8.250 1.00 0.74 H new ATOM 0 HA THR A1960 3.929 -6.734 8.948 1.00 0.81 H new ATOM 0 HB THR A1960 1.715 -7.759 7.155 1.00 0.92 H new ATOM 0 HG1 THR A1960 0.663 -8.446 9.147 1.00 1.63 H new ATOM 0 HG21 THR A1960 2.310 -9.911 8.206 1.00 1.27 H new ATOM 0 HG22 THR A1960 3.722 -9.150 7.434 1.00 1.27 H new ATOM 0 HG23 THR A1960 3.530 -9.084 9.202 1.00 1.27 H new ATOM 1128 N LEU A1961 5.109 -6.465 6.749 1.00 0.55 N ATOM 1129 CA LEU A1961 5.826 -6.206 5.543 1.00 0.51 C ATOM 1130 C LEU A1961 6.631 -7.436 5.197 1.00 0.51 C ATOM 1131 O LEU A1961 7.240 -8.055 6.082 1.00 0.58 O ATOM 1132 CB LEU A1961 6.750 -5.004 5.744 1.00 0.62 C ATOM 1133 CG LEU A1961 7.369 -4.436 4.480 1.00 0.71 C ATOM 1134 CD1 LEU A1961 6.288 -3.876 3.563 1.00 1.35 C ATOM 1135 CD2 LEU A1961 8.402 -3.379 4.809 1.00 1.32 C ATOM 0 H LEU A1961 5.699 -6.710 7.545 1.00 0.55 H new ATOM 0 HA LEU A1961 5.136 -5.978 4.730 1.00 0.51 H new ATOM 0 HB2 LEU A1961 6.186 -4.213 6.238 1.00 0.62 H new ATOM 0 HB3 LEU A1961 7.553 -5.294 6.422 1.00 0.62 H new ATOM 0 HG LEU A1961 7.878 -5.245 3.955 1.00 0.71 H new ATOM 0 HD11 LEU A1961 6.749 -3.473 2.661 1.00 1.35 H new ATOM 0 HD12 LEU A1961 5.594 -4.671 3.291 1.00 1.35 H new ATOM 0 HD13 LEU A1961 5.747 -3.083 4.080 1.00 1.35 H new ATOM 0 HD21 LEU A1961 8.830 -2.989 3.886 1.00 1.32 H new ATOM 0 HD22 LEU A1961 7.929 -2.567 5.361 1.00 1.32 H new ATOM 0 HD23 LEU A1961 9.192 -3.819 5.417 1.00 1.32 H new ATOM 1147 N THR A1962 6.637 -7.813 3.953 1.00 0.51 N ATOM 1148 CA THR A1962 7.315 -9.008 3.565 1.00 0.58 C ATOM 1149 C THR A1962 7.982 -8.863 2.204 1.00 0.51 C ATOM 1150 O THR A1962 7.420 -8.295 1.284 1.00 0.72 O ATOM 1151 CB THR A1962 6.339 -10.230 3.626 1.00 0.72 C ATOM 1152 OG1 THR A1962 6.879 -11.389 2.970 1.00 1.19 O ATOM 1153 CG2 THR A1962 4.948 -9.881 3.093 1.00 0.61 C ATOM 0 H THR A1962 6.180 -7.310 3.193 1.00 0.51 H new ATOM 0 HA THR A1962 8.120 -9.193 4.276 1.00 0.58 H new ATOM 0 HB THR A1962 6.226 -10.483 4.680 1.00 0.72 H new ATOM 0 HG1 THR A1962 6.239 -12.128 3.033 1.00 1.19 H new ATOM 0 HG21 THR A1962 4.304 -10.758 3.154 1.00 0.61 H new ATOM 0 HG22 THR A1962 4.521 -9.075 3.690 1.00 0.61 H new ATOM 0 HG23 THR A1962 5.026 -9.560 2.054 1.00 0.61 H new ATOM 1161 N TYR A1963 9.200 -9.330 2.099 1.00 0.47 N ATOM 1162 CA TYR A1963 9.907 -9.281 0.848 1.00 0.48 C ATOM 1163 C TYR A1963 9.609 -10.539 0.065 1.00 0.55 C ATOM 1164 O TYR A1963 9.520 -11.624 0.641 1.00 0.75 O ATOM 1165 CB TYR A1963 11.424 -9.075 1.056 1.00 0.62 C ATOM 1166 CG TYR A1963 12.113 -10.094 1.952 1.00 0.78 C ATOM 1167 CD1 TYR A1963 12.545 -11.314 1.451 1.00 1.03 C ATOM 1168 CD2 TYR A1963 12.351 -9.821 3.294 1.00 0.78 C ATOM 1169 CE1 TYR A1963 13.186 -12.229 2.251 1.00 1.27 C ATOM 1170 CE2 TYR A1963 12.991 -10.737 4.103 1.00 1.01 C ATOM 1171 CZ TYR A1963 13.406 -11.938 3.575 1.00 1.25 C ATOM 1172 OH TYR A1963 14.058 -12.852 4.374 1.00 1.52 O ATOM 0 H TYR A1963 9.723 -9.749 2.868 1.00 0.47 H new ATOM 0 HA TYR A1963 9.563 -8.419 0.276 1.00 0.48 H new ATOM 0 HB2 TYR A1963 11.911 -9.089 0.081 1.00 0.62 H new ATOM 0 HB3 TYR A1963 11.583 -8.082 1.477 1.00 0.62 H new ATOM 0 HD1 TYR A1963 12.374 -11.549 0.411 1.00 1.03 H new ATOM 0 HD2 TYR A1963 12.030 -8.877 3.710 1.00 0.78 H new ATOM 0 HE1 TYR A1963 13.515 -13.172 1.841 1.00 1.27 H new ATOM 0 HE2 TYR A1963 13.165 -10.513 5.145 1.00 1.01 H new ATOM 0 HH TYR A1963 14.136 -12.495 5.283 1.00 1.52 H new ATOM 1182 N GLU A1964 9.412 -10.398 -1.208 1.00 0.54 N ATOM 1183 CA GLU A1964 9.062 -11.506 -2.041 1.00 0.70 C ATOM 1184 C GLU A1964 9.763 -11.380 -3.379 1.00 0.80 C ATOM 1185 O GLU A1964 9.387 -10.533 -4.213 1.00 0.78 O ATOM 1186 CB GLU A1964 7.567 -11.497 -2.225 1.00 0.87 C ATOM 1187 CG GLU A1964 6.998 -12.635 -3.017 1.00 1.25 C ATOM 1188 CD GLU A1964 5.534 -12.447 -3.179 1.00 1.87 C ATOM 1189 OE1 GLU A1964 4.780 -12.800 -2.253 1.00 2.22 O ATOM 1190 OE2 GLU A1964 5.121 -11.871 -4.197 1.00 2.75 O ATOM 0 H GLU A1964 9.490 -9.508 -1.701 1.00 0.54 H new ATOM 0 HA GLU A1964 9.372 -12.445 -1.582 1.00 0.70 H new ATOM 0 HB2 GLU A1964 7.099 -11.495 -1.240 1.00 0.87 H new ATOM 0 HB3 GLU A1964 7.286 -10.564 -2.713 1.00 0.87 H new ATOM 0 HG2 GLU A1964 7.478 -12.687 -3.994 1.00 1.25 H new ATOM 0 HG3 GLU A1964 7.200 -13.580 -2.512 1.00 1.25 H new ATOM 1197 N ASP A1965 10.812 -12.178 -3.551 1.00 1.04 N ATOM 1198 CA ASP A1965 11.640 -12.195 -4.774 1.00 1.25 C ATOM 1199 C ASP A1965 12.278 -10.843 -4.983 1.00 1.07 C ATOM 1200 O ASP A1965 12.406 -10.357 -6.109 1.00 1.08 O ATOM 1201 CB ASP A1965 10.836 -12.619 -6.019 1.00 1.46 C ATOM 1202 CG ASP A1965 10.428 -14.070 -6.003 1.00 2.18 C ATOM 1203 OD1 ASP A1965 11.276 -14.955 -6.230 1.00 2.64 O ATOM 1204 OD2 ASP A1965 9.241 -14.362 -5.750 1.00 2.74 O ATOM 0 H ASP A1965 11.123 -12.843 -2.843 1.00 1.04 H new ATOM 0 HA ASP A1965 12.420 -12.943 -4.634 1.00 1.25 H new ATOM 0 HB2 ASP A1965 9.943 -11.999 -6.094 1.00 1.46 H new ATOM 0 HB3 ASP A1965 11.433 -12.427 -6.911 1.00 1.46 H new ATOM 1209 N GLN A1966 12.678 -10.254 -3.865 1.00 1.03 N ATOM 1210 CA GLN A1966 13.291 -8.924 -3.769 1.00 1.04 C ATOM 1211 C GLN A1966 12.316 -7.763 -3.965 1.00 0.84 C ATOM 1212 O GLN A1966 12.643 -6.633 -3.643 1.00 1.05 O ATOM 1213 CB GLN A1966 14.603 -8.774 -4.567 1.00 1.33 C ATOM 1214 CG GLN A1966 15.734 -9.611 -3.978 1.00 1.71 C ATOM 1215 CD GLN A1966 17.098 -9.401 -4.627 1.00 2.12 C ATOM 1216 OE1 GLN A1966 18.123 -9.504 -3.949 1.00 2.66 O ATOM 1217 NE2 GLN A1966 17.144 -9.173 -5.911 1.00 2.40 N ATOM 0 H GLN A1966 12.583 -10.705 -2.955 1.00 1.03 H new ATOM 0 HA GLN A1966 13.593 -8.851 -2.724 1.00 1.04 H new ATOM 0 HB2 GLN A1966 14.433 -9.072 -5.602 1.00 1.33 H new ATOM 0 HB3 GLN A1966 14.899 -7.725 -4.582 1.00 1.33 H new ATOM 0 HG2 GLN A1966 15.816 -9.386 -2.915 1.00 1.71 H new ATOM 0 HG3 GLN A1966 15.467 -10.665 -4.061 1.00 1.71 H new ATOM 0 HE21 GLN A1966 16.279 -9.093 -6.446 1.00 2.40 H new ATOM 0 HE22 GLN A1966 18.045 -9.075 -6.380 1.00 2.40 H new ATOM 1226 N VAL A1967 11.120 -8.044 -4.451 1.00 0.60 N ATOM 1227 CA VAL A1967 10.085 -7.033 -4.526 1.00 0.49 C ATOM 1228 C VAL A1967 9.391 -7.029 -3.189 1.00 0.41 C ATOM 1229 O VAL A1967 9.061 -8.092 -2.655 1.00 0.41 O ATOM 1230 CB VAL A1967 9.039 -7.305 -5.660 1.00 0.52 C ATOM 1231 CG1 VAL A1967 7.916 -6.276 -5.652 1.00 1.01 C ATOM 1232 CG2 VAL A1967 9.705 -7.295 -7.006 1.00 1.06 C ATOM 0 H VAL A1967 10.844 -8.962 -4.798 1.00 0.60 H new ATOM 0 HA VAL A1967 10.543 -6.073 -4.764 1.00 0.49 H new ATOM 0 HB VAL A1967 8.609 -8.288 -5.468 1.00 0.52 H new ATOM 0 HG11 VAL A1967 7.212 -6.500 -6.453 1.00 1.01 H new ATOM 0 HG12 VAL A1967 7.398 -6.310 -4.694 1.00 1.01 H new ATOM 0 HG13 VAL A1967 8.334 -5.281 -5.803 1.00 1.01 H new ATOM 0 HG21 VAL A1967 8.962 -7.486 -7.781 1.00 1.06 H new ATOM 0 HG22 VAL A1967 10.166 -6.322 -7.177 1.00 1.06 H new ATOM 0 HG23 VAL A1967 10.471 -8.070 -7.039 1.00 1.06 H new ATOM 1242 N LEU A1968 9.180 -5.890 -2.649 1.00 0.41 N ATOM 1243 CA LEU A1968 8.595 -5.787 -1.358 1.00 0.38 C ATOM 1244 C LEU A1968 7.088 -5.904 -1.503 1.00 0.37 C ATOM 1245 O LEU A1968 6.495 -5.258 -2.352 1.00 0.49 O ATOM 1246 CB LEU A1968 8.995 -4.450 -0.746 1.00 0.42 C ATOM 1247 CG LEU A1968 8.642 -4.237 0.709 1.00 0.43 C ATOM 1248 CD1 LEU A1968 9.312 -5.298 1.564 1.00 0.47 C ATOM 1249 CD2 LEU A1968 9.088 -2.859 1.144 1.00 0.50 C ATOM 0 H LEU A1968 9.407 -4.997 -3.086 1.00 0.41 H new ATOM 0 HA LEU A1968 8.943 -6.583 -0.699 1.00 0.38 H new ATOM 0 HB2 LEU A1968 10.073 -4.335 -0.855 1.00 0.42 H new ATOM 0 HB3 LEU A1968 8.529 -3.656 -1.329 1.00 0.42 H new ATOM 0 HG LEU A1968 7.562 -4.317 0.833 1.00 0.43 H new ATOM 0 HD11 LEU A1968 9.053 -5.138 2.611 1.00 0.47 H new ATOM 0 HD12 LEU A1968 8.971 -6.285 1.252 1.00 0.47 H new ATOM 0 HD13 LEU A1968 10.393 -5.233 1.443 1.00 0.47 H new ATOM 0 HD21 LEU A1968 8.832 -2.708 2.193 1.00 0.50 H new ATOM 0 HD22 LEU A1968 10.167 -2.769 1.017 1.00 0.50 H new ATOM 0 HD23 LEU A1968 8.587 -2.106 0.536 1.00 0.50 H new ATOM 1261 N LYS A1969 6.485 -6.763 -0.740 1.00 0.33 N ATOM 1262 CA LYS A1969 5.056 -6.955 -0.824 1.00 0.36 C ATOM 1263 C LYS A1969 4.394 -6.623 0.494 1.00 0.34 C ATOM 1264 O LYS A1969 4.966 -6.852 1.587 1.00 0.36 O ATOM 1265 CB LYS A1969 4.667 -8.400 -1.206 1.00 0.47 C ATOM 1266 CG LYS A1969 5.194 -8.946 -2.533 1.00 0.73 C ATOM 1267 CD LYS A1969 4.881 -8.052 -3.723 1.00 1.19 C ATOM 1268 CE LYS A1969 5.054 -8.790 -5.063 1.00 1.19 C ATOM 1269 NZ LYS A1969 6.270 -9.649 -5.111 1.00 1.29 N ATOM 0 H LYS A1969 6.955 -7.347 -0.048 1.00 0.33 H new ATOM 0 HA LYS A1969 4.711 -6.283 -1.610 1.00 0.36 H new ATOM 0 HB2 LYS A1969 5.009 -9.062 -0.410 1.00 0.47 H new ATOM 0 HB3 LYS A1969 3.579 -8.461 -1.226 1.00 0.47 H new ATOM 0 HG2 LYS A1969 6.274 -9.076 -2.460 1.00 0.73 H new ATOM 0 HG3 LYS A1969 4.765 -9.933 -2.707 1.00 0.73 H new ATOM 0 HD2 LYS A1969 3.858 -7.685 -3.641 1.00 1.19 H new ATOM 0 HD3 LYS A1969 5.535 -7.180 -3.703 1.00 1.19 H new ATOM 0 HE2 LYS A1969 4.174 -9.407 -5.246 1.00 1.19 H new ATOM 0 HE3 LYS A1969 5.103 -8.058 -5.869 1.00 1.19 H new ATOM 0 HZ1 LYS A1969 6.638 -9.676 -6.083 1.00 1.29 H new ATOM 0 HZ2 LYS A1969 6.996 -9.258 -4.477 1.00 1.29 H new ATOM 0 HZ3 LYS A1969 6.026 -10.613 -4.806 1.00 1.29 H new ATOM 1283 N LEU A1970 3.221 -6.079 0.398 1.00 0.42 N ATOM 1284 CA LEU A1970 2.409 -5.804 1.533 1.00 0.49 C ATOM 1285 C LEU A1970 0.967 -6.000 1.076 1.00 0.46 C ATOM 1286 O LEU A1970 0.527 -5.386 0.113 1.00 0.57 O ATOM 1287 CB LEU A1970 2.664 -4.353 2.030 1.00 0.60 C ATOM 1288 CG LEU A1970 2.265 -4.008 3.489 1.00 0.91 C ATOM 1289 CD1 LEU A1970 2.708 -2.601 3.838 1.00 1.11 C ATOM 1290 CD2 LEU A1970 0.775 -4.151 3.730 1.00 1.75 C ATOM 0 H LEU A1970 2.797 -5.810 -0.490 1.00 0.42 H new ATOM 0 HA LEU A1970 2.636 -6.463 2.371 1.00 0.49 H new ATOM 0 HB2 LEU A1970 3.727 -4.141 1.914 1.00 0.60 H new ATOM 0 HB3 LEU A1970 2.130 -3.673 1.367 1.00 0.60 H new ATOM 0 HG LEU A1970 2.773 -4.724 4.135 1.00 0.91 H new ATOM 0 HD11 LEU A1970 2.421 -2.373 4.865 1.00 1.11 H new ATOM 0 HD12 LEU A1970 3.791 -2.525 3.739 1.00 1.11 H new ATOM 0 HD13 LEU A1970 2.231 -1.891 3.162 1.00 1.11 H new ATOM 0 HD21 LEU A1970 0.548 -3.898 4.766 1.00 1.75 H new ATOM 0 HD22 LEU A1970 0.233 -3.479 3.065 1.00 1.75 H new ATOM 0 HD23 LEU A1970 0.472 -5.179 3.533 1.00 1.75 H new ATOM 1302 N VAL A1971 0.274 -6.899 1.705 1.00 0.46 N ATOM 1303 CA VAL A1971 -1.109 -7.151 1.384 1.00 0.48 C ATOM 1304 C VAL A1971 -1.992 -6.543 2.457 1.00 0.45 C ATOM 1305 O VAL A1971 -1.901 -6.893 3.640 1.00 0.60 O ATOM 1306 CB VAL A1971 -1.403 -8.677 1.184 1.00 0.64 C ATOM 1307 CG1 VAL A1971 -0.739 -9.162 -0.089 1.00 0.73 C ATOM 1308 CG2 VAL A1971 -0.901 -9.513 2.353 1.00 0.74 C ATOM 0 H VAL A1971 0.645 -7.482 2.456 1.00 0.46 H new ATOM 0 HA VAL A1971 -1.334 -6.677 0.429 1.00 0.48 H new ATOM 0 HB VAL A1971 -2.485 -8.796 1.121 1.00 0.64 H new ATOM 0 HG11 VAL A1971 -0.945 -10.224 -0.225 1.00 0.73 H new ATOM 0 HG12 VAL A1971 -1.131 -8.604 -0.939 1.00 0.73 H new ATOM 0 HG13 VAL A1971 0.338 -9.008 -0.019 1.00 0.73 H new ATOM 0 HG21 VAL A1971 -1.126 -10.564 2.172 1.00 0.74 H new ATOM 0 HG22 VAL A1971 0.177 -9.385 2.456 1.00 0.74 H new ATOM 0 HG23 VAL A1971 -1.394 -9.189 3.270 1.00 0.74 H new ATOM 1318 N TYR A1972 -2.771 -5.577 2.059 1.00 0.38 N ATOM 1319 CA TYR A1972 -3.681 -4.902 2.955 1.00 0.39 C ATOM 1320 C TYR A1972 -4.920 -5.721 3.050 1.00 0.45 C ATOM 1321 O TYR A1972 -5.758 -5.710 2.154 1.00 0.55 O ATOM 1322 CB TYR A1972 -3.980 -3.477 2.481 1.00 0.43 C ATOM 1323 CG TYR A1972 -2.767 -2.623 2.403 1.00 0.56 C ATOM 1324 CD1 TYR A1972 -1.989 -2.596 1.255 1.00 0.79 C ATOM 1325 CD2 TYR A1972 -2.389 -1.848 3.469 1.00 0.75 C ATOM 1326 CE1 TYR A1972 -0.866 -1.823 1.187 1.00 0.98 C ATOM 1327 CE2 TYR A1972 -1.274 -1.069 3.404 1.00 0.97 C ATOM 1328 CZ TYR A1972 -0.515 -1.062 2.262 1.00 1.04 C ATOM 1329 OH TYR A1972 0.599 -0.297 2.208 1.00 1.27 O ATOM 0 H TYR A1972 -2.796 -5.230 1.100 1.00 0.38 H new ATOM 0 HA TYR A1972 -3.228 -4.803 3.941 1.00 0.39 H new ATOM 0 HB2 TYR A1972 -4.452 -3.518 1.499 1.00 0.43 H new ATOM 0 HB3 TYR A1972 -4.698 -3.017 3.160 1.00 0.43 H new ATOM 0 HD1 TYR A1972 -2.276 -3.195 0.403 1.00 0.79 H new ATOM 0 HD2 TYR A1972 -2.983 -1.855 4.371 1.00 0.75 H new ATOM 0 HE1 TYR A1972 -0.262 -1.814 0.291 1.00 0.98 H new ATOM 0 HE2 TYR A1972 -0.989 -0.459 4.248 1.00 0.97 H new ATOM 0 HH TYR A1972 0.598 0.224 1.378 1.00 1.27 H new ATOM 1339 N GLU A1973 -5.014 -6.457 4.100 1.00 0.57 N ATOM 1340 CA GLU A1973 -6.035 -7.441 4.231 1.00 0.73 C ATOM 1341 C GLU A1973 -7.022 -7.141 5.334 1.00 0.58 C ATOM 1342 O GLU A1973 -7.020 -6.042 5.905 1.00 0.57 O ATOM 1343 CB GLU A1973 -5.387 -8.796 4.404 1.00 1.09 C ATOM 1344 CG GLU A1973 -4.340 -8.867 5.486 1.00 1.33 C ATOM 1345 CD GLU A1973 -3.732 -10.229 5.556 1.00 1.89 C ATOM 1346 OE1 GLU A1973 -2.860 -10.553 4.717 1.00 2.75 O ATOM 1347 OE2 GLU A1973 -4.081 -10.998 6.469 1.00 2.17 O ATOM 0 H GLU A1973 -4.382 -6.395 4.898 1.00 0.57 H new ATOM 0 HA GLU A1973 -6.631 -7.433 3.319 1.00 0.73 H new ATOM 0 HB2 GLU A1973 -6.164 -9.529 4.622 1.00 1.09 H new ATOM 0 HB3 GLU A1973 -4.931 -9.088 3.458 1.00 1.09 H new ATOM 0 HG2 GLU A1973 -3.563 -8.128 5.293 1.00 1.33 H new ATOM 0 HG3 GLU A1973 -4.788 -8.615 6.447 1.00 1.33 H new ATOM 1354 N ASP A1974 -7.891 -8.135 5.598 1.00 0.73 N ATOM 1355 CA ASP A1974 -8.978 -8.062 6.590 1.00 0.79 C ATOM 1356 C ASP A1974 -9.964 -6.980 6.159 1.00 0.83 C ATOM 1357 O ASP A1974 -10.616 -6.334 6.970 1.00 1.13 O ATOM 1358 CB ASP A1974 -8.426 -7.798 8.016 1.00 1.03 C ATOM 1359 CG ASP A1974 -9.433 -8.081 9.128 1.00 1.29 C ATOM 1360 OD1 ASP A1974 -9.595 -9.243 9.561 1.00 1.56 O ATOM 1361 OD2 ASP A1974 -10.101 -7.134 9.573 1.00 1.57 O ATOM 0 H ASP A1974 -7.855 -9.033 5.115 1.00 0.73 H new ATOM 0 HA ASP A1974 -9.495 -9.021 6.632 1.00 0.79 H new ATOM 0 HB2 ASP A1974 -7.542 -8.416 8.173 1.00 1.03 H new ATOM 0 HB3 ASP A1974 -8.105 -6.759 8.085 1.00 1.03 H new ATOM 1366 N GLY A1975 -10.086 -6.814 4.847 1.00 1.18 N ATOM 1367 CA GLY A1975 -10.983 -5.823 4.297 1.00 1.43 C ATOM 1368 C GLY A1975 -12.438 -6.096 4.648 1.00 1.27 C ATOM 1369 O GLY A1975 -12.795 -7.219 5.043 1.00 1.57 O ATOM 0 H GLY A1975 -9.573 -7.355 4.151 1.00 1.18 H new ATOM 0 HA2 GLY A1975 -10.702 -4.837 4.668 1.00 1.43 H new ATOM 0 HA3 GLY A1975 -10.872 -5.799 3.213 1.00 1.43 H new ATOM 1373 N ASP A1976 -13.266 -5.095 4.489 1.00 0.96 N ATOM 1374 CA ASP A1976 -14.683 -5.177 4.822 1.00 0.90 C ATOM 1375 C ASP A1976 -15.370 -6.125 3.843 1.00 0.95 C ATOM 1376 O ASP A1976 -15.257 -5.938 2.622 1.00 1.08 O ATOM 1377 CB ASP A1976 -15.307 -3.776 4.758 1.00 0.95 C ATOM 1378 CG ASP A1976 -16.755 -3.727 5.186 1.00 1.57 C ATOM 1379 OD1 ASP A1976 -17.032 -3.501 6.382 1.00 2.24 O ATOM 1380 OD2 ASP A1976 -17.647 -3.861 4.337 1.00 2.08 O ATOM 0 H ASP A1976 -12.982 -4.187 4.122 1.00 0.96 H new ATOM 0 HA ASP A1976 -14.811 -5.563 5.833 1.00 0.90 H new ATOM 0 HB2 ASP A1976 -14.729 -3.103 5.391 1.00 0.95 H new ATOM 0 HB3 ASP A1976 -15.228 -3.401 3.738 1.00 0.95 H new ATOM 1385 N PRO A1977 -16.010 -7.191 4.359 1.00 1.16 N ATOM 1386 CA PRO A1977 -16.669 -8.219 3.538 1.00 1.39 C ATOM 1387 C PRO A1977 -17.705 -7.654 2.569 1.00 1.45 C ATOM 1388 O PRO A1977 -18.730 -7.080 2.978 1.00 1.66 O ATOM 1389 CB PRO A1977 -17.343 -9.130 4.570 1.00 1.68 C ATOM 1390 CG PRO A1977 -16.549 -8.936 5.806 1.00 1.68 C ATOM 1391 CD PRO A1977 -16.130 -7.496 5.797 1.00 1.41 C ATOM 0 HA PRO A1977 -15.949 -8.728 2.897 1.00 1.39 H new ATOM 0 HB2 PRO A1977 -18.387 -8.855 4.721 1.00 1.68 H new ATOM 0 HB3 PRO A1977 -17.331 -10.172 4.249 1.00 1.68 H new ATOM 0 HG2 PRO A1977 -17.141 -9.166 6.692 1.00 1.68 H new ATOM 0 HG3 PRO A1977 -15.682 -9.596 5.822 1.00 1.68 H new ATOM 0 HD2 PRO A1977 -16.868 -6.859 6.284 1.00 1.41 H new ATOM 0 HD3 PRO A1977 -15.186 -7.348 6.321 1.00 1.41 H new ATOM 1399 N CYS A1978 -17.431 -7.820 1.305 1.00 1.46 N ATOM 1400 CA CYS A1978 -18.302 -7.371 0.243 1.00 1.62 C ATOM 1401 C CYS A1978 -19.293 -8.487 -0.027 1.00 1.87 C ATOM 1402 O CYS A1978 -19.030 -9.607 0.356 1.00 1.90 O ATOM 1403 CB CYS A1978 -17.482 -7.145 -1.022 1.00 1.58 C ATOM 1404 SG CYS A1978 -16.070 -6.021 -0.854 1.00 1.81 S ATOM 0 H CYS A1978 -16.582 -8.279 0.973 1.00 1.46 H new ATOM 0 HA CYS A1978 -18.804 -6.445 0.524 1.00 1.62 H new ATOM 0 HB2 CYS A1978 -17.115 -8.110 -1.372 1.00 1.58 H new ATOM 0 HB3 CYS A1978 -18.143 -6.755 -1.796 1.00 1.58 H new ATOM 1409 N PRO A1979 -20.434 -8.230 -0.693 1.00 2.20 N ATOM 1410 CA PRO A1979 -21.408 -9.290 -1.021 1.00 2.55 C ATOM 1411 C PRO A1979 -20.777 -10.442 -1.834 1.00 2.56 C ATOM 1412 O PRO A1979 -21.244 -11.574 -1.793 1.00 2.76 O ATOM 1413 CB PRO A1979 -22.477 -8.564 -1.859 1.00 2.93 C ATOM 1414 CG PRO A1979 -21.867 -7.254 -2.239 1.00 2.90 C ATOM 1415 CD PRO A1979 -20.903 -6.908 -1.144 1.00 2.38 C ATOM 0 HA PRO A1979 -21.805 -9.760 -0.121 1.00 2.55 H new ATOM 0 HB2 PRO A1979 -22.743 -9.144 -2.743 1.00 2.93 H new ATOM 0 HB3 PRO A1979 -23.393 -8.419 -1.286 1.00 2.93 H new ATOM 0 HG2 PRO A1979 -21.356 -7.327 -3.199 1.00 2.90 H new ATOM 0 HG3 PRO A1979 -22.632 -6.484 -2.342 1.00 2.90 H new ATOM 0 HD2 PRO A1979 -20.082 -6.290 -1.508 1.00 2.38 H new ATOM 0 HD3 PRO A1979 -21.387 -6.354 -0.339 1.00 2.38 H new ATOM 1423 N THR A1980 -19.721 -10.136 -2.555 1.00 2.44 N ATOM 1424 CA THR A1980 -19.010 -11.050 -3.352 1.00 2.58 C ATOM 1425 C THR A1980 -17.776 -11.651 -2.614 1.00 2.52 C ATOM 1426 O THR A1980 -17.126 -12.574 -3.121 1.00 2.86 O ATOM 1427 CB THR A1980 -18.551 -10.246 -4.552 1.00 2.52 C ATOM 1428 OG1 THR A1980 -18.289 -8.876 -4.123 1.00 2.72 O ATOM 1429 CG2 THR A1980 -19.577 -10.261 -5.669 1.00 2.83 C ATOM 0 H THR A1980 -19.335 -9.193 -2.588 1.00 2.44 H new ATOM 0 HA THR A1980 -19.639 -11.899 -3.618 1.00 2.58 H new ATOM 0 HB THR A1980 -17.642 -10.699 -4.949 1.00 2.52 H new ATOM 0 HG1 THR A1980 -17.761 -8.414 -4.807 1.00 2.72 H new ATOM 0 HG21 THR A1980 -19.208 -9.673 -6.510 1.00 2.83 H new ATOM 0 HG22 THR A1980 -19.748 -11.288 -5.992 1.00 2.83 H new ATOM 0 HG23 THR A1980 -20.513 -9.833 -5.309 1.00 2.83 H new ATOM 1437 N ASP A1981 -17.497 -11.159 -1.416 1.00 2.25 N ATOM 1438 CA ASP A1981 -16.297 -11.544 -0.661 1.00 2.32 C ATOM 1439 C ASP A1981 -16.607 -11.425 0.823 1.00 2.24 C ATOM 1440 O ASP A1981 -16.228 -10.468 1.495 1.00 2.36 O ATOM 1441 CB ASP A1981 -15.126 -10.637 -1.083 1.00 2.46 C ATOM 1442 CG ASP A1981 -13.752 -11.010 -0.536 1.00 2.87 C ATOM 1443 OD1 ASP A1981 -13.064 -11.850 -1.132 1.00 3.37 O ATOM 1444 OD2 ASP A1981 -13.388 -10.521 0.558 1.00 3.20 O ATOM 0 H ASP A1981 -18.090 -10.483 -0.934 1.00 2.25 H new ATOM 0 HA ASP A1981 -16.008 -12.574 -0.869 1.00 2.32 H new ATOM 0 HB2 ASP A1981 -15.071 -10.633 -2.172 1.00 2.46 H new ATOM 0 HB3 ASP A1981 -15.353 -9.618 -0.771 1.00 2.46 H new ATOM 1449 N LEU A1982 -17.473 -12.314 1.250 1.00 2.24 N ATOM 1450 CA LEU A1982 -17.966 -12.389 2.617 1.00 2.35 C ATOM 1451 C LEU A1982 -17.197 -13.415 3.395 1.00 2.41 C ATOM 1452 O LEU A1982 -16.652 -13.154 4.459 1.00 2.56 O ATOM 1453 CB LEU A1982 -19.410 -12.848 2.591 1.00 2.55 C ATOM 1454 CG LEU A1982 -20.392 -11.971 1.870 1.00 2.64 C ATOM 1455 CD1 LEU A1982 -21.618 -12.779 1.565 1.00 2.83 C ATOM 1456 CD2 LEU A1982 -20.749 -10.786 2.735 1.00 2.91 C ATOM 0 H LEU A1982 -17.870 -13.030 0.641 1.00 2.24 H new ATOM 0 HA LEU A1982 -17.860 -11.407 3.077 1.00 2.35 H new ATOM 0 HB2 LEU A1982 -19.442 -13.838 2.136 1.00 2.55 H new ATOM 0 HB3 LEU A1982 -19.748 -12.960 3.621 1.00 2.55 H new ATOM 0 HG LEU A1982 -19.955 -11.602 0.942 1.00 2.64 H new ATOM 0 HD11 LEU A1982 -22.343 -12.156 1.041 1.00 2.83 H new ATOM 0 HD12 LEU A1982 -21.347 -13.628 0.937 1.00 2.83 H new ATOM 0 HD13 LEU A1982 -22.056 -13.141 2.495 1.00 2.83 H new ATOM 0 HD21 LEU A1982 -21.462 -10.152 2.208 1.00 2.91 H new ATOM 0 HD22 LEU A1982 -21.194 -11.136 3.666 1.00 2.91 H new ATOM 0 HD23 LEU A1982 -19.849 -10.213 2.957 1.00 2.91 H new ATOM 1468 N LYS A1983 -17.152 -14.595 2.814 1.00 2.40 N ATOM 1469 CA LYS A1983 -16.627 -15.806 3.449 1.00 2.57 C ATOM 1470 C LYS A1983 -15.225 -16.068 2.967 1.00 2.46 C ATOM 1471 O LYS A1983 -14.708 -17.189 3.006 1.00 2.62 O ATOM 1472 CB LYS A1983 -17.551 -16.978 3.121 1.00 2.75 C ATOM 1473 CG LYS A1983 -18.940 -16.860 3.713 1.00 2.91 C ATOM 1474 CD LYS A1983 -18.905 -16.815 5.235 1.00 3.23 C ATOM 1475 CE LYS A1983 -20.302 -16.684 5.819 1.00 3.77 C ATOM 1476 NZ LYS A1983 -20.977 -15.441 5.379 1.00 4.43 N ATOM 0 H LYS A1983 -17.486 -14.753 1.863 1.00 2.40 H new ATOM 0 HA LYS A1983 -16.591 -15.678 4.531 1.00 2.57 H new ATOM 0 HB2 LYS A1983 -17.636 -17.066 2.038 1.00 2.75 H new ATOM 0 HB3 LYS A1983 -17.092 -17.899 3.481 1.00 2.75 H new ATOM 0 HG2 LYS A1983 -19.421 -15.958 3.334 1.00 2.91 H new ATOM 0 HG3 LYS A1983 -19.546 -17.706 3.388 1.00 2.91 H new ATOM 0 HD2 LYS A1983 -18.433 -17.721 5.616 1.00 3.23 H new ATOM 0 HD3 LYS A1983 -18.292 -15.975 5.562 1.00 3.23 H new ATOM 0 HE2 LYS A1983 -20.900 -17.545 5.522 1.00 3.77 H new ATOM 0 HE3 LYS A1983 -20.242 -16.697 6.907 1.00 3.77 H new ATOM 0 HZ1 LYS A1983 -21.814 -15.271 5.973 1.00 4.43 H new ATOM 0 HZ2 LYS A1983 -20.321 -14.639 5.468 1.00 4.43 H new ATOM 0 HZ3 LYS A1983 -21.271 -15.539 4.386 1.00 4.43 H new ATOM 1490 N MET A1984 -14.639 -15.015 2.564 1.00 2.32 N ATOM 1491 CA MET A1984 -13.352 -14.904 2.060 1.00 2.29 C ATOM 1492 C MET A1984 -13.056 -13.470 2.331 1.00 2.18 C ATOM 1493 O MET A1984 -13.977 -12.666 2.315 1.00 2.40 O ATOM 1494 CB MET A1984 -13.328 -15.270 0.552 1.00 2.28 C ATOM 1495 CG MET A1984 -14.354 -14.532 -0.313 1.00 2.33 C ATOM 1496 SD MET A1984 -14.438 -15.168 -2.012 1.00 2.53 S ATOM 1497 CE MET A1984 -12.765 -14.856 -2.571 1.00 2.68 C ATOM 0 H MET A1984 -15.112 -14.112 2.586 1.00 2.32 H new ATOM 0 HA MET A1984 -12.613 -15.573 2.501 1.00 2.29 H new ATOM 0 HB2 MET A1984 -12.332 -15.065 0.160 1.00 2.28 H new ATOM 0 HB3 MET A1984 -13.496 -16.342 0.452 1.00 2.28 H new ATOM 0 HG2 MET A1984 -15.338 -14.615 0.149 1.00 2.33 H new ATOM 0 HG3 MET A1984 -14.103 -13.472 -0.340 1.00 2.33 H new ATOM 0 HE1 MET A1984 -12.787 -14.485 -3.596 1.00 2.68 H new ATOM 0 HE2 MET A1984 -12.299 -14.112 -1.926 1.00 2.68 H new ATOM 0 HE3 MET A1984 -12.190 -15.781 -2.532 1.00 2.68 H new ATOM 1507 N LYS A1985 -11.875 -13.170 2.707 1.00 2.14 N ATOM 1508 CA LYS A1985 -11.554 -11.824 3.113 1.00 2.09 C ATOM 1509 C LYS A1985 -10.406 -11.264 2.322 1.00 1.89 C ATOM 1510 O LYS A1985 -9.246 -11.582 2.565 1.00 2.34 O ATOM 1511 CB LYS A1985 -11.307 -11.754 4.628 1.00 2.67 C ATOM 1512 CG LYS A1985 -12.563 -12.051 5.456 1.00 3.08 C ATOM 1513 CD LYS A1985 -12.266 -12.186 6.941 1.00 3.73 C ATOM 1514 CE LYS A1985 -11.692 -10.919 7.542 1.00 4.42 C ATOM 1515 NZ LYS A1985 -11.333 -11.120 8.957 1.00 4.89 N ATOM 0 H LYS A1985 -11.097 -13.829 2.749 1.00 2.14 H new ATOM 0 HA LYS A1985 -12.415 -11.192 2.895 1.00 2.09 H new ATOM 0 HB2 LYS A1985 -10.526 -12.465 4.896 1.00 2.67 H new ATOM 0 HB3 LYS A1985 -10.936 -10.762 4.884 1.00 2.67 H new ATOM 0 HG2 LYS A1985 -13.290 -11.253 5.306 1.00 3.08 H new ATOM 0 HG3 LYS A1985 -13.022 -12.972 5.096 1.00 3.08 H new ATOM 0 HD2 LYS A1985 -13.183 -12.450 7.468 1.00 3.73 H new ATOM 0 HD3 LYS A1985 -11.564 -13.006 7.094 1.00 3.73 H new ATOM 0 HE2 LYS A1985 -10.810 -10.613 6.980 1.00 4.42 H new ATOM 0 HE3 LYS A1985 -12.419 -10.111 7.459 1.00 4.42 H new ATOM 0 HZ1 LYS A1985 -10.896 -10.254 9.331 1.00 4.89 H new ATOM 0 HZ2 LYS A1985 -12.189 -11.340 9.505 1.00 4.89 H new ATOM 0 HZ3 LYS A1985 -10.660 -11.909 9.036 1.00 4.89 H new ATOM 1529 N HIS A1986 -10.769 -10.492 1.343 1.00 1.63 N ATOM 1530 CA HIS A1986 -9.872 -9.796 0.422 1.00 1.68 C ATOM 1531 C HIS A1986 -8.670 -9.094 1.055 1.00 1.14 C ATOM 1532 O HIS A1986 -8.772 -8.436 2.114 1.00 1.35 O ATOM 1533 CB HIS A1986 -10.651 -8.796 -0.447 1.00 2.46 C ATOM 1534 CG HIS A1986 -11.437 -7.725 0.292 1.00 3.48 C ATOM 1535 ND1 HIS A1986 -11.234 -6.380 0.101 1.00 4.38 N ATOM 1536 CD2 HIS A1986 -12.485 -7.811 1.147 1.00 4.21 C ATOM 1537 CE1 HIS A1986 -12.117 -5.700 0.799 1.00 5.37 C ATOM 1538 NE2 HIS A1986 -12.884 -6.539 1.437 1.00 5.32 N ATOM 0 H HIS A1986 -11.752 -10.310 1.140 1.00 1.63 H new ATOM 0 HA HIS A1986 -9.449 -10.598 -0.183 1.00 1.68 H new ATOM 0 HB2 HIS A1986 -9.945 -8.302 -1.115 1.00 2.46 H new ATOM 0 HB3 HIS A1986 -11.344 -9.356 -1.074 1.00 2.46 H new ATOM 0 HD2 HIS A1986 -12.924 -8.721 1.529 1.00 4.21 H new ATOM 0 HE1 HIS A1986 -12.194 -4.623 0.837 1.00 5.37 H new ATOM 0 HE2 HIS A1986 -13.657 -6.286 2.053 1.00 5.32 H new ATOM 1547 N LYS A1987 -7.550 -9.237 0.375 1.00 1.12 N ATOM 1548 CA LYS A1987 -6.331 -8.579 0.686 1.00 1.18 C ATOM 1549 C LYS A1987 -5.912 -7.811 -0.561 1.00 1.02 C ATOM 1550 O LYS A1987 -5.964 -8.344 -1.664 1.00 1.30 O ATOM 1551 CB LYS A1987 -5.225 -9.597 1.099 1.00 1.91 C ATOM 1552 CG LYS A1987 -4.921 -10.685 0.061 1.00 2.70 C ATOM 1553 CD LYS A1987 -3.706 -11.563 0.423 1.00 3.34 C ATOM 1554 CE LYS A1987 -3.955 -12.615 1.527 1.00 3.96 C ATOM 1555 NZ LYS A1987 -4.211 -12.051 2.868 1.00 4.45 N ATOM 0 H LYS A1987 -7.479 -9.844 -0.441 1.00 1.12 H new ATOM 0 HA LYS A1987 -6.469 -7.908 1.533 1.00 1.18 H new ATOM 0 HB2 LYS A1987 -4.307 -9.048 1.306 1.00 1.91 H new ATOM 0 HB3 LYS A1987 -5.525 -10.078 2.030 1.00 1.91 H new ATOM 0 HG2 LYS A1987 -5.798 -11.322 -0.052 1.00 2.70 H new ATOM 0 HG3 LYS A1987 -4.743 -10.213 -0.905 1.00 2.70 H new ATOM 0 HD2 LYS A1987 -3.370 -12.078 -0.477 1.00 3.34 H new ATOM 0 HD3 LYS A1987 -2.891 -10.913 0.741 1.00 3.34 H new ATOM 0 HE2 LYS A1987 -4.806 -13.231 1.238 1.00 3.96 H new ATOM 0 HE3 LYS A1987 -3.089 -13.274 1.584 1.00 3.96 H new ATOM 0 HZ1 LYS A1987 -3.984 -12.762 3.593 1.00 4.45 H new ATOM 0 HZ2 LYS A1987 -3.616 -11.210 3.010 1.00 4.45 H new ATOM 0 HZ3 LYS A1987 -5.213 -11.784 2.947 1.00 4.45 H new ATOM 1569 N SER A1988 -5.557 -6.585 -0.402 1.00 0.68 N ATOM 1570 CA SER A1988 -5.126 -5.789 -1.513 1.00 0.60 C ATOM 1571 C SER A1988 -3.612 -5.871 -1.629 1.00 0.50 C ATOM 1572 O SER A1988 -2.884 -5.558 -0.684 1.00 0.57 O ATOM 1573 CB SER A1988 -5.608 -4.351 -1.339 1.00 0.64 C ATOM 1574 OG SER A1988 -7.034 -4.314 -1.260 1.00 1.41 O ATOM 0 H SER A1988 -5.554 -6.100 0.495 1.00 0.68 H new ATOM 0 HA SER A1988 -5.558 -6.168 -2.439 1.00 0.60 H new ATOM 0 HB2 SER A1988 -5.175 -3.922 -0.435 1.00 0.64 H new ATOM 0 HB3 SER A1988 -5.267 -3.742 -2.176 1.00 0.64 H new ATOM 0 HG SER A1988 -7.308 -4.265 -0.320 1.00 1.41 H new ATOM 1580 N TYR A1989 -3.158 -6.322 -2.766 1.00 0.51 N ATOM 1581 CA TYR A1989 -1.751 -6.553 -3.017 1.00 0.49 C ATOM 1582 C TYR A1989 -1.059 -5.279 -3.394 1.00 0.41 C ATOM 1583 O TYR A1989 -1.419 -4.639 -4.386 1.00 0.42 O ATOM 1584 CB TYR A1989 -1.568 -7.545 -4.159 1.00 0.63 C ATOM 1585 CG TYR A1989 -2.011 -8.957 -3.877 1.00 0.75 C ATOM 1586 CD1 TYR A1989 -3.350 -9.317 -3.929 1.00 1.18 C ATOM 1587 CD2 TYR A1989 -1.083 -9.932 -3.563 1.00 1.69 C ATOM 1588 CE1 TYR A1989 -3.744 -10.609 -3.673 1.00 1.40 C ATOM 1589 CE2 TYR A1989 -1.469 -11.222 -3.307 1.00 2.13 C ATOM 1590 CZ TYR A1989 -2.798 -11.557 -3.361 1.00 1.66 C ATOM 1591 OH TYR A1989 -3.183 -12.849 -3.097 1.00 2.20 O ATOM 0 H TYR A1989 -3.759 -6.544 -3.560 1.00 0.51 H new ATOM 0 HA TYR A1989 -1.319 -6.951 -2.099 1.00 0.49 H new ATOM 0 HB2 TYR A1989 -2.118 -7.178 -5.026 1.00 0.63 H new ATOM 0 HB3 TYR A1989 -0.513 -7.563 -4.434 1.00 0.63 H new ATOM 0 HD1 TYR A1989 -4.093 -8.572 -4.174 1.00 1.18 H new ATOM 0 HD2 TYR A1989 -0.035 -9.673 -3.519 1.00 1.69 H new ATOM 0 HE1 TYR A1989 -4.789 -10.878 -3.717 1.00 1.40 H new ATOM 0 HE2 TYR A1989 -0.730 -11.971 -3.064 1.00 2.13 H new ATOM 0 HH TYR A1989 -2.392 -13.391 -2.896 1.00 2.20 H new ATOM 1601 N PHE A1990 -0.099 -4.895 -2.617 1.00 0.40 N ATOM 1602 CA PHE A1990 0.683 -3.768 -2.950 1.00 0.40 C ATOM 1603 C PHE A1990 2.112 -4.245 -3.156 1.00 0.40 C ATOM 1604 O PHE A1990 2.731 -4.821 -2.245 1.00 0.51 O ATOM 1605 CB PHE A1990 0.621 -2.718 -1.849 1.00 0.49 C ATOM 1606 CG PHE A1990 0.745 -1.314 -2.359 1.00 0.84 C ATOM 1607 CD1 PHE A1990 1.757 -0.956 -3.223 1.00 1.31 C ATOM 1608 CD2 PHE A1990 -0.182 -0.359 -1.996 1.00 1.45 C ATOM 1609 CE1 PHE A1990 1.844 0.321 -3.706 1.00 2.02 C ATOM 1610 CE2 PHE A1990 -0.096 0.923 -2.484 1.00 2.10 C ATOM 1611 CZ PHE A1990 0.920 1.264 -3.340 1.00 2.31 C ATOM 0 H PHE A1990 0.157 -5.354 -1.743 1.00 0.40 H new ATOM 0 HA PHE A1990 0.302 -3.302 -3.859 1.00 0.40 H new ATOM 0 HB2 PHE A1990 -0.322 -2.820 -1.312 1.00 0.49 H new ATOM 0 HB3 PHE A1990 1.419 -2.908 -1.131 1.00 0.49 H new ATOM 0 HD1 PHE A1990 2.489 -1.691 -3.522 1.00 1.31 H new ATOM 0 HD2 PHE A1990 -0.984 -0.621 -1.321 1.00 1.45 H new ATOM 0 HE1 PHE A1990 2.645 0.587 -4.379 1.00 2.02 H new ATOM 0 HE2 PHE A1990 -0.828 1.662 -2.193 1.00 2.10 H new ATOM 0 HZ PHE A1990 0.991 2.271 -3.724 1.00 2.31 H new ATOM 1621 N SER A1991 2.597 -4.077 -4.345 1.00 0.35 N ATOM 1622 CA SER A1991 3.928 -4.444 -4.689 1.00 0.36 C ATOM 1623 C SER A1991 4.835 -3.222 -4.746 1.00 0.40 C ATOM 1624 O SER A1991 4.569 -2.264 -5.461 1.00 0.55 O ATOM 1625 CB SER A1991 3.918 -5.223 -6.004 1.00 0.36 C ATOM 1626 OG SER A1991 2.930 -4.714 -6.895 1.00 1.09 O ATOM 0 H SER A1991 2.066 -3.673 -5.117 1.00 0.35 H new ATOM 0 HA SER A1991 4.337 -5.094 -3.915 1.00 0.36 H new ATOM 0 HB2 SER A1991 4.900 -5.163 -6.473 1.00 0.36 H new ATOM 0 HB3 SER A1991 3.724 -6.277 -5.804 1.00 0.36 H new ATOM 0 HG SER A1991 2.834 -5.321 -7.658 1.00 1.09 H new ATOM 1632 N PHE A1992 5.859 -3.245 -3.961 1.00 0.36 N ATOM 1633 CA PHE A1992 6.815 -2.187 -3.911 1.00 0.37 C ATOM 1634 C PHE A1992 8.081 -2.637 -4.611 1.00 0.39 C ATOM 1635 O PHE A1992 8.787 -3.527 -4.137 1.00 0.40 O ATOM 1636 CB PHE A1992 7.111 -1.792 -2.459 1.00 0.40 C ATOM 1637 CG PHE A1992 5.908 -1.319 -1.700 1.00 0.48 C ATOM 1638 CD1 PHE A1992 5.483 -0.003 -1.784 1.00 0.56 C ATOM 1639 CD2 PHE A1992 5.201 -2.193 -0.906 1.00 0.58 C ATOM 1640 CE1 PHE A1992 4.373 0.426 -1.087 1.00 0.68 C ATOM 1641 CE2 PHE A1992 4.092 -1.778 -0.205 1.00 0.71 C ATOM 1642 CZ PHE A1992 3.691 -0.422 -0.294 1.00 0.74 C ATOM 0 H PHE A1992 6.060 -4.015 -3.323 1.00 0.36 H new ATOM 0 HA PHE A1992 6.412 -1.309 -4.416 1.00 0.37 H new ATOM 0 HB2 PHE A1992 7.542 -2.649 -1.941 1.00 0.40 H new ATOM 0 HB3 PHE A1992 7.864 -1.004 -2.454 1.00 0.40 H new ATOM 0 HD1 PHE A1992 6.027 0.695 -2.403 1.00 0.56 H new ATOM 0 HD2 PHE A1992 5.522 -3.222 -0.832 1.00 0.58 H new ATOM 0 HE1 PHE A1992 4.048 1.452 -1.178 1.00 0.68 H new ATOM 0 HE2 PHE A1992 3.536 -2.475 0.404 1.00 0.71 H new ATOM 0 HZ PHE A1992 2.841 -0.070 0.272 1.00 0.74 H new ATOM 1652 N VAL A1993 8.345 -2.043 -5.726 1.00 0.44 N ATOM 1653 CA VAL A1993 9.497 -2.365 -6.534 1.00 0.51 C ATOM 1654 C VAL A1993 10.380 -1.121 -6.654 1.00 0.53 C ATOM 1655 O VAL A1993 9.884 -0.019 -6.629 1.00 0.58 O ATOM 1656 CB VAL A1993 9.049 -2.926 -7.932 1.00 0.59 C ATOM 1657 CG1 VAL A1993 8.021 -2.027 -8.590 1.00 0.76 C ATOM 1658 CG2 VAL A1993 10.230 -3.143 -8.866 1.00 0.91 C ATOM 0 H VAL A1993 7.761 -1.304 -6.118 1.00 0.44 H new ATOM 0 HA VAL A1993 10.084 -3.152 -6.061 1.00 0.51 H new ATOM 0 HB VAL A1993 8.589 -3.896 -7.742 1.00 0.59 H new ATOM 0 HG11 VAL A1993 7.735 -2.447 -9.554 1.00 0.76 H new ATOM 0 HG12 VAL A1993 7.141 -1.952 -7.951 1.00 0.76 H new ATOM 0 HG13 VAL A1993 8.447 -1.035 -8.738 1.00 0.76 H new ATOM 0 HG21 VAL A1993 9.873 -3.531 -9.820 1.00 0.91 H new ATOM 0 HG22 VAL A1993 10.744 -2.196 -9.029 1.00 0.91 H new ATOM 0 HG23 VAL A1993 10.921 -3.858 -8.419 1.00 0.91 H new ATOM 1668 N CYS A1994 11.661 -1.301 -6.722 1.00 0.59 N ATOM 1669 CA CYS A1994 12.601 -0.208 -6.763 1.00 0.67 C ATOM 1670 C CYS A1994 12.827 0.337 -8.155 1.00 0.65 C ATOM 1671 O CYS A1994 13.316 -0.358 -9.036 1.00 0.84 O ATOM 1672 CB CYS A1994 13.907 -0.620 -6.094 1.00 0.88 C ATOM 1673 SG CYS A1994 14.430 -2.347 -6.435 1.00 1.47 S ATOM 0 H CYS A1994 12.097 -2.222 -6.751 1.00 0.59 H new ATOM 0 HA CYS A1994 12.163 0.618 -6.202 1.00 0.67 H new ATOM 0 HB2 CYS A1994 14.697 0.056 -6.422 1.00 0.88 H new ATOM 0 HB3 CYS A1994 13.804 -0.492 -5.016 1.00 0.88 H new ATOM 1678 N LYS A1995 12.426 1.583 -8.358 1.00 0.77 N ATOM 1679 CA LYS A1995 12.629 2.261 -9.621 1.00 0.93 C ATOM 1680 C LYS A1995 13.036 3.691 -9.463 1.00 1.05 C ATOM 1681 O LYS A1995 12.368 4.482 -8.761 1.00 1.39 O ATOM 1682 CB LYS A1995 11.416 2.201 -10.527 1.00 1.37 C ATOM 1683 CG LYS A1995 11.287 0.918 -11.289 1.00 1.79 C ATOM 1684 CD LYS A1995 10.101 0.963 -12.213 1.00 2.03 C ATOM 1685 CE LYS A1995 9.986 -0.319 -13.021 1.00 2.56 C ATOM 1686 NZ LYS A1995 8.836 -0.283 -13.940 1.00 3.14 N ATOM 0 H LYS A1995 11.953 2.147 -7.652 1.00 0.77 H new ATOM 0 HA LYS A1995 13.448 1.712 -10.086 1.00 0.93 H new ATOM 0 HB2 LYS A1995 10.519 2.346 -9.926 1.00 1.37 H new ATOM 0 HB3 LYS A1995 11.463 3.029 -11.235 1.00 1.37 H new ATOM 0 HG2 LYS A1995 12.195 0.738 -11.864 1.00 1.79 H new ATOM 0 HG3 LYS A1995 11.180 0.086 -10.593 1.00 1.79 H new ATOM 0 HD2 LYS A1995 9.190 1.114 -11.633 1.00 2.03 H new ATOM 0 HD3 LYS A1995 10.194 1.814 -12.887 1.00 2.03 H new ATOM 0 HE2 LYS A1995 10.902 -0.473 -13.591 1.00 2.56 H new ATOM 0 HE3 LYS A1995 9.885 -1.168 -12.344 1.00 2.56 H new ATOM 0 HZ1 LYS A1995 8.790 -1.174 -14.474 1.00 3.14 H new ATOM 0 HZ2 LYS A1995 7.959 -0.161 -13.394 1.00 3.14 H new ATOM 0 HZ3 LYS A1995 8.945 0.512 -14.602 1.00 3.14 H new ATOM 1700 N SER A1996 14.074 4.040 -10.182 1.00 1.31 N ATOM 1701 CA SER A1996 14.585 5.390 -10.251 1.00 1.68 C ATOM 1702 C SER A1996 13.635 6.251 -11.104 1.00 1.67 C ATOM 1703 O SER A1996 13.777 7.467 -11.190 1.00 2.05 O ATOM 1704 CB SER A1996 15.975 5.354 -10.873 1.00 2.15 C ATOM 1705 OG SER A1996 16.791 4.371 -10.216 1.00 2.57 O ATOM 0 H SER A1996 14.602 3.377 -10.751 1.00 1.31 H new ATOM 0 HA SER A1996 14.648 5.825 -9.254 1.00 1.68 H new ATOM 0 HB2 SER A1996 15.899 5.122 -11.935 1.00 2.15 H new ATOM 0 HB3 SER A1996 16.442 6.336 -10.793 1.00 2.15 H new ATOM 0 HG SER A1996 17.681 4.357 -10.627 1.00 2.57 H new ATOM 1711 N ASP A1997 12.655 5.582 -11.740 1.00 1.56 N ATOM 1712 CA ASP A1997 11.602 6.247 -12.519 1.00 1.73 C ATOM 1713 C ASP A1997 10.807 7.168 -11.626 1.00 1.59 C ATOM 1714 O ASP A1997 10.243 8.150 -12.072 1.00 2.04 O ATOM 1715 CB ASP A1997 10.652 5.220 -13.127 1.00 1.99 C ATOM 1716 CG ASP A1997 11.326 4.307 -14.106 1.00 2.32 C ATOM 1717 OD1 ASP A1997 11.922 3.302 -13.686 1.00 2.80 O ATOM 1718 OD2 ASP A1997 11.263 4.582 -15.320 1.00 2.65 O ATOM 0 H ASP A1997 12.574 4.565 -11.726 1.00 1.56 H new ATOM 0 HA ASP A1997 12.079 6.816 -13.317 1.00 1.73 H new ATOM 0 HB2 ASP A1997 10.210 4.625 -12.328 1.00 1.99 H new ATOM 0 HB3 ASP A1997 9.835 5.740 -13.627 1.00 1.99 H new ATOM 1723 N ALA A1998 10.759 6.831 -10.357 1.00 1.32 N ATOM 1724 CA ALA A1998 10.091 7.653 -9.388 1.00 1.24 C ATOM 1725 C ALA A1998 11.105 8.224 -8.437 1.00 1.57 C ATOM 1726 O ALA A1998 11.141 9.423 -8.213 1.00 1.87 O ATOM 1727 CB ALA A1998 9.048 6.869 -8.627 1.00 1.44 C ATOM 0 H ALA A1998 11.180 5.984 -9.975 1.00 1.32 H new ATOM 0 HA ALA A1998 9.581 8.461 -9.912 1.00 1.24 H new ATOM 0 HB1 ALA A1998 8.561 7.520 -7.901 1.00 1.44 H new ATOM 0 HB2 ALA A1998 8.304 6.481 -9.323 1.00 1.44 H new ATOM 0 HB3 ALA A1998 9.525 6.039 -8.106 1.00 1.44 H new ATOM 1733 N GLY A1999 11.948 7.359 -7.896 1.00 2.05 N ATOM 1734 CA GLY A1999 12.950 7.810 -6.945 1.00 2.88 C ATOM 1735 C GLY A1999 12.310 8.460 -5.727 1.00 2.81 C ATOM 1736 O GLY A1999 11.396 7.881 -5.114 1.00 3.07 O ATOM 0 H GLY A1999 11.960 6.359 -8.094 1.00 2.05 H new ATOM 0 HA2 GLY A1999 13.560 6.964 -6.629 1.00 2.88 H new ATOM 0 HA3 GLY A1999 13.619 8.522 -7.429 1.00 2.88 H new ATOM 1740 N ASP A2000 12.722 9.684 -5.424 1.00 2.90 N ATOM 1741 CA ASP A2000 12.191 10.403 -4.260 1.00 3.13 C ATOM 1742 C ASP A2000 10.797 10.960 -4.537 1.00 2.60 C ATOM 1743 O ASP A2000 10.053 11.271 -3.599 1.00 2.99 O ATOM 1744 CB ASP A2000 13.125 11.541 -3.774 1.00 3.84 C ATOM 1745 CG ASP A2000 13.042 12.824 -4.584 1.00 3.99 C ATOM 1746 OD1 ASP A2000 13.685 12.909 -5.654 1.00 4.30 O ATOM 1747 OD2 ASP A2000 12.305 13.749 -4.189 1.00 4.11 O ATOM 0 H ASP A2000 13.418 10.202 -5.961 1.00 2.90 H new ATOM 0 HA ASP A2000 12.129 9.666 -3.460 1.00 3.13 H new ATOM 0 HB2 ASP A2000 12.887 11.768 -2.735 1.00 3.84 H new ATOM 0 HB3 ASP A2000 14.154 11.181 -3.794 1.00 3.84 H new ATOM 1752 N ASP A2001 10.444 11.071 -5.822 1.00 2.08 N ATOM 1753 CA ASP A2001 9.114 11.564 -6.243 1.00 1.96 C ATOM 1754 C ASP A2001 8.052 10.666 -5.639 1.00 1.77 C ATOM 1755 O ASP A2001 7.196 11.126 -4.890 1.00 2.29 O ATOM 1756 CB ASP A2001 9.004 11.555 -7.774 1.00 2.29 C ATOM 1757 CG ASP A2001 7.659 12.014 -8.315 1.00 2.96 C ATOM 1758 OD1 ASP A2001 7.466 13.227 -8.498 1.00 3.70 O ATOM 1759 OD2 ASP A2001 6.750 11.170 -8.516 1.00 3.24 O ATOM 0 H ASP A2001 11.060 10.826 -6.598 1.00 2.08 H new ATOM 0 HA ASP A2001 8.975 12.588 -5.897 1.00 1.96 H new ATOM 0 HB2 ASP A2001 9.784 12.196 -8.185 1.00 2.29 H new ATOM 0 HB3 ASP A2001 9.200 10.545 -8.133 1.00 2.29 H new ATOM 1764 N SER A2002 8.173 9.373 -5.937 1.00 1.56 N ATOM 1765 CA SER A2002 7.342 8.322 -5.365 1.00 1.44 C ATOM 1766 C SER A2002 5.818 8.468 -5.595 1.00 1.26 C ATOM 1767 O SER A2002 5.145 9.294 -4.982 1.00 1.36 O ATOM 1768 CB SER A2002 7.689 8.113 -3.883 1.00 1.64 C ATOM 1769 OG SER A2002 8.966 7.484 -3.752 1.00 1.88 O ATOM 0 H SER A2002 8.867 9.023 -6.597 1.00 1.56 H new ATOM 0 HA SER A2002 7.591 7.421 -5.926 1.00 1.44 H new ATOM 0 HB2 SER A2002 7.695 9.073 -3.366 1.00 1.64 H new ATOM 0 HB3 SER A2002 6.924 7.499 -3.407 1.00 1.64 H new ATOM 0 HG SER A2002 9.595 7.886 -4.386 1.00 1.88 H new ATOM 1775 N GLN A2003 5.294 7.624 -6.458 1.00 1.23 N ATOM 1776 CA GLN A2003 3.886 7.594 -6.751 1.00 1.09 C ATOM 1777 C GLN A2003 3.401 6.139 -6.877 1.00 0.88 C ATOM 1778 O GLN A2003 4.135 5.274 -7.391 1.00 1.00 O ATOM 1779 CB GLN A2003 3.562 8.478 -7.987 1.00 1.33 C ATOM 1780 CG GLN A2003 4.426 8.219 -9.221 1.00 1.53 C ATOM 1781 CD GLN A2003 4.020 7.020 -10.052 1.00 1.86 C ATOM 1782 OE1 GLN A2003 4.855 6.363 -10.640 1.00 2.51 O ATOM 1783 NE2 GLN A2003 2.746 6.774 -10.166 1.00 1.74 N ATOM 0 H GLN A2003 5.841 6.937 -6.977 1.00 1.23 H new ATOM 0 HA GLN A2003 3.327 8.031 -5.924 1.00 1.09 H new ATOM 0 HB2 GLN A2003 2.517 8.326 -8.257 1.00 1.33 H new ATOM 0 HB3 GLN A2003 3.669 9.525 -7.702 1.00 1.33 H new ATOM 0 HG2 GLN A2003 4.401 9.105 -9.855 1.00 1.53 H new ATOM 0 HG3 GLN A2003 5.459 8.086 -8.900 1.00 1.53 H new ATOM 0 HE21 GLN A2003 2.069 7.344 -9.659 1.00 1.74 H new ATOM 0 HE22 GLN A2003 2.425 6.011 -10.762 1.00 1.74 H new ATOM 1792 N PRO A2004 2.212 5.843 -6.348 1.00 0.72 N ATOM 1793 CA PRO A2004 1.632 4.510 -6.363 1.00 0.61 C ATOM 1794 C PRO A2004 0.831 4.247 -7.633 1.00 0.60 C ATOM 1795 O PRO A2004 -0.127 4.957 -7.934 1.00 0.74 O ATOM 1796 CB PRO A2004 0.690 4.516 -5.148 1.00 0.66 C ATOM 1797 CG PRO A2004 0.649 5.937 -4.652 1.00 0.77 C ATOM 1798 CD PRO A2004 1.328 6.789 -5.674 1.00 0.83 C ATOM 0 HA PRO A2004 2.398 3.735 -6.329 1.00 0.61 H new ATOM 0 HB2 PRO A2004 -0.306 4.173 -5.427 1.00 0.66 H new ATOM 0 HB3 PRO A2004 1.053 3.843 -4.371 1.00 0.66 H new ATOM 0 HG2 PRO A2004 -0.381 6.262 -4.505 1.00 0.77 H new ATOM 0 HG3 PRO A2004 1.151 6.021 -3.688 1.00 0.77 H new ATOM 0 HD2 PRO A2004 0.614 7.238 -6.365 1.00 0.83 H new ATOM 0 HD3 PRO A2004 1.885 7.606 -5.214 1.00 0.83 H new ATOM 1806 N VAL A2005 1.216 3.242 -8.362 1.00 0.57 N ATOM 1807 CA VAL A2005 0.548 2.883 -9.589 1.00 0.59 C ATOM 1808 C VAL A2005 -0.608 1.966 -9.255 1.00 0.59 C ATOM 1809 O VAL A2005 -0.416 0.921 -8.623 1.00 0.62 O ATOM 1810 CB VAL A2005 1.508 2.140 -10.564 1.00 0.66 C ATOM 1811 CG1 VAL A2005 0.832 1.832 -11.897 1.00 0.73 C ATOM 1812 CG2 VAL A2005 2.789 2.928 -10.778 1.00 0.69 C ATOM 0 H VAL A2005 2.006 2.642 -8.126 1.00 0.57 H new ATOM 0 HA VAL A2005 0.203 3.795 -10.076 1.00 0.59 H new ATOM 0 HB VAL A2005 1.767 1.189 -10.099 1.00 0.66 H new ATOM 0 HG11 VAL A2005 1.534 1.313 -12.550 1.00 0.73 H new ATOM 0 HG12 VAL A2005 -0.039 1.200 -11.726 1.00 0.73 H new ATOM 0 HG13 VAL A2005 0.517 2.763 -12.369 1.00 0.73 H new ATOM 0 HG21 VAL A2005 3.440 2.385 -11.463 1.00 0.69 H new ATOM 0 HG22 VAL A2005 2.550 3.904 -11.201 1.00 0.69 H new ATOM 0 HG23 VAL A2005 3.298 3.062 -9.823 1.00 0.69 H new ATOM 1822 N PHE A2006 -1.791 2.361 -9.624 1.00 0.62 N ATOM 1823 CA PHE A2006 -2.944 1.529 -9.420 1.00 0.65 C ATOM 1824 C PHE A2006 -3.166 0.668 -10.650 1.00 0.63 C ATOM 1825 O PHE A2006 -3.207 1.173 -11.784 1.00 0.71 O ATOM 1826 CB PHE A2006 -4.206 2.351 -9.043 1.00 0.76 C ATOM 1827 CG PHE A2006 -4.622 3.425 -10.028 1.00 0.86 C ATOM 1828 CD1 PHE A2006 -4.003 4.667 -10.020 1.00 0.91 C ATOM 1829 CD2 PHE A2006 -5.615 3.183 -10.970 1.00 1.01 C ATOM 1830 CE1 PHE A2006 -4.368 5.644 -10.923 1.00 1.08 C ATOM 1831 CE2 PHE A2006 -5.982 4.158 -11.876 1.00 1.17 C ATOM 1832 CZ PHE A2006 -5.416 5.400 -11.816 1.00 1.21 C ATOM 0 H PHE A2006 -1.985 3.258 -10.070 1.00 0.62 H new ATOM 0 HA PHE A2006 -2.756 0.878 -8.566 1.00 0.65 H new ATOM 0 HB2 PHE A2006 -5.040 1.660 -8.916 1.00 0.76 H new ATOM 0 HB3 PHE A2006 -4.032 2.822 -8.075 1.00 0.76 H new ATOM 0 HD1 PHE A2006 -3.226 4.871 -9.298 1.00 0.91 H new ATOM 0 HD2 PHE A2006 -6.105 2.221 -10.993 1.00 1.01 H new ATOM 0 HE1 PHE A2006 -3.848 6.590 -10.940 1.00 1.08 H new ATOM 0 HE2 PHE A2006 -6.719 3.938 -12.634 1.00 1.17 H new ATOM 0 HZ PHE A2006 -5.777 6.191 -12.456 1.00 1.21 H new ATOM 1842 N LEU A2007 -3.240 -0.620 -10.449 1.00 0.62 N ATOM 1843 CA LEU A2007 -3.438 -1.533 -11.542 1.00 0.71 C ATOM 1844 C LEU A2007 -4.921 -1.702 -11.804 1.00 0.81 C ATOM 1845 O LEU A2007 -5.449 -1.169 -12.783 1.00 0.97 O ATOM 1846 CB LEU A2007 -2.740 -2.902 -11.303 1.00 0.81 C ATOM 1847 CG LEU A2007 -1.184 -2.956 -11.405 1.00 0.85 C ATOM 1848 CD1 LEU A2007 -0.494 -2.048 -10.397 1.00 1.29 C ATOM 1849 CD2 LEU A2007 -0.693 -4.384 -11.233 1.00 1.10 C ATOM 0 H LEU A2007 -3.166 -1.063 -9.533 1.00 0.62 H new ATOM 0 HA LEU A2007 -2.969 -1.106 -12.428 1.00 0.71 H new ATOM 0 HB2 LEU A2007 -3.022 -3.252 -10.310 1.00 0.81 H new ATOM 0 HB3 LEU A2007 -3.147 -3.615 -12.020 1.00 0.81 H new ATOM 0 HG LEU A2007 -0.923 -2.592 -12.399 1.00 0.85 H new ATOM 0 HD11 LEU A2007 0.587 -2.128 -10.516 1.00 1.29 H new ATOM 0 HD12 LEU A2007 -0.802 -1.016 -10.566 1.00 1.29 H new ATOM 0 HD13 LEU A2007 -0.771 -2.349 -9.387 1.00 1.29 H new ATOM 0 HD21 LEU A2007 0.394 -4.406 -11.307 1.00 1.10 H new ATOM 0 HD22 LEU A2007 -0.998 -4.759 -10.256 1.00 1.10 H new ATOM 0 HD23 LEU A2007 -1.122 -5.013 -12.013 1.00 1.10 H new ATOM 1861 N SER A2008 -5.605 -2.406 -10.927 1.00 0.80 N ATOM 1862 CA SER A2008 -7.034 -2.621 -11.059 1.00 0.99 C ATOM 1863 C SER A2008 -7.624 -3.018 -9.723 1.00 0.80 C ATOM 1864 O SER A2008 -6.959 -3.697 -8.928 1.00 0.64 O ATOM 1865 CB SER A2008 -7.335 -3.741 -12.080 1.00 1.31 C ATOM 1866 OG SER A2008 -6.819 -3.446 -13.368 1.00 1.75 O ATOM 0 H SER A2008 -5.190 -2.845 -10.105 1.00 0.80 H new ATOM 0 HA SER A2008 -7.479 -1.689 -11.407 1.00 0.99 H new ATOM 0 HB2 SER A2008 -6.907 -4.678 -11.725 1.00 1.31 H new ATOM 0 HB3 SER A2008 -8.413 -3.888 -12.148 1.00 1.31 H new ATOM 0 HG SER A2008 -6.408 -2.556 -13.360 1.00 1.75 H new ATOM 1872 N PHE A2009 -8.834 -2.560 -9.465 1.00 0.90 N ATOM 1873 CA PHE A2009 -9.582 -2.993 -8.317 1.00 0.77 C ATOM 1874 C PHE A2009 -10.667 -3.921 -8.820 1.00 0.80 C ATOM 1875 O PHE A2009 -11.517 -3.521 -9.622 1.00 0.93 O ATOM 1876 CB PHE A2009 -10.208 -1.794 -7.566 1.00 0.85 C ATOM 1877 CG PHE A2009 -11.014 -2.173 -6.328 1.00 0.77 C ATOM 1878 CD1 PHE A2009 -10.391 -2.342 -5.108 1.00 0.72 C ATOM 1879 CD2 PHE A2009 -12.389 -2.353 -6.393 1.00 1.14 C ATOM 1880 CE1 PHE A2009 -11.110 -2.683 -3.982 1.00 0.81 C ATOM 1881 CE2 PHE A2009 -13.114 -2.693 -5.268 1.00 1.16 C ATOM 1882 CZ PHE A2009 -12.474 -2.859 -4.062 1.00 0.87 C ATOM 0 H PHE A2009 -9.319 -1.879 -10.049 1.00 0.90 H new ATOM 0 HA PHE A2009 -8.925 -3.500 -7.611 1.00 0.77 H new ATOM 0 HB2 PHE A2009 -9.412 -1.111 -7.270 1.00 0.85 H new ATOM 0 HB3 PHE A2009 -10.856 -1.250 -8.253 1.00 0.85 H new ATOM 0 HD1 PHE A2009 -9.322 -2.205 -5.034 1.00 0.72 H new ATOM 0 HD2 PHE A2009 -12.899 -2.225 -7.337 1.00 1.14 H new ATOM 0 HE1 PHE A2009 -10.604 -2.812 -3.037 1.00 0.81 H new ATOM 0 HE2 PHE A2009 -14.183 -2.829 -5.335 1.00 1.16 H new ATOM 0 HZ PHE A2009 -13.039 -3.126 -3.181 1.00 0.87 H new ATOM 1892 N ASP A2010 -10.620 -5.139 -8.401 1.00 0.74 N ATOM 1893 CA ASP A2010 -11.607 -6.105 -8.800 1.00 0.83 C ATOM 1894 C ASP A2010 -12.705 -6.131 -7.781 1.00 0.88 C ATOM 1895 O ASP A2010 -12.449 -6.402 -6.623 1.00 0.97 O ATOM 1896 CB ASP A2010 -10.992 -7.492 -8.920 1.00 0.97 C ATOM 1897 CG ASP A2010 -12.031 -8.530 -9.220 1.00 1.63 C ATOM 1898 OD1 ASP A2010 -12.421 -8.676 -10.394 1.00 2.01 O ATOM 1899 OD2 ASP A2010 -12.463 -9.240 -8.284 1.00 2.43 O ATOM 0 H ASP A2010 -9.902 -5.501 -7.774 1.00 0.74 H new ATOM 0 HA ASP A2010 -12.004 -5.820 -9.775 1.00 0.83 H new ATOM 0 HB2 ASP A2010 -10.240 -7.490 -9.709 1.00 0.97 H new ATOM 0 HB3 ASP A2010 -10.480 -7.746 -7.992 1.00 0.97 H new ATOM 1904 N GLU A2011 -13.923 -5.849 -8.202 1.00 1.03 N ATOM 1905 CA GLU A2011 -15.053 -5.793 -7.279 1.00 1.24 C ATOM 1906 C GLU A2011 -15.698 -7.168 -7.094 1.00 1.30 C ATOM 1907 O GLU A2011 -16.643 -7.331 -6.312 1.00 1.46 O ATOM 1908 CB GLU A2011 -16.094 -4.781 -7.755 1.00 1.52 C ATOM 1909 CG GLU A2011 -15.518 -3.403 -8.016 1.00 1.76 C ATOM 1910 CD GLU A2011 -16.577 -2.363 -8.263 1.00 2.09 C ATOM 1911 OE1 GLU A2011 -17.064 -2.256 -9.410 1.00 2.75 O ATOM 1912 OE2 GLU A2011 -16.945 -1.618 -7.333 1.00 2.23 O ATOM 0 H GLU A2011 -14.161 -5.655 -9.175 1.00 1.03 H new ATOM 0 HA GLU A2011 -14.666 -5.470 -6.312 1.00 1.24 H new ATOM 0 HB2 GLU A2011 -16.559 -5.151 -8.669 1.00 1.52 H new ATOM 0 HB3 GLU A2011 -16.882 -4.702 -7.006 1.00 1.52 H new ATOM 0 HG2 GLU A2011 -14.911 -3.101 -7.162 1.00 1.76 H new ATOM 0 HG3 GLU A2011 -14.854 -3.450 -8.879 1.00 1.76 H new ATOM 1919 N GLN A2012 -15.178 -8.158 -7.788 1.00 1.32 N ATOM 1920 CA GLN A2012 -15.710 -9.500 -7.691 1.00 1.52 C ATOM 1921 C GLN A2012 -15.201 -10.170 -6.412 1.00 1.49 C ATOM 1922 O GLN A2012 -15.899 -10.958 -5.793 1.00 1.71 O ATOM 1923 CB GLN A2012 -15.385 -10.320 -8.949 1.00 1.75 C ATOM 1924 CG GLN A2012 -16.005 -11.704 -8.959 1.00 2.10 C ATOM 1925 CD GLN A2012 -15.811 -12.426 -10.274 1.00 2.62 C ATOM 1926 OE1 GLN A2012 -14.822 -13.147 -10.479 1.00 3.40 O ATOM 1927 NE2 GLN A2012 -16.743 -12.259 -11.166 1.00 2.81 N ATOM 0 H GLN A2012 -14.388 -8.059 -8.425 1.00 1.32 H new ATOM 0 HA GLN A2012 -16.797 -9.448 -7.631 1.00 1.52 H new ATOM 0 HB2 GLN A2012 -15.729 -9.772 -9.826 1.00 1.75 H new ATOM 0 HB3 GLN A2012 -14.303 -10.417 -9.038 1.00 1.75 H new ATOM 0 HG2 GLN A2012 -15.568 -12.298 -8.156 1.00 2.10 H new ATOM 0 HG3 GLN A2012 -17.071 -11.620 -8.750 1.00 2.10 H new ATOM 0 HE21 GLN A2012 -17.542 -11.659 -10.962 1.00 2.81 H new ATOM 0 HE22 GLN A2012 -16.675 -12.728 -12.069 1.00 2.81 H new ATOM 1936 N THR A2013 -13.986 -9.866 -6.033 1.00 1.37 N ATOM 1937 CA THR A2013 -13.462 -10.332 -4.760 1.00 1.47 C ATOM 1938 C THR A2013 -12.923 -9.135 -3.941 1.00 1.37 C ATOM 1939 O THR A2013 -12.287 -9.304 -2.923 1.00 1.57 O ATOM 1940 CB THR A2013 -12.366 -11.442 -4.966 1.00 1.72 C ATOM 1941 OG1 THR A2013 -11.863 -11.952 -3.709 1.00 1.95 O ATOM 1942 CG2 THR A2013 -11.205 -10.931 -5.806 1.00 1.76 C ATOM 0 H THR A2013 -13.337 -9.300 -6.580 1.00 1.37 H new ATOM 0 HA THR A2013 -14.272 -10.792 -4.195 1.00 1.47 H new ATOM 0 HB THR A2013 -12.857 -12.258 -5.496 1.00 1.72 H new ATOM 0 HG1 THR A2013 -12.516 -11.775 -3.000 1.00 1.95 H new ATOM 0 HG21 THR A2013 -10.467 -11.724 -5.928 1.00 1.76 H new ATOM 0 HG22 THR A2013 -11.572 -10.623 -6.785 1.00 1.76 H new ATOM 0 HG23 THR A2013 -10.743 -10.079 -5.308 1.00 1.76 H new ATOM 1950 N CYS A2014 -13.201 -7.920 -4.418 1.00 1.20 N ATOM 1951 CA CYS A2014 -12.772 -6.659 -3.758 1.00 1.22 C ATOM 1952 C CYS A2014 -11.261 -6.602 -3.525 1.00 1.19 C ATOM 1953 O CYS A2014 -10.772 -5.941 -2.599 1.00 1.49 O ATOM 1954 CB CYS A2014 -13.544 -6.420 -2.467 1.00 1.49 C ATOM 1955 SG CYS A2014 -15.298 -6.047 -2.726 1.00 1.65 S ATOM 0 H CYS A2014 -13.732 -7.769 -5.276 1.00 1.20 H new ATOM 0 HA CYS A2014 -13.010 -5.849 -4.447 1.00 1.22 H new ATOM 0 HB2 CYS A2014 -13.459 -7.304 -1.834 1.00 1.49 H new ATOM 0 HB3 CYS A2014 -13.082 -5.595 -1.925 1.00 1.49 H new ATOM 1960 N THR A2015 -10.535 -7.238 -4.396 1.00 1.02 N ATOM 1961 CA THR A2015 -9.108 -7.300 -4.305 1.00 1.04 C ATOM 1962 C THR A2015 -8.514 -6.320 -5.306 1.00 0.96 C ATOM 1963 O THR A2015 -8.975 -6.239 -6.445 1.00 1.08 O ATOM 1964 CB THR A2015 -8.630 -8.744 -4.588 1.00 1.15 C ATOM 1965 OG1 THR A2015 -9.189 -9.633 -3.590 1.00 1.56 O ATOM 1966 CG2 THR A2015 -7.112 -8.859 -4.577 1.00 1.39 C ATOM 0 H THR A2015 -10.922 -7.734 -5.199 1.00 1.02 H new ATOM 0 HA THR A2015 -8.778 -7.027 -3.303 1.00 1.04 H new ATOM 0 HB THR A2015 -8.973 -9.021 -5.585 1.00 1.15 H new ATOM 0 HG1 THR A2015 -8.891 -10.550 -3.765 1.00 1.56 H new ATOM 0 HG21 THR A2015 -6.824 -9.890 -4.780 1.00 1.39 H new ATOM 0 HG22 THR A2015 -6.692 -8.207 -5.343 1.00 1.39 H new ATOM 0 HG23 THR A2015 -6.732 -8.562 -3.600 1.00 1.39 H new ATOM 1974 N SER A2016 -7.558 -5.553 -4.880 1.00 0.87 N ATOM 1975 CA SER A2016 -6.954 -4.606 -5.750 1.00 0.83 C ATOM 1976 C SER A2016 -5.470 -4.901 -5.866 1.00 0.71 C ATOM 1977 O SER A2016 -4.902 -5.654 -5.045 1.00 0.74 O ATOM 1978 CB SER A2016 -7.189 -3.193 -5.228 1.00 0.87 C ATOM 1979 OG SER A2016 -6.853 -2.221 -6.204 1.00 1.36 O ATOM 0 H SER A2016 -7.182 -5.568 -3.932 1.00 0.87 H new ATOM 0 HA SER A2016 -7.403 -4.680 -6.740 1.00 0.83 H new ATOM 0 HB2 SER A2016 -8.234 -3.078 -4.942 1.00 0.87 H new ATOM 0 HB3 SER A2016 -6.593 -3.031 -4.330 1.00 0.87 H new ATOM 0 HG SER A2016 -6.338 -1.500 -5.784 1.00 1.36 H new ATOM 1985 N TYR A2017 -4.861 -4.337 -6.874 1.00 0.64 N ATOM 1986 CA TYR A2017 -3.456 -4.501 -7.132 1.00 0.57 C ATOM 1987 C TYR A2017 -2.840 -3.134 -7.287 1.00 0.49 C ATOM 1988 O TYR A2017 -3.313 -2.317 -8.107 1.00 0.56 O ATOM 1989 CB TYR A2017 -3.217 -5.286 -8.426 1.00 0.71 C ATOM 1990 CG TYR A2017 -3.883 -6.635 -8.494 1.00 0.86 C ATOM 1991 CD1 TYR A2017 -3.321 -7.745 -7.881 1.00 0.92 C ATOM 1992 CD2 TYR A2017 -5.074 -6.797 -9.186 1.00 1.01 C ATOM 1993 CE1 TYR A2017 -3.929 -8.980 -7.956 1.00 1.09 C ATOM 1994 CE2 TYR A2017 -5.685 -8.024 -9.269 1.00 1.18 C ATOM 1995 CZ TYR A2017 -5.112 -9.112 -8.653 1.00 1.20 C ATOM 1996 OH TYR A2017 -5.718 -10.344 -8.753 1.00 1.38 O ATOM 0 H TYR A2017 -5.336 -3.740 -7.551 1.00 0.64 H new ATOM 0 HA TYR A2017 -3.010 -5.050 -6.303 1.00 0.57 H new ATOM 0 HB2 TYR A2017 -3.565 -4.685 -9.266 1.00 0.71 H new ATOM 0 HB3 TYR A2017 -2.143 -5.422 -8.555 1.00 0.71 H new ATOM 0 HD1 TYR A2017 -2.394 -7.640 -7.337 1.00 0.92 H new ATOM 0 HD2 TYR A2017 -5.529 -5.944 -9.668 1.00 1.01 H new ATOM 0 HE1 TYR A2017 -3.483 -9.837 -7.473 1.00 1.09 H new ATOM 0 HE2 TYR A2017 -6.610 -8.134 -9.815 1.00 1.18 H new ATOM 0 HH TYR A2017 -6.543 -10.261 -9.276 1.00 1.38 H new ATOM 2006 N PHE A2018 -1.837 -2.862 -6.511 1.00 0.39 N ATOM 2007 CA PHE A2018 -1.135 -1.610 -6.581 1.00 0.39 C ATOM 2008 C PHE A2018 0.347 -1.887 -6.648 1.00 0.36 C ATOM 2009 O PHE A2018 0.825 -2.841 -6.047 1.00 0.40 O ATOM 2010 CB PHE A2018 -1.424 -0.742 -5.356 1.00 0.47 C ATOM 2011 CG PHE A2018 -2.870 -0.453 -5.101 1.00 0.57 C ATOM 2012 CD1 PHE A2018 -3.590 0.357 -5.957 1.00 0.74 C ATOM 2013 CD2 PHE A2018 -3.509 -0.996 -3.998 1.00 0.74 C ATOM 2014 CE1 PHE A2018 -4.918 0.624 -5.721 1.00 0.89 C ATOM 2015 CE2 PHE A2018 -4.839 -0.730 -3.753 1.00 0.87 C ATOM 2016 CZ PHE A2018 -5.545 0.081 -4.617 1.00 0.87 C ATOM 0 H PHE A2018 -1.477 -3.504 -5.805 1.00 0.39 H new ATOM 0 HA PHE A2018 -1.470 -1.073 -7.468 1.00 0.39 H new ATOM 0 HB2 PHE A2018 -1.009 -1.234 -4.477 1.00 0.47 H new ATOM 0 HB3 PHE A2018 -0.896 0.205 -5.470 1.00 0.47 H new ATOM 0 HD1 PHE A2018 -3.105 0.785 -6.821 1.00 0.74 H new ATOM 0 HD2 PHE A2018 -2.959 -1.635 -3.323 1.00 0.74 H new ATOM 0 HE1 PHE A2018 -5.470 1.258 -6.399 1.00 0.89 H new ATOM 0 HE2 PHE A2018 -5.326 -1.155 -2.888 1.00 0.87 H new ATOM 0 HZ PHE A2018 -6.588 0.291 -4.430 1.00 0.87 H new ATOM 2026 N SER A2019 1.055 -1.080 -7.372 1.00 0.45 N ATOM 2027 CA SER A2019 2.479 -1.214 -7.497 1.00 0.47 C ATOM 2028 C SER A2019 3.146 0.141 -7.293 1.00 0.45 C ATOM 2029 O SER A2019 2.852 1.098 -7.987 1.00 0.49 O ATOM 2030 CB SER A2019 2.837 -1.794 -8.869 1.00 0.51 C ATOM 2031 OG SER A2019 2.326 -3.119 -9.031 1.00 1.24 O ATOM 0 H SER A2019 0.661 -0.301 -7.900 1.00 0.45 H new ATOM 0 HA SER A2019 2.843 -1.899 -6.731 1.00 0.47 H new ATOM 0 HB2 SER A2019 2.436 -1.151 -9.652 1.00 0.51 H new ATOM 0 HB3 SER A2019 3.920 -1.804 -8.989 1.00 0.51 H new ATOM 0 HG SER A2019 2.465 -3.626 -8.204 1.00 1.24 H new ATOM 2037 N TRP A2020 4.008 0.230 -6.337 1.00 0.52 N ATOM 2038 CA TRP A2020 4.701 1.451 -6.074 1.00 0.57 C ATOM 2039 C TRP A2020 6.151 1.234 -6.400 1.00 0.49 C ATOM 2040 O TRP A2020 6.843 0.449 -5.750 1.00 0.43 O ATOM 2041 CB TRP A2020 4.551 1.873 -4.607 1.00 0.69 C ATOM 2042 CG TRP A2020 4.995 3.280 -4.293 1.00 0.88 C ATOM 2043 CD1 TRP A2020 6.087 3.930 -4.773 1.00 0.81 C ATOM 2044 CD2 TRP A2020 4.361 4.193 -3.395 1.00 1.75 C ATOM 2045 NE1 TRP A2020 6.170 5.177 -4.246 1.00 1.00 N ATOM 2046 CE2 TRP A2020 5.122 5.372 -3.396 1.00 1.65 C ATOM 2047 CE3 TRP A2020 3.225 4.132 -2.594 1.00 2.75 C ATOM 2048 CZ2 TRP A2020 4.783 6.482 -2.628 1.00 2.41 C ATOM 2049 CZ3 TRP A2020 2.895 5.232 -1.834 1.00 3.55 C ATOM 2050 CH2 TRP A2020 3.669 6.392 -1.856 1.00 3.35 C ATOM 0 H TRP A2020 4.254 -0.540 -5.715 1.00 0.52 H new ATOM 0 HA TRP A2020 4.280 2.249 -6.686 1.00 0.57 H new ATOM 0 HB2 TRP A2020 3.505 1.767 -4.321 1.00 0.69 H new ATOM 0 HB3 TRP A2020 5.122 1.182 -3.987 1.00 0.69 H new ATOM 0 HD1 TRP A2020 6.791 3.512 -5.477 1.00 0.81 H new ATOM 0 HE1 TRP A2020 6.899 5.859 -4.452 1.00 1.00 H new ATOM 0 HE3 TRP A2020 2.615 3.241 -2.569 1.00 2.75 H new ATOM 0 HZ2 TRP A2020 5.382 7.380 -2.645 1.00 2.41 H new ATOM 0 HZ3 TRP A2020 2.017 5.196 -1.207 1.00 3.55 H new ATOM 0 HH2 TRP A2020 3.377 7.235 -1.247 1.00 3.35 H new ATOM 2061 N HIS A2021 6.599 1.890 -7.410 1.00 0.61 N ATOM 2062 CA HIS A2021 7.971 1.799 -7.778 1.00 0.66 C ATOM 2063 C HIS A2021 8.798 2.906 -7.124 1.00 0.64 C ATOM 2064 O HIS A2021 8.939 3.991 -7.658 1.00 0.81 O ATOM 2065 CB HIS A2021 8.181 1.689 -9.304 1.00 0.86 C ATOM 2066 CG HIS A2021 7.541 2.754 -10.153 1.00 0.93 C ATOM 2067 ND1 HIS A2021 8.079 4.002 -10.325 1.00 1.53 N ATOM 2068 CD2 HIS A2021 6.420 2.730 -10.903 1.00 1.33 C ATOM 2069 CE1 HIS A2021 7.322 4.692 -11.146 1.00 1.61 C ATOM 2070 NE2 HIS A2021 6.318 3.944 -11.503 1.00 1.43 N ATOM 0 H HIS A2021 6.034 2.500 -8.001 1.00 0.61 H new ATOM 0 HA HIS A2021 8.348 0.857 -7.381 1.00 0.66 H new ATOM 0 HB2 HIS A2021 9.253 1.695 -9.501 1.00 0.86 H new ATOM 0 HB3 HIS A2021 7.802 0.720 -9.631 1.00 0.86 H new ATOM 0 HD1 HIS A2021 8.934 4.342 -9.884 1.00 1.53 H new ATOM 0 HD2 HIS A2021 5.734 1.902 -11.007 1.00 1.33 H new ATOM 0 HE1 HIS A2021 7.501 5.707 -11.470 1.00 1.61 H new ATOM 2079 N THR A2022 9.322 2.612 -5.962 1.00 0.51 N ATOM 2080 CA THR A2022 10.063 3.557 -5.166 1.00 0.50 C ATOM 2081 C THR A2022 11.418 2.968 -4.783 1.00 0.48 C ATOM 2082 O THR A2022 11.575 1.749 -4.698 1.00 0.50 O ATOM 2083 CB THR A2022 9.284 3.965 -3.876 1.00 0.53 C ATOM 2084 OG1 THR A2022 10.006 4.966 -3.149 1.00 0.63 O ATOM 2085 CG2 THR A2022 9.043 2.760 -2.968 1.00 0.56 C ATOM 0 H THR A2022 9.244 1.690 -5.534 1.00 0.51 H new ATOM 0 HA THR A2022 10.207 4.454 -5.769 1.00 0.50 H new ATOM 0 HB THR A2022 8.320 4.365 -4.190 1.00 0.53 H new ATOM 0 HG1 THR A2022 9.653 5.852 -3.374 1.00 0.63 H new ATOM 0 HG21 THR A2022 8.499 3.078 -2.079 1.00 0.56 H new ATOM 0 HG22 THR A2022 8.458 2.012 -3.504 1.00 0.56 H new ATOM 0 HG23 THR A2022 10.000 2.330 -2.673 1.00 0.56 H new ATOM 2093 N SER A2023 12.375 3.825 -4.586 1.00 0.55 N ATOM 2094 CA SER A2023 13.717 3.449 -4.208 1.00 0.60 C ATOM 2095 C SER A2023 13.766 2.781 -2.812 1.00 0.59 C ATOM 2096 O SER A2023 14.647 1.979 -2.542 1.00 0.75 O ATOM 2097 CB SER A2023 14.557 4.703 -4.216 1.00 0.85 C ATOM 2098 OG SER A2023 14.326 5.420 -5.420 1.00 1.21 O ATOM 0 H SER A2023 12.247 4.832 -4.685 1.00 0.55 H new ATOM 0 HA SER A2023 14.098 2.713 -4.916 1.00 0.60 H new ATOM 0 HB2 SER A2023 14.309 5.325 -3.356 1.00 0.85 H new ATOM 0 HB3 SER A2023 15.613 4.447 -4.130 1.00 0.85 H new ATOM 0 HG SER A2023 15.069 6.038 -5.580 1.00 1.21 H new ATOM 2104 N LEU A2024 12.794 3.091 -1.954 1.00 0.61 N ATOM 2105 CA LEU A2024 12.759 2.555 -0.571 1.00 0.74 C ATOM 2106 C LEU A2024 12.403 1.073 -0.551 1.00 0.76 C ATOM 2107 O LEU A2024 12.652 0.377 0.430 1.00 0.93 O ATOM 2108 CB LEU A2024 11.740 3.325 0.317 1.00 0.91 C ATOM 2109 CG LEU A2024 12.046 4.788 0.688 1.00 0.78 C ATOM 2110 CD1 LEU A2024 13.392 4.911 1.369 1.00 1.53 C ATOM 2111 CD2 LEU A2024 11.946 5.710 -0.515 1.00 1.11 C ATOM 0 H LEU A2024 12.015 3.709 -2.181 1.00 0.61 H new ATOM 0 HA LEU A2024 13.762 2.690 -0.167 1.00 0.74 H new ATOM 0 HB2 LEU A2024 10.777 3.307 -0.192 1.00 0.91 H new ATOM 0 HB3 LEU A2024 11.620 2.766 1.245 1.00 0.91 H new ATOM 0 HG LEU A2024 11.284 5.107 1.399 1.00 0.78 H new ATOM 0 HD11 LEU A2024 13.579 5.955 1.619 1.00 1.53 H new ATOM 0 HD12 LEU A2024 13.394 4.314 2.281 1.00 1.53 H new ATOM 0 HD13 LEU A2024 14.173 4.552 0.699 1.00 1.53 H new ATOM 0 HD21 LEU A2024 12.169 6.732 -0.210 1.00 1.11 H new ATOM 0 HD22 LEU A2024 12.660 5.394 -1.276 1.00 1.11 H new ATOM 0 HD23 LEU A2024 10.937 5.666 -0.924 1.00 1.11 H new ATOM 2123 N ALA A2025 11.842 0.609 -1.643 1.00 0.66 N ATOM 2124 CA ALA A2025 11.337 -0.741 -1.751 1.00 0.72 C ATOM 2125 C ALA A2025 12.445 -1.786 -1.774 1.00 0.85 C ATOM 2126 O ALA A2025 12.489 -2.670 -0.943 1.00 1.20 O ATOM 2127 CB ALA A2025 10.494 -0.851 -2.986 1.00 0.64 C ATOM 0 H ALA A2025 11.722 1.163 -2.491 1.00 0.66 H new ATOM 0 HA ALA A2025 10.739 -0.944 -0.863 1.00 0.72 H new ATOM 0 HB1 ALA A2025 10.109 -1.867 -3.075 1.00 0.64 H new ATOM 0 HB2 ALA A2025 9.660 -0.152 -2.921 1.00 0.64 H new ATOM 0 HB3 ALA A2025 11.099 -0.614 -3.862 1.00 0.64 H new ATOM 2133 N CYS A2026 13.335 -1.671 -2.715 1.00 0.90 N ATOM 2134 CA CYS A2026 14.393 -2.631 -2.870 1.00 1.05 C ATOM 2135 C CYS A2026 15.636 -1.973 -3.403 1.00 1.23 C ATOM 2136 O CYS A2026 15.679 -0.756 -3.546 1.00 1.55 O ATOM 2137 CB CYS A2026 13.950 -3.841 -3.735 1.00 1.61 C ATOM 2138 SG CYS A2026 13.129 -3.477 -5.338 1.00 2.15 S ATOM 0 H CYS A2026 13.350 -0.912 -3.396 1.00 0.90 H new ATOM 0 HA CYS A2026 14.632 -3.031 -1.885 1.00 1.05 H new ATOM 0 HB2 CYS A2026 14.831 -4.451 -3.938 1.00 1.61 H new ATOM 0 HB3 CYS A2026 13.271 -4.451 -3.139 1.00 1.61 H new