USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 950 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: A 836 ASN : amide:sc= 0.98 K(o=2.1,f=-10!) USER MOD Set 1.2: A 925 LYS NZ :NH3+ -110:sc= 1.07! (180deg=-2.34!) USER MOD Set 2.1: A 921 SER OG : rot 71:sc= 0.601 USER MOD Set 2.2: A 939 TYR OH : rot -123:sc= 1.15 USER MOD Set 3.1: A 887 THR OG1 : rot 130:sc= 0 USER MOD Set 3.2: A 919 MET CE :methyl -171:sc= -0.776 (180deg=-0.95) USER MOD Set 4.1: A 868 HIS : no HD1:sc= 0.697 K(o=1.2,f=-4.3!) USER MOD Set 4.2: A 896 THR OG1 : rot 137:sc= 0.552 USER MOD Set 5.1: A 852 LYS NZ :NH3+ -109:sc= 0.876 (180deg=0) USER MOD Set 5.2: A 867 ASN : amide:sc= 1.49 K(o=2.4,f=-3.6) USER MOD Single : A 825 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 826 MET CE :methyl -163:sc= -0.806 (180deg=-1.6!) USER MOD Single : A 833 HIS : no HE2:sc= 1.19 K(o=1.2,f=-5.4!) USER MOD Single : A 843 GLN : amide:sc= -0.0561 X(o=-0.056,f=-0.13) USER MOD Single : A 846 SER OG : rot 180:sc= 0 USER MOD Single : A 849 TYR OH : rot 180:sc= 0 USER MOD Single : A 850 GLN : amide:sc= -1 K(o=-1,f=-2.9!) USER MOD Single : A 851 CYS SG : rot -41:sc= 1.23 USER MOD Single : A 853 THR OG1 : rot 180:sc= 0.00942 USER MOD Single : A 855 ASN : amide:sc= -0.376 K(o=-0.38,f=-2.5!) USER MOD Single : A 862 ASN : amide:sc= 0.912 K(o=0.91,f=-0.21) USER MOD Single : A 865 SER OG : rot 62:sc= 1.25 USER MOD Single : A 866 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 874 SER OG : rot 180:sc= 0.0824 USER MOD Single : A 884 TYR OH : rot 180:sc= 0 USER MOD Single : A 888 GLN : amide:sc= 1.14 K(o=1.1,f=-0.058) USER MOD Single : A 892 GLN : amide:sc= -0.538 X(o=-0.54,f=-0.046) USER MOD Single : A 903 THR OG1 : rot 99:sc= 0.761 USER MOD Single : A 905 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 911 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 912 GLN :FLIP amide:sc= -0.574 F(o=-1.5,f=-0.57) USER MOD Single : A 914 CYS SG : rot 180:sc= 0 USER MOD Single : A 917 SER OG : rot -31:sc= 1.16 USER MOD Single : A 922 CYS SG : rot 150:sc= -1.12 USER MOD Single : A 924 SER OG : rot 180:sc= 0 USER MOD Single : A 928 THR OG1 : rot 180:sc= 0 USER MOD Single : A 933 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 934 GLN : amide:sc= 1.18 K(o=1.2,f=-0.33) USER MOD Single : A 935 THR OG1 : rot 90:sc= 1.3 USER MOD Single : A 937 THR OG1 : rot 81:sc= 1.3 USER MOD Single : A 945 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 946 SER OG : rot 100:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 112 N MET A 825 -9.774 -8.623 -21.496 1.00 0.74 N ATOM 113 CA MET A 825 -10.849 -9.204 -22.284 1.00 0.64 C ATOM 114 C MET A 825 -10.433 -10.565 -22.818 1.00 0.57 C ATOM 115 O MET A 825 -9.306 -10.739 -23.286 1.00 0.64 O ATOM 116 CB MET A 825 -11.225 -8.275 -23.442 1.00 0.76 C ATOM 117 CG MET A 825 -12.716 -7.996 -23.540 1.00 0.93 C ATOM 118 SD MET A 825 -13.462 -7.621 -21.941 1.00 1.60 S ATOM 119 CE MET A 825 -13.221 -5.847 -21.864 1.00 1.90 C ATOM 0 HA MET A 825 -11.721 -9.330 -21.642 1.00 0.64 H new ATOM 0 HB2 MET A 825 -10.694 -7.330 -23.326 1.00 0.76 H new ATOM 0 HB3 MET A 825 -10.885 -8.719 -24.378 1.00 0.76 H new ATOM 0 HG2 MET A 825 -12.881 -7.159 -24.218 1.00 0.93 H new ATOM 0 HG3 MET A 825 -13.215 -8.862 -23.975 1.00 0.93 H new ATOM 0 HE1 MET A 825 -13.631 -5.464 -20.929 1.00 1.90 H new ATOM 0 HE2 MET A 825 -12.156 -5.622 -21.912 1.00 1.90 H new ATOM 0 HE3 MET A 825 -13.730 -5.374 -22.704 1.00 1.90 H new ATOM 129 N MET A 826 -11.340 -11.527 -22.741 1.00 0.51 N ATOM 130 CA MET A 826 -11.049 -12.890 -23.163 1.00 0.49 C ATOM 131 C MET A 826 -11.498 -13.119 -24.597 1.00 0.43 C ATOM 132 O MET A 826 -12.660 -12.896 -24.938 1.00 0.50 O ATOM 133 CB MET A 826 -11.735 -13.900 -22.240 1.00 0.60 C ATOM 134 CG MET A 826 -11.266 -13.834 -20.795 1.00 1.14 C ATOM 135 SD MET A 826 -12.620 -14.036 -19.618 1.00 1.62 S ATOM 136 CE MET A 826 -13.696 -12.693 -20.114 1.00 1.93 C ATOM 0 H MET A 826 -12.287 -11.389 -22.389 1.00 0.51 H new ATOM 0 HA MET A 826 -9.970 -13.033 -23.105 1.00 0.49 H new ATOM 0 HB2 MET A 826 -12.811 -13.732 -22.270 1.00 0.60 H new ATOM 0 HB3 MET A 826 -11.559 -14.905 -22.623 1.00 0.60 H new ATOM 0 HG2 MET A 826 -10.520 -14.610 -20.623 1.00 1.14 H new ATOM 0 HG3 MET A 826 -10.776 -12.876 -20.619 1.00 1.14 H new ATOM 0 HE1 MET A 826 -14.413 -12.488 -19.319 1.00 1.93 H new ATOM 0 HE2 MET A 826 -13.100 -11.800 -20.304 1.00 1.93 H new ATOM 0 HE3 MET A 826 -14.231 -12.972 -21.022 1.00 1.93 H new ATOM 146 N ILE A 827 -10.567 -13.555 -25.429 1.00 0.36 N ATOM 147 CA ILE A 827 -10.862 -13.885 -26.811 1.00 0.34 C ATOM 148 C ILE A 827 -10.673 -15.382 -27.028 1.00 0.34 C ATOM 149 O ILE A 827 -9.673 -15.960 -26.592 1.00 0.37 O ATOM 150 CB ILE A 827 -9.958 -13.113 -27.802 1.00 0.35 C ATOM 151 CG1 ILE A 827 -9.358 -11.856 -27.146 1.00 0.37 C ATOM 152 CG2 ILE A 827 -10.741 -12.749 -29.057 1.00 0.43 C ATOM 153 CD1 ILE A 827 -10.299 -10.669 -27.094 1.00 0.47 C ATOM 0 H ILE A 827 -9.591 -13.689 -25.166 1.00 0.36 H new ATOM 0 HA ILE A 827 -11.895 -13.595 -27.003 1.00 0.34 H new ATOM 0 HB ILE A 827 -9.130 -13.763 -28.085 1.00 0.35 H new ATOM 0 HG12 ILE A 827 -9.048 -12.103 -26.131 1.00 0.37 H new ATOM 0 HG13 ILE A 827 -8.460 -11.569 -27.693 1.00 0.37 H new ATOM 0 HG21 ILE A 827 -10.093 -12.206 -29.745 1.00 0.43 H new ATOM 0 HG22 ILE A 827 -11.101 -13.659 -29.538 1.00 0.43 H new ATOM 0 HG23 ILE A 827 -11.590 -12.121 -28.787 1.00 0.43 H new ATOM 0 HD11 ILE A 827 -9.797 -9.827 -26.617 1.00 0.47 H new ATOM 0 HD12 ILE A 827 -10.590 -10.391 -28.107 1.00 0.47 H new ATOM 0 HD13 ILE A 827 -11.187 -10.934 -26.521 1.00 0.47 H new ATOM 165 N LEU A 828 -11.633 -16.013 -27.683 1.00 0.34 N ATOM 166 CA LEU A 828 -11.572 -17.446 -27.915 1.00 0.35 C ATOM 167 C LEU A 828 -11.280 -17.748 -29.375 1.00 0.36 C ATOM 168 O LEU A 828 -12.089 -17.450 -30.257 1.00 0.40 O ATOM 169 CB LEU A 828 -12.882 -18.117 -27.498 1.00 0.44 C ATOM 170 CG LEU A 828 -12.977 -19.614 -27.805 1.00 0.62 C ATOM 171 CD1 LEU A 828 -12.074 -20.411 -26.880 1.00 1.37 C ATOM 172 CD2 LEU A 828 -14.414 -20.091 -27.687 1.00 1.16 C ATOM 0 H LEU A 828 -12.462 -15.557 -28.063 1.00 0.34 H new ATOM 0 HA LEU A 828 -10.761 -17.847 -27.307 1.00 0.35 H new ATOM 0 HB2 LEU A 828 -13.020 -17.973 -26.426 1.00 0.44 H new ATOM 0 HB3 LEU A 828 -13.707 -17.608 -27.996 1.00 0.44 H new ATOM 0 HG LEU A 828 -12.643 -19.774 -28.830 1.00 0.62 H new ATOM 0 HD11 LEU A 828 -12.157 -21.472 -27.116 1.00 1.37 H new ATOM 0 HD12 LEU A 828 -11.041 -20.089 -27.014 1.00 1.37 H new ATOM 0 HD13 LEU A 828 -12.375 -20.244 -25.846 1.00 1.37 H new ATOM 0 HD21 LEU A 828 -14.463 -21.157 -27.909 1.00 1.16 H new ATOM 0 HD22 LEU A 828 -14.774 -19.914 -26.673 1.00 1.16 H new ATOM 0 HD23 LEU A 828 -15.038 -19.545 -28.394 1.00 1.16 H new ATOM 184 N VAL A 829 -10.118 -18.328 -29.620 1.00 0.39 N ATOM 185 CA VAL A 829 -9.758 -18.787 -30.948 1.00 0.44 C ATOM 186 C VAL A 829 -10.124 -20.262 -31.077 1.00 0.43 C ATOM 187 O VAL A 829 -9.475 -21.140 -30.493 1.00 0.43 O ATOM 188 CB VAL A 829 -8.251 -18.559 -31.261 1.00 0.52 C ATOM 189 CG1 VAL A 829 -7.395 -18.745 -30.017 1.00 0.97 C ATOM 190 CG2 VAL A 829 -7.772 -19.474 -32.383 1.00 1.06 C ATOM 0 H VAL A 829 -9.404 -18.493 -28.910 1.00 0.39 H new ATOM 0 HA VAL A 829 -10.316 -18.202 -31.679 1.00 0.44 H new ATOM 0 HB VAL A 829 -8.142 -17.528 -31.597 1.00 0.52 H new ATOM 0 HG11 VAL A 829 -6.347 -18.579 -30.268 1.00 0.97 H new ATOM 0 HG12 VAL A 829 -7.703 -18.031 -29.253 1.00 0.97 H new ATOM 0 HG13 VAL A 829 -7.521 -19.759 -29.637 1.00 0.97 H new ATOM 0 HG21 VAL A 829 -6.715 -19.289 -32.577 1.00 1.06 H new ATOM 0 HG22 VAL A 829 -7.911 -20.514 -32.088 1.00 1.06 H new ATOM 0 HG23 VAL A 829 -8.347 -19.273 -33.287 1.00 1.06 H new ATOM 200 N VAL A 830 -11.194 -20.524 -31.803 1.00 0.46 N ATOM 201 CA VAL A 830 -11.688 -21.878 -31.953 1.00 0.50 C ATOM 202 C VAL A 830 -11.444 -22.384 -33.362 1.00 0.61 C ATOM 203 O VAL A 830 -12.347 -22.372 -34.191 1.00 1.07 O ATOM 204 CB VAL A 830 -13.200 -21.980 -31.643 1.00 0.53 C ATOM 205 CG1 VAL A 830 -13.434 -22.814 -30.400 1.00 0.97 C ATOM 206 CG2 VAL A 830 -13.831 -20.605 -31.481 1.00 0.80 C ATOM 0 H VAL A 830 -11.737 -19.817 -32.298 1.00 0.46 H new ATOM 0 HA VAL A 830 -11.142 -22.492 -31.236 1.00 0.50 H new ATOM 0 HB VAL A 830 -13.677 -22.470 -32.492 1.00 0.53 H new ATOM 0 HG11 VAL A 830 -14.503 -22.874 -30.198 1.00 0.97 H new ATOM 0 HG12 VAL A 830 -13.037 -23.817 -30.555 1.00 0.97 H new ATOM 0 HG13 VAL A 830 -12.930 -22.351 -29.551 1.00 0.97 H new ATOM 0 HG21 VAL A 830 -14.893 -20.716 -31.264 1.00 0.80 H new ATOM 0 HG22 VAL A 830 -13.346 -20.077 -30.660 1.00 0.80 H new ATOM 0 HG23 VAL A 830 -13.706 -20.036 -32.403 1.00 0.80 H new ATOM 216 N ASP A 831 -10.232 -22.854 -33.611 1.00 0.36 N ATOM 217 CA ASP A 831 -9.862 -23.359 -34.932 1.00 0.37 C ATOM 218 C ASP A 831 -9.725 -24.863 -34.875 1.00 0.42 C ATOM 219 O ASP A 831 -8.982 -25.391 -34.043 1.00 0.52 O ATOM 220 CB ASP A 831 -8.547 -22.734 -35.420 1.00 0.44 C ATOM 221 CG ASP A 831 -8.160 -23.133 -36.848 1.00 0.64 C ATOM 222 OD1 ASP A 831 -8.635 -24.186 -37.314 1.00 1.27 O ATOM 223 OD2 ASP A 831 -7.396 -22.399 -37.515 1.00 1.30 O ATOM 0 H ASP A 831 -9.485 -22.898 -32.918 1.00 0.36 H new ATOM 0 HA ASP A 831 -10.647 -23.085 -35.637 1.00 0.37 H new ATOM 0 HB2 ASP A 831 -8.631 -21.649 -35.367 1.00 0.44 H new ATOM 0 HB3 ASP A 831 -7.745 -23.025 -34.742 1.00 0.44 H new ATOM 228 N ASP A 832 -10.449 -25.541 -35.758 1.00 0.48 N ATOM 229 CA ASP A 832 -10.435 -27.002 -35.828 1.00 0.61 C ATOM 230 C ASP A 832 -9.014 -27.542 -35.967 1.00 0.66 C ATOM 231 O ASP A 832 -8.672 -28.576 -35.388 1.00 0.98 O ATOM 232 CB ASP A 832 -11.289 -27.488 -37.005 1.00 0.78 C ATOM 233 CG ASP A 832 -10.878 -28.866 -37.499 1.00 1.21 C ATOM 234 OD1 ASP A 832 -11.330 -29.874 -36.914 1.00 1.51 O ATOM 235 OD2 ASP A 832 -10.104 -28.945 -38.476 1.00 2.03 O ATOM 0 H ASP A 832 -11.061 -25.098 -36.444 1.00 0.48 H new ATOM 0 HA ASP A 832 -10.854 -27.379 -34.895 1.00 0.61 H new ATOM 0 HB2 ASP A 832 -12.336 -27.512 -36.703 1.00 0.78 H new ATOM 0 HB3 ASP A 832 -11.210 -26.774 -37.825 1.00 0.78 H new ATOM 240 N HIS A 833 -8.183 -26.828 -36.712 1.00 0.61 N ATOM 241 CA HIS A 833 -6.835 -27.291 -37.000 1.00 0.74 C ATOM 242 C HIS A 833 -5.823 -26.595 -36.098 1.00 0.75 C ATOM 243 O HIS A 833 -5.549 -25.408 -36.264 1.00 1.20 O ATOM 244 CB HIS A 833 -6.494 -27.052 -38.470 1.00 0.93 C ATOM 245 CG HIS A 833 -6.529 -28.301 -39.294 1.00 1.10 C ATOM 246 ND1 HIS A 833 -7.664 -29.065 -39.458 1.00 1.87 N ATOM 247 CD2 HIS A 833 -5.556 -28.921 -40.001 1.00 1.47 C ATOM 248 CE1 HIS A 833 -7.388 -30.099 -40.227 1.00 2.12 C ATOM 249 NE2 HIS A 833 -6.116 -30.037 -40.572 1.00 1.84 N ATOM 0 H HIS A 833 -8.419 -25.927 -37.127 1.00 0.61 H new ATOM 0 HA HIS A 833 -6.789 -28.362 -36.802 1.00 0.74 H new ATOM 0 HB2 HIS A 833 -7.196 -26.330 -38.886 1.00 0.93 H new ATOM 0 HB3 HIS A 833 -5.501 -26.607 -38.538 1.00 0.93 H new ATOM 0 HD1 HIS A 833 -8.576 -28.862 -39.048 1.00 1.87 H new ATOM 0 HD2 HIS A 833 -4.530 -28.598 -40.098 1.00 1.47 H new ATOM 0 HE1 HIS A 833 -8.086 -30.868 -40.525 1.00 2.12 H new ATOM 258 N PRO A 834 -5.246 -27.342 -35.140 1.00 0.66 N ATOM 259 CA PRO A 834 -4.330 -26.797 -34.129 1.00 0.70 C ATOM 260 C PRO A 834 -3.173 -25.991 -34.722 1.00 0.62 C ATOM 261 O PRO A 834 -2.668 -25.072 -34.079 1.00 0.61 O ATOM 262 CB PRO A 834 -3.796 -28.038 -33.398 1.00 0.92 C ATOM 263 CG PRO A 834 -4.205 -29.204 -34.231 1.00 1.12 C ATOM 264 CD PRO A 834 -5.448 -28.785 -34.955 1.00 0.98 C ATOM 0 HA PRO A 834 -4.850 -26.092 -33.480 1.00 0.70 H new ATOM 0 HB2 PRO A 834 -2.712 -27.994 -33.292 1.00 0.92 H new ATOM 0 HB3 PRO A 834 -4.212 -28.110 -32.393 1.00 0.92 H new ATOM 0 HG2 PRO A 834 -3.418 -29.475 -34.934 1.00 1.12 H new ATOM 0 HG3 PRO A 834 -4.393 -30.080 -33.610 1.00 1.12 H new ATOM 0 HD2 PRO A 834 -5.556 -29.304 -35.908 1.00 0.98 H new ATOM 0 HD3 PRO A 834 -6.345 -28.997 -34.374 1.00 0.98 H new ATOM 272 N ILE A 835 -2.763 -26.325 -35.942 1.00 0.68 N ATOM 273 CA ILE A 835 -1.673 -25.610 -36.604 1.00 0.72 C ATOM 274 C ILE A 835 -2.049 -24.151 -36.882 1.00 0.61 C ATOM 275 O ILE A 835 -1.281 -23.229 -36.597 1.00 0.58 O ATOM 276 CB ILE A 835 -1.266 -26.291 -37.932 1.00 0.91 C ATOM 277 CG1 ILE A 835 -2.497 -26.784 -38.690 1.00 1.64 C ATOM 278 CG2 ILE A 835 -0.315 -27.447 -37.664 1.00 1.72 C ATOM 279 CD1 ILE A 835 -2.771 -26.019 -39.965 1.00 2.26 C ATOM 0 H ILE A 835 -3.166 -27.083 -36.492 1.00 0.68 H new ATOM 0 HA ILE A 835 -0.825 -25.637 -35.920 1.00 0.72 H new ATOM 0 HB ILE A 835 -0.756 -25.552 -38.551 1.00 0.91 H new ATOM 0 HG12 ILE A 835 -2.367 -27.839 -38.930 1.00 1.64 H new ATOM 0 HG13 ILE A 835 -3.368 -26.711 -38.038 1.00 1.64 H new ATOM 0 HG21 ILE A 835 -0.038 -27.916 -38.608 1.00 1.72 H new ATOM 0 HG22 ILE A 835 0.581 -27.074 -37.167 1.00 1.72 H new ATOM 0 HG23 ILE A 835 -0.805 -28.181 -37.024 1.00 1.72 H new ATOM 0 HD11 ILE A 835 -3.659 -26.425 -40.449 1.00 2.26 H new ATOM 0 HD12 ILE A 835 -2.934 -24.967 -39.730 1.00 2.26 H new ATOM 0 HD13 ILE A 835 -1.917 -26.113 -40.636 1.00 2.26 H new ATOM 291 N ASN A 836 -3.238 -23.934 -37.420 1.00 0.57 N ATOM 292 CA ASN A 836 -3.686 -22.581 -37.713 1.00 0.52 C ATOM 293 C ASN A 836 -4.276 -21.959 -36.459 1.00 0.42 C ATOM 294 O ASN A 836 -4.316 -20.741 -36.313 1.00 0.44 O ATOM 295 CB ASN A 836 -4.698 -22.574 -38.861 1.00 0.62 C ATOM 296 CG ASN A 836 -4.463 -21.432 -39.834 1.00 1.06 C ATOM 297 OD1 ASN A 836 -5.280 -20.521 -39.955 1.00 1.35 O ATOM 298 ND2 ASN A 836 -3.344 -21.471 -40.542 1.00 1.83 N ATOM 0 H ASN A 836 -3.904 -24.668 -37.661 1.00 0.57 H new ATOM 0 HA ASN A 836 -2.830 -21.986 -38.032 1.00 0.52 H new ATOM 0 HB2 ASN A 836 -4.642 -23.521 -39.397 1.00 0.62 H new ATOM 0 HB3 ASN A 836 -5.706 -22.498 -38.453 1.00 0.62 H new ATOM 0 HD21 ASN A 836 -3.139 -20.730 -41.212 1.00 1.83 H new ATOM 0 HD22 ASN A 836 -2.688 -22.242 -40.417 1.00 1.83 H new ATOM 305 N ARG A 837 -4.712 -22.820 -35.547 1.00 0.41 N ATOM 306 CA ARG A 837 -5.183 -22.393 -34.238 1.00 0.42 C ATOM 307 C ARG A 837 -4.072 -21.678 -33.476 1.00 0.38 C ATOM 308 O ARG A 837 -4.279 -20.590 -32.938 1.00 0.40 O ATOM 309 CB ARG A 837 -5.669 -23.599 -33.440 1.00 0.55 C ATOM 310 CG ARG A 837 -6.688 -23.255 -32.374 1.00 0.69 C ATOM 311 CD ARG A 837 -6.359 -23.942 -31.064 1.00 1.25 C ATOM 312 NE ARG A 837 -7.199 -25.115 -30.836 1.00 1.63 N ATOM 313 CZ ARG A 837 -6.796 -26.199 -30.173 1.00 2.06 C ATOM 314 NH1 ARG A 837 -5.543 -26.289 -29.752 1.00 2.44 N ATOM 315 NH2 ARG A 837 -7.641 -27.200 -29.956 1.00 2.78 N ATOM 0 H ARG A 837 -4.748 -23.829 -35.694 1.00 0.41 H new ATOM 0 HA ARG A 837 -6.011 -21.698 -34.377 1.00 0.42 H new ATOM 0 HB2 ARG A 837 -6.105 -24.325 -34.126 1.00 0.55 H new ATOM 0 HB3 ARG A 837 -4.812 -24.081 -32.969 1.00 0.55 H new ATOM 0 HG2 ARG A 837 -6.714 -22.175 -32.226 1.00 0.69 H new ATOM 0 HG3 ARG A 837 -7.682 -23.555 -32.706 1.00 0.69 H new ATOM 0 HD2 ARG A 837 -5.311 -24.241 -31.065 1.00 1.25 H new ATOM 0 HD3 ARG A 837 -6.489 -23.238 -30.242 1.00 1.25 H new ATOM 0 HE ARG A 837 -8.150 -25.104 -31.206 1.00 1.63 H new ATOM 0 HH11 ARG A 837 -4.888 -25.529 -29.935 1.00 2.44 H new ATOM 0 HH12 ARG A 837 -5.234 -27.118 -29.245 1.00 2.44 H new ATOM 0 HH21 ARG A 837 -8.601 -27.140 -30.297 1.00 2.78 H new ATOM 0 HH22 ARG A 837 -7.331 -28.029 -29.448 1.00 2.78 H new ATOM 329 N ARG A 838 -2.886 -22.286 -33.437 1.00 0.40 N ATOM 330 CA ARG A 838 -1.749 -21.668 -32.766 1.00 0.44 C ATOM 331 C ARG A 838 -1.284 -20.440 -33.536 1.00 0.37 C ATOM 332 O ARG A 838 -0.733 -19.510 -32.953 1.00 0.40 O ATOM 333 CB ARG A 838 -0.581 -22.651 -32.561 1.00 0.59 C ATOM 334 CG ARG A 838 -0.110 -23.366 -33.820 1.00 0.96 C ATOM 335 CD ARG A 838 0.900 -22.543 -34.610 1.00 0.87 C ATOM 336 NE ARG A 838 2.279 -22.828 -34.228 1.00 1.50 N ATOM 337 CZ ARG A 838 3.254 -23.076 -35.098 1.00 2.03 C ATOM 338 NH1 ARG A 838 2.991 -23.141 -36.396 1.00 2.49 N ATOM 339 NH2 ARG A 838 4.496 -23.255 -34.670 1.00 2.75 N ATOM 0 H ARG A 838 -2.691 -23.195 -33.857 1.00 0.40 H new ATOM 0 HA ARG A 838 -2.087 -21.364 -31.775 1.00 0.44 H new ATOM 0 HB2 ARG A 838 0.261 -22.106 -32.135 1.00 0.59 H new ATOM 0 HB3 ARG A 838 -0.881 -23.399 -31.827 1.00 0.59 H new ATOM 0 HG2 ARG A 838 0.338 -24.321 -33.546 1.00 0.96 H new ATOM 0 HG3 ARG A 838 -0.970 -23.587 -34.453 1.00 0.96 H new ATOM 0 HD2 ARG A 838 0.773 -22.743 -35.674 1.00 0.87 H new ATOM 0 HD3 ARG A 838 0.697 -21.483 -34.459 1.00 0.87 H new ATOM 0 HE ARG A 838 2.509 -22.838 -33.234 1.00 1.50 H new ATOM 0 HH11 ARG A 838 2.038 -23.001 -36.731 1.00 2.49 H new ATOM 0 HH12 ARG A 838 3.742 -23.331 -37.060 1.00 2.49 H new ATOM 0 HH21 ARG A 838 4.704 -23.203 -33.673 1.00 2.75 H new ATOM 0 HH22 ARG A 838 5.243 -23.445 -35.338 1.00 2.75 H new ATOM 353 N LEU A 839 -1.490 -20.450 -34.850 1.00 0.36 N ATOM 354 CA LEU A 839 -1.169 -19.292 -35.670 1.00 0.40 C ATOM 355 C LEU A 839 -2.026 -18.094 -35.262 1.00 0.34 C ATOM 356 O LEU A 839 -1.506 -17.013 -34.989 1.00 0.37 O ATOM 357 CB LEU A 839 -1.365 -19.610 -37.155 1.00 0.52 C ATOM 358 CG LEU A 839 -0.075 -19.694 -37.976 1.00 0.82 C ATOM 359 CD1 LEU A 839 -0.389 -20.000 -39.433 1.00 1.13 C ATOM 360 CD2 LEU A 839 0.714 -18.397 -37.864 1.00 1.14 C ATOM 0 H LEU A 839 -1.875 -21.242 -35.364 1.00 0.36 H new ATOM 0 HA LEU A 839 -0.121 -19.039 -35.510 1.00 0.40 H new ATOM 0 HB2 LEU A 839 -1.895 -20.559 -37.241 1.00 0.52 H new ATOM 0 HB3 LEU A 839 -2.007 -18.846 -37.593 1.00 0.52 H new ATOM 0 HG LEU A 839 0.534 -20.505 -37.576 1.00 0.82 H new ATOM 0 HD11 LEU A 839 0.539 -20.056 -40.001 1.00 1.13 H new ATOM 0 HD12 LEU A 839 -0.913 -20.953 -39.500 1.00 1.13 H new ATOM 0 HD13 LEU A 839 -1.018 -19.210 -39.843 1.00 1.13 H new ATOM 0 HD21 LEU A 839 1.627 -18.475 -38.454 1.00 1.14 H new ATOM 0 HD22 LEU A 839 0.110 -17.570 -38.238 1.00 1.14 H new ATOM 0 HD23 LEU A 839 0.970 -18.216 -36.820 1.00 1.14 H new ATOM 372 N LEU A 840 -3.334 -18.303 -35.197 1.00 0.35 N ATOM 373 CA LEU A 840 -4.264 -17.258 -34.781 1.00 0.42 C ATOM 374 C LEU A 840 -3.993 -16.837 -33.337 1.00 0.42 C ATOM 375 O LEU A 840 -4.099 -15.660 -32.989 1.00 0.47 O ATOM 376 CB LEU A 840 -5.706 -17.755 -34.928 1.00 0.55 C ATOM 377 CG LEU A 840 -6.792 -16.683 -34.780 1.00 0.86 C ATOM 378 CD1 LEU A 840 -6.466 -15.460 -35.626 1.00 1.43 C ATOM 379 CD2 LEU A 840 -8.151 -17.244 -35.170 1.00 1.10 C ATOM 0 H LEU A 840 -3.778 -19.192 -35.428 1.00 0.35 H new ATOM 0 HA LEU A 840 -4.120 -16.388 -35.422 1.00 0.42 H new ATOM 0 HB2 LEU A 840 -5.813 -18.223 -35.907 1.00 0.55 H new ATOM 0 HB3 LEU A 840 -5.882 -18.531 -34.183 1.00 0.55 H new ATOM 0 HG LEU A 840 -6.825 -16.378 -33.734 1.00 0.86 H new ATOM 0 HD11 LEU A 840 -7.251 -14.714 -35.504 1.00 1.43 H new ATOM 0 HD12 LEU A 840 -5.513 -15.040 -35.306 1.00 1.43 H new ATOM 0 HD13 LEU A 840 -6.401 -15.750 -36.675 1.00 1.43 H new ATOM 0 HD21 LEU A 840 -8.910 -16.469 -35.059 1.00 1.10 H new ATOM 0 HD22 LEU A 840 -8.123 -17.578 -36.207 1.00 1.10 H new ATOM 0 HD23 LEU A 840 -8.396 -18.087 -34.524 1.00 1.10 H new ATOM 391 N ALA A 841 -3.629 -17.805 -32.503 1.00 0.42 N ATOM 392 CA ALA A 841 -3.289 -17.544 -31.109 1.00 0.50 C ATOM 393 C ALA A 841 -2.017 -16.708 -30.996 1.00 0.46 C ATOM 394 O ALA A 841 -1.837 -15.965 -30.032 1.00 0.49 O ATOM 395 CB ALA A 841 -3.130 -18.856 -30.355 1.00 0.60 C ATOM 0 H ALA A 841 -3.562 -18.787 -32.772 1.00 0.42 H new ATOM 0 HA ALA A 841 -4.104 -16.974 -30.663 1.00 0.50 H new ATOM 0 HB1 ALA A 841 -2.876 -18.650 -29.315 1.00 0.60 H new ATOM 0 HB2 ALA A 841 -4.065 -19.415 -30.396 1.00 0.60 H new ATOM 0 HB3 ALA A 841 -2.335 -19.445 -30.813 1.00 0.60 H new ATOM 401 N ASP A 842 -1.137 -16.831 -31.983 1.00 0.43 N ATOM 402 CA ASP A 842 0.093 -16.046 -32.010 1.00 0.45 C ATOM 403 C ASP A 842 -0.214 -14.600 -32.365 1.00 0.40 C ATOM 404 O ASP A 842 0.340 -13.676 -31.769 1.00 0.42 O ATOM 405 CB ASP A 842 1.091 -16.625 -33.013 1.00 0.52 C ATOM 406 CG ASP A 842 2.451 -15.963 -32.912 1.00 0.82 C ATOM 407 OD1 ASP A 842 3.115 -16.118 -31.863 1.00 1.27 O ATOM 408 OD2 ASP A 842 2.868 -15.295 -33.882 1.00 1.34 O ATOM 0 H ASP A 842 -1.251 -17.465 -32.774 1.00 0.43 H new ATOM 0 HA ASP A 842 0.540 -16.085 -31.017 1.00 0.45 H new ATOM 0 HB2 ASP A 842 1.196 -17.696 -32.842 1.00 0.52 H new ATOM 0 HB3 ASP A 842 0.702 -16.501 -34.024 1.00 0.52 H new ATOM 413 N GLN A 843 -1.108 -14.414 -33.333 1.00 0.38 N ATOM 414 CA GLN A 843 -1.582 -13.084 -33.700 1.00 0.39 C ATOM 415 C GLN A 843 -2.299 -12.445 -32.514 1.00 0.36 C ATOM 416 O GLN A 843 -2.171 -11.246 -32.254 1.00 0.38 O ATOM 417 CB GLN A 843 -2.525 -13.165 -34.905 1.00 0.44 C ATOM 418 CG GLN A 843 -1.813 -13.107 -36.248 1.00 0.56 C ATOM 419 CD GLN A 843 -1.527 -14.479 -36.822 1.00 1.11 C ATOM 420 OE1 GLN A 843 -2.422 -15.155 -37.327 1.00 1.85 O ATOM 421 NE2 GLN A 843 -0.274 -14.901 -36.750 1.00 1.64 N ATOM 0 H GLN A 843 -1.519 -15.171 -33.879 1.00 0.38 H new ATOM 0 HA GLN A 843 -0.725 -12.469 -33.973 1.00 0.39 H new ATOM 0 HB2 GLN A 843 -3.095 -14.092 -34.846 1.00 0.44 H new ATOM 0 HB3 GLN A 843 -3.242 -12.346 -34.849 1.00 0.44 H new ATOM 0 HG2 GLN A 843 -2.424 -12.543 -36.953 1.00 0.56 H new ATOM 0 HG3 GLN A 843 -0.875 -12.564 -36.133 1.00 0.56 H new ATOM 0 HE21 GLN A 843 0.439 -14.310 -36.323 1.00 1.64 H new ATOM 0 HE22 GLN A 843 -0.022 -15.817 -37.121 1.00 1.64 H new ATOM 430 N LEU A 844 -3.046 -13.268 -31.789 1.00 0.35 N ATOM 431 CA LEU A 844 -3.690 -12.848 -30.553 1.00 0.37 C ATOM 432 C LEU A 844 -2.635 -12.426 -29.533 1.00 0.38 C ATOM 433 O LEU A 844 -2.821 -11.470 -28.777 1.00 0.40 O ATOM 434 CB LEU A 844 -4.536 -13.998 -29.999 1.00 0.43 C ATOM 435 CG LEU A 844 -5.902 -13.602 -29.429 1.00 0.59 C ATOM 436 CD1 LEU A 844 -5.751 -12.910 -28.083 1.00 1.08 C ATOM 437 CD2 LEU A 844 -6.654 -12.715 -30.409 1.00 1.24 C ATOM 0 H LEU A 844 -3.221 -14.241 -32.040 1.00 0.35 H new ATOM 0 HA LEU A 844 -4.339 -11.996 -30.755 1.00 0.37 H new ATOM 0 HB2 LEU A 844 -4.692 -14.726 -30.795 1.00 0.43 H new ATOM 0 HB3 LEU A 844 -3.967 -14.499 -29.216 1.00 0.43 H new ATOM 0 HG LEU A 844 -6.481 -14.512 -29.276 1.00 0.59 H new ATOM 0 HD11 LEU A 844 -6.735 -12.639 -27.701 1.00 1.08 H new ATOM 0 HD12 LEU A 844 -5.261 -13.584 -27.380 1.00 1.08 H new ATOM 0 HD13 LEU A 844 -5.148 -12.010 -28.202 1.00 1.08 H new ATOM 0 HD21 LEU A 844 -7.622 -12.444 -29.986 1.00 1.24 H new ATOM 0 HD22 LEU A 844 -6.075 -11.811 -30.599 1.00 1.24 H new ATOM 0 HD23 LEU A 844 -6.805 -13.253 -31.345 1.00 1.24 H new ATOM 449 N GLY A 845 -1.526 -13.149 -29.531 1.00 0.42 N ATOM 450 CA GLY A 845 -0.398 -12.800 -28.689 1.00 0.49 C ATOM 451 C GLY A 845 0.186 -11.443 -29.038 1.00 0.47 C ATOM 452 O GLY A 845 0.681 -10.730 -28.163 1.00 0.52 O ATOM 0 H GLY A 845 -1.385 -13.981 -30.104 1.00 0.42 H new ATOM 0 HA2 GLY A 845 -0.713 -12.799 -27.646 1.00 0.49 H new ATOM 0 HA3 GLY A 845 0.375 -13.562 -28.788 1.00 0.49 H new ATOM 456 N SER A 846 0.140 -11.087 -30.319 1.00 0.47 N ATOM 457 CA SER A 846 0.596 -9.777 -30.767 1.00 0.52 C ATOM 458 C SER A 846 -0.334 -8.682 -30.250 1.00 0.46 C ATOM 459 O SER A 846 0.090 -7.547 -30.022 1.00 0.52 O ATOM 460 CB SER A 846 0.675 -9.734 -32.296 1.00 0.62 C ATOM 461 OG SER A 846 1.234 -10.935 -32.803 1.00 0.70 O ATOM 0 H SER A 846 -0.209 -11.689 -31.065 1.00 0.47 H new ATOM 0 HA SER A 846 1.593 -9.601 -30.363 1.00 0.52 H new ATOM 0 HB2 SER A 846 -0.321 -9.587 -32.713 1.00 0.62 H new ATOM 0 HB3 SER A 846 1.281 -8.884 -32.610 1.00 0.62 H new ATOM 0 HG SER A 846 1.275 -10.889 -33.781 1.00 0.70 H new ATOM 467 N LEU A 847 -1.602 -9.029 -30.070 1.00 0.42 N ATOM 468 CA LEU A 847 -2.567 -8.118 -29.466 1.00 0.47 C ATOM 469 C LEU A 847 -2.279 -7.959 -27.977 1.00 0.46 C ATOM 470 O LEU A 847 -2.291 -6.850 -27.445 1.00 0.56 O ATOM 471 CB LEU A 847 -3.991 -8.644 -29.663 1.00 0.56 C ATOM 472 CG LEU A 847 -4.969 -7.681 -30.344 1.00 0.74 C ATOM 473 CD1 LEU A 847 -6.397 -8.013 -29.945 1.00 1.36 C ATOM 474 CD2 LEU A 847 -4.650 -6.232 -30.000 1.00 1.56 C ATOM 0 H LEU A 847 -1.987 -9.936 -30.334 1.00 0.42 H new ATOM 0 HA LEU A 847 -2.478 -7.147 -29.953 1.00 0.47 H new ATOM 0 HB2 LEU A 847 -3.942 -9.559 -30.253 1.00 0.56 H new ATOM 0 HB3 LEU A 847 -4.396 -8.915 -28.688 1.00 0.56 H new ATOM 0 HG LEU A 847 -4.863 -7.802 -31.422 1.00 0.74 H new ATOM 0 HD11 LEU A 847 -7.082 -7.321 -30.436 1.00 1.36 H new ATOM 0 HD12 LEU A 847 -6.632 -9.033 -30.249 1.00 1.36 H new ATOM 0 HD13 LEU A 847 -6.503 -7.923 -28.864 1.00 1.36 H new ATOM 0 HD21 LEU A 847 -5.362 -5.574 -30.499 1.00 1.56 H new ATOM 0 HD22 LEU A 847 -4.719 -6.090 -28.921 1.00 1.56 H new ATOM 0 HD23 LEU A 847 -3.640 -5.993 -30.333 1.00 1.56 H new ATOM 486 N GLY A 848 -2.024 -9.080 -27.315 1.00 0.43 N ATOM 487 CA GLY A 848 -1.710 -9.054 -25.899 1.00 0.48 C ATOM 488 C GLY A 848 -2.940 -9.210 -25.031 1.00 0.48 C ATOM 489 O GLY A 848 -2.955 -8.778 -23.877 1.00 0.62 O ATOM 0 H GLY A 848 -2.029 -10.010 -27.735 1.00 0.43 H new ATOM 0 HA2 GLY A 848 -1.005 -9.853 -25.672 1.00 0.48 H new ATOM 0 HA3 GLY A 848 -1.215 -8.114 -25.657 1.00 0.48 H new ATOM 493 N TYR A 849 -3.974 -9.830 -25.585 1.00 0.42 N ATOM 494 CA TYR A 849 -5.219 -10.043 -24.856 1.00 0.46 C ATOM 495 C TYR A 849 -5.316 -11.490 -24.386 1.00 0.45 C ATOM 496 O TYR A 849 -4.458 -12.310 -24.715 1.00 0.51 O ATOM 497 CB TYR A 849 -6.422 -9.696 -25.735 1.00 0.53 C ATOM 498 CG TYR A 849 -6.769 -8.224 -25.736 1.00 0.63 C ATOM 499 CD1 TYR A 849 -5.885 -7.280 -26.244 1.00 1.07 C ATOM 500 CD2 TYR A 849 -7.983 -7.778 -25.227 1.00 0.93 C ATOM 501 CE1 TYR A 849 -6.197 -5.936 -26.242 1.00 1.20 C ATOM 502 CE2 TYR A 849 -8.303 -6.434 -25.223 1.00 1.09 C ATOM 503 CZ TYR A 849 -7.408 -5.517 -25.733 1.00 1.00 C ATOM 504 OH TYR A 849 -7.724 -4.178 -25.728 1.00 1.22 O ATOM 0 H TYR A 849 -3.976 -10.195 -26.538 1.00 0.42 H new ATOM 0 HA TYR A 849 -5.223 -9.388 -23.985 1.00 0.46 H new ATOM 0 HB2 TYR A 849 -6.217 -10.013 -26.758 1.00 0.53 H new ATOM 0 HB3 TYR A 849 -7.287 -10.264 -25.393 1.00 0.53 H new ATOM 0 HD1 TYR A 849 -4.937 -7.604 -26.647 1.00 1.07 H new ATOM 0 HD2 TYR A 849 -8.687 -8.493 -24.828 1.00 0.93 H new ATOM 0 HE1 TYR A 849 -5.496 -5.216 -26.637 1.00 1.20 H new ATOM 0 HE2 TYR A 849 -9.250 -6.103 -24.822 1.00 1.09 H new ATOM 0 HH TYR A 849 -8.614 -4.053 -25.336 1.00 1.22 H new ATOM 514 N GLN A 850 -6.363 -11.799 -23.625 1.00 0.47 N ATOM 515 CA GLN A 850 -6.559 -13.145 -23.102 1.00 0.49 C ATOM 516 C GLN A 850 -6.837 -14.118 -24.232 1.00 0.45 C ATOM 517 O GLN A 850 -7.770 -13.930 -25.011 1.00 0.51 O ATOM 518 CB GLN A 850 -7.705 -13.164 -22.098 1.00 0.59 C ATOM 519 CG GLN A 850 -7.240 -13.063 -20.660 1.00 0.97 C ATOM 520 CD GLN A 850 -6.917 -14.414 -20.060 1.00 1.66 C ATOM 521 OE1 GLN A 850 -6.486 -15.333 -20.759 1.00 2.38 O ATOM 522 NE2 GLN A 850 -7.131 -14.547 -18.766 1.00 2.17 N ATOM 0 H GLN A 850 -7.088 -11.134 -23.358 1.00 0.47 H new ATOM 0 HA GLN A 850 -5.645 -13.453 -22.594 1.00 0.49 H new ATOM 0 HB2 GLN A 850 -8.382 -12.337 -22.313 1.00 0.59 H new ATOM 0 HB3 GLN A 850 -8.275 -14.084 -22.225 1.00 0.59 H new ATOM 0 HG2 GLN A 850 -6.356 -12.427 -20.611 1.00 0.97 H new ATOM 0 HG3 GLN A 850 -8.014 -12.580 -20.064 1.00 0.97 H new ATOM 0 HE21 GLN A 850 -7.489 -13.760 -18.225 1.00 2.17 H new ATOM 0 HE22 GLN A 850 -6.939 -15.437 -18.306 1.00 2.17 H new ATOM 531 N CYS A 851 -6.029 -15.158 -24.310 1.00 0.45 N ATOM 532 CA CYS A 851 -6.110 -16.101 -25.411 1.00 0.47 C ATOM 533 C CYS A 851 -6.588 -17.467 -24.931 1.00 0.41 C ATOM 534 O CYS A 851 -5.897 -18.149 -24.173 1.00 0.51 O ATOM 535 CB CYS A 851 -4.745 -16.226 -26.092 1.00 0.61 C ATOM 536 SG CYS A 851 -3.481 -15.121 -25.417 1.00 0.94 S ATOM 0 H CYS A 851 -5.307 -15.372 -23.622 1.00 0.45 H new ATOM 0 HA CYS A 851 -6.837 -15.725 -26.131 1.00 0.47 H new ATOM 0 HB2 CYS A 851 -4.398 -17.256 -26.002 1.00 0.61 H new ATOM 0 HB3 CYS A 851 -4.861 -16.021 -27.156 1.00 0.61 H new ATOM 0 HG CYS A 851 -4.005 -13.955 -25.180 1.00 0.94 H new ATOM 542 N LYS A 852 -7.781 -17.850 -25.357 1.00 0.34 N ATOM 543 CA LYS A 852 -8.329 -19.160 -25.032 1.00 0.34 C ATOM 544 C LYS A 852 -8.401 -20.009 -26.297 1.00 0.31 C ATOM 545 O LYS A 852 -8.946 -19.569 -27.308 1.00 0.33 O ATOM 546 CB LYS A 852 -9.720 -19.011 -24.405 1.00 0.40 C ATOM 547 CG LYS A 852 -9.710 -18.948 -22.880 1.00 0.66 C ATOM 548 CD LYS A 852 -9.018 -17.692 -22.368 1.00 0.56 C ATOM 549 CE LYS A 852 -8.627 -17.825 -20.904 1.00 0.88 C ATOM 550 NZ LYS A 852 -9.810 -17.789 -20.001 1.00 1.44 N ATOM 0 H LYS A 852 -8.392 -17.270 -25.932 1.00 0.34 H new ATOM 0 HA LYS A 852 -7.679 -19.654 -24.309 1.00 0.34 H new ATOM 0 HB2 LYS A 852 -10.187 -18.106 -24.793 1.00 0.40 H new ATOM 0 HB3 LYS A 852 -10.341 -19.850 -24.720 1.00 0.40 H new ATOM 0 HG2 LYS A 852 -10.735 -18.975 -22.509 1.00 0.66 H new ATOM 0 HG3 LYS A 852 -9.204 -19.828 -22.484 1.00 0.66 H new ATOM 0 HD2 LYS A 852 -8.128 -17.497 -22.966 1.00 0.56 H new ATOM 0 HD3 LYS A 852 -9.680 -16.835 -22.492 1.00 0.56 H new ATOM 0 HE2 LYS A 852 -8.088 -18.761 -20.757 1.00 0.88 H new ATOM 0 HE3 LYS A 852 -7.944 -17.019 -20.637 1.00 0.88 H new ATOM 0 HZ1 LYS A 852 -9.818 -16.892 -19.474 1.00 1.44 H new ATOM 0 HZ2 LYS A 852 -10.680 -17.866 -20.565 1.00 1.44 H new ATOM 0 HZ3 LYS A 852 -9.760 -18.583 -19.331 1.00 1.44 H new ATOM 564 N THR A 853 -7.839 -21.208 -26.251 1.00 0.33 N ATOM 565 CA THR A 853 -7.741 -22.049 -27.436 1.00 0.34 C ATOM 566 C THR A 853 -8.726 -23.221 -27.401 1.00 0.34 C ATOM 567 O THR A 853 -8.844 -23.914 -26.387 1.00 0.44 O ATOM 568 CB THR A 853 -6.310 -22.594 -27.589 1.00 0.46 C ATOM 569 OG1 THR A 853 -5.677 -22.687 -26.303 1.00 0.62 O ATOM 570 CG2 THR A 853 -5.488 -21.694 -28.494 1.00 0.61 C ATOM 0 H THR A 853 -7.444 -21.621 -25.406 1.00 0.33 H new ATOM 0 HA THR A 853 -7.995 -21.421 -28.290 1.00 0.34 H new ATOM 0 HB THR A 853 -6.369 -23.586 -28.037 1.00 0.46 H new ATOM 0 HG1 THR A 853 -4.768 -23.036 -26.410 1.00 0.62 H new ATOM 0 HG21 THR A 853 -4.480 -22.097 -28.589 1.00 0.61 H new ATOM 0 HG22 THR A 853 -5.954 -21.645 -29.478 1.00 0.61 H new ATOM 0 HG23 THR A 853 -5.440 -20.693 -28.065 1.00 0.61 H new ATOM 578 N ALA A 854 -9.419 -23.441 -28.518 1.00 0.32 N ATOM 579 CA ALA A 854 -10.346 -24.565 -28.661 1.00 0.37 C ATOM 580 C ALA A 854 -10.551 -24.869 -30.145 1.00 0.34 C ATOM 581 O ALA A 854 -9.858 -24.289 -30.985 1.00 0.35 O ATOM 582 CB ALA A 854 -11.668 -24.263 -27.970 1.00 0.47 C ATOM 0 H ALA A 854 -9.355 -22.849 -29.346 1.00 0.32 H new ATOM 0 HA ALA A 854 -9.922 -25.446 -28.180 1.00 0.37 H new ATOM 0 HB1 ALA A 854 -12.342 -25.111 -28.088 1.00 0.47 H new ATOM 0 HB2 ALA A 854 -11.492 -24.085 -26.909 1.00 0.47 H new ATOM 0 HB3 ALA A 854 -12.118 -23.377 -28.417 1.00 0.47 H new ATOM 588 N ASN A 855 -11.484 -25.761 -30.489 1.00 0.36 N ATOM 589 CA ASN A 855 -11.672 -26.133 -31.895 1.00 0.43 C ATOM 590 C ASN A 855 -13.074 -26.679 -32.185 1.00 0.44 C ATOM 591 O ASN A 855 -13.249 -27.881 -32.369 1.00 0.53 O ATOM 592 CB ASN A 855 -10.604 -27.156 -32.329 1.00 0.54 C ATOM 593 CG ASN A 855 -10.620 -28.443 -31.525 1.00 1.11 C ATOM 594 OD1 ASN A 855 -10.295 -28.456 -30.339 1.00 1.90 O ATOM 595 ND2 ASN A 855 -11.000 -29.535 -32.170 1.00 1.75 N ATOM 0 H ASN A 855 -12.108 -26.230 -29.832 1.00 0.36 H new ATOM 0 HA ASN A 855 -11.560 -25.218 -32.477 1.00 0.43 H new ATOM 0 HB2 ASN A 855 -10.752 -27.396 -33.382 1.00 0.54 H new ATOM 0 HB3 ASN A 855 -9.619 -26.697 -32.242 1.00 0.54 H new ATOM 0 HD21 ASN A 855 -11.031 -30.430 -31.683 1.00 1.75 H new ATOM 0 HD22 ASN A 855 -11.262 -29.481 -33.154 1.00 1.75 H new ATOM 602 N ASP A 856 -14.057 -25.774 -32.238 1.00 0.43 N ATOM 603 CA ASP A 856 -15.438 -26.099 -32.639 1.00 0.47 C ATOM 604 C ASP A 856 -16.364 -24.973 -32.223 1.00 0.49 C ATOM 605 O ASP A 856 -16.016 -24.164 -31.371 1.00 0.60 O ATOM 606 CB ASP A 856 -15.939 -27.403 -32.001 1.00 0.51 C ATOM 607 CG ASP A 856 -16.992 -28.121 -32.829 1.00 0.80 C ATOM 608 OD1 ASP A 856 -17.859 -27.432 -33.402 1.00 1.01 O ATOM 609 OD2 ASP A 856 -16.932 -29.367 -32.939 1.00 1.45 O ATOM 0 H ASP A 856 -13.921 -24.791 -32.004 1.00 0.43 H new ATOM 0 HA ASP A 856 -15.438 -26.227 -33.721 1.00 0.47 H new ATOM 0 HB2 ASP A 856 -15.092 -28.071 -31.848 1.00 0.51 H new ATOM 0 HB3 ASP A 856 -16.352 -27.181 -31.017 1.00 0.51 H new ATOM 614 N GLY A 857 -17.540 -24.930 -32.813 1.00 0.53 N ATOM 615 CA GLY A 857 -18.544 -23.995 -32.376 1.00 0.58 C ATOM 616 C GLY A 857 -19.276 -24.536 -31.175 1.00 0.54 C ATOM 617 O GLY A 857 -19.633 -23.794 -30.261 1.00 0.57 O ATOM 0 H GLY A 857 -17.819 -25.529 -33.590 1.00 0.53 H new ATOM 0 HA2 GLY A 857 -18.079 -23.041 -32.127 1.00 0.58 H new ATOM 0 HA3 GLY A 857 -19.249 -23.804 -33.185 1.00 0.58 H new ATOM 621 N VAL A 858 -19.480 -25.848 -31.163 1.00 0.52 N ATOM 622 CA VAL A 858 -20.093 -26.503 -30.023 1.00 0.52 C ATOM 623 C VAL A 858 -19.107 -26.564 -28.860 1.00 0.50 C ATOM 624 O VAL A 858 -19.497 -26.507 -27.696 1.00 0.54 O ATOM 625 CB VAL A 858 -20.618 -27.915 -30.372 1.00 0.55 C ATOM 626 CG1 VAL A 858 -21.537 -27.853 -31.584 1.00 0.72 C ATOM 627 CG2 VAL A 858 -19.482 -28.898 -30.613 1.00 0.95 C ATOM 0 H VAL A 858 -19.230 -26.474 -31.929 1.00 0.52 H new ATOM 0 HA VAL A 858 -20.957 -25.908 -29.727 1.00 0.52 H new ATOM 0 HB VAL A 858 -21.185 -28.277 -29.515 1.00 0.55 H new ATOM 0 HG11 VAL A 858 -21.899 -28.854 -31.818 1.00 0.72 H new ATOM 0 HG12 VAL A 858 -22.384 -27.203 -31.365 1.00 0.72 H new ATOM 0 HG13 VAL A 858 -20.987 -27.457 -32.438 1.00 0.72 H new ATOM 0 HG21 VAL A 858 -19.894 -29.878 -30.855 1.00 0.95 H new ATOM 0 HG22 VAL A 858 -18.867 -28.548 -31.442 1.00 0.95 H new ATOM 0 HG23 VAL A 858 -18.870 -28.974 -29.714 1.00 0.95 H new ATOM 637 N ASP A 859 -17.819 -26.657 -29.183 1.00 0.47 N ATOM 638 CA ASP A 859 -16.778 -26.619 -28.168 1.00 0.49 C ATOM 639 C ASP A 859 -16.583 -25.192 -27.689 1.00 0.45 C ATOM 640 O ASP A 859 -16.129 -24.957 -26.573 1.00 0.46 O ATOM 641 CB ASP A 859 -15.461 -27.172 -28.710 1.00 0.55 C ATOM 642 CG ASP A 859 -14.584 -27.755 -27.622 1.00 0.64 C ATOM 643 OD1 ASP A 859 -15.120 -28.444 -26.724 1.00 0.75 O ATOM 644 OD2 ASP A 859 -13.353 -27.542 -27.667 1.00 0.84 O ATOM 0 H ASP A 859 -17.475 -26.759 -30.138 1.00 0.47 H new ATOM 0 HA ASP A 859 -17.090 -27.245 -27.332 1.00 0.49 H new ATOM 0 HB2 ASP A 859 -15.672 -27.941 -29.453 1.00 0.55 H new ATOM 0 HB3 ASP A 859 -14.919 -26.376 -29.221 1.00 0.55 H new ATOM 649 N ALA A 860 -16.944 -24.239 -28.543 1.00 0.45 N ATOM 650 CA ALA A 860 -16.880 -22.828 -28.192 1.00 0.47 C ATOM 651 C ALA A 860 -17.861 -22.512 -27.075 1.00 0.49 C ATOM 652 O ALA A 860 -17.506 -21.865 -26.096 1.00 0.51 O ATOM 653 CB ALA A 860 -17.162 -21.956 -29.407 1.00 0.51 C ATOM 0 H ALA A 860 -17.285 -24.422 -29.487 1.00 0.45 H new ATOM 0 HA ALA A 860 -15.871 -22.611 -27.841 1.00 0.47 H new ATOM 0 HB1 ALA A 860 -17.109 -20.905 -29.121 1.00 0.51 H new ATOM 0 HB2 ALA A 860 -16.422 -22.159 -30.181 1.00 0.51 H new ATOM 0 HB3 ALA A 860 -18.158 -22.178 -29.791 1.00 0.51 H new ATOM 659 N LEU A 861 -19.095 -22.984 -27.216 1.00 0.55 N ATOM 660 CA LEU A 861 -20.106 -22.757 -26.190 1.00 0.66 C ATOM 661 C LEU A 861 -19.837 -23.629 -24.966 1.00 0.59 C ATOM 662 O LEU A 861 -20.212 -23.277 -23.848 1.00 0.60 O ATOM 663 CB LEU A 861 -21.518 -23.005 -26.736 1.00 0.87 C ATOM 664 CG LEU A 861 -21.746 -24.345 -27.439 1.00 0.85 C ATOM 665 CD1 LEU A 861 -22.506 -25.303 -26.532 1.00 1.85 C ATOM 666 CD2 LEU A 861 -22.500 -24.133 -28.743 1.00 1.19 C ATOM 0 H LEU A 861 -19.417 -23.520 -28.022 1.00 0.55 H new ATOM 0 HA LEU A 861 -20.046 -21.712 -25.887 1.00 0.66 H new ATOM 0 HB2 LEU A 861 -22.223 -22.928 -25.909 1.00 0.87 H new ATOM 0 HB3 LEU A 861 -21.760 -22.205 -27.436 1.00 0.87 H new ATOM 0 HG LEU A 861 -20.776 -24.787 -27.666 1.00 0.85 H new ATOM 0 HD11 LEU A 861 -22.658 -26.250 -27.049 1.00 1.85 H new ATOM 0 HD12 LEU A 861 -21.932 -25.475 -25.622 1.00 1.85 H new ATOM 0 HD13 LEU A 861 -23.473 -24.870 -26.275 1.00 1.85 H new ATOM 0 HD21 LEU A 861 -22.656 -25.094 -29.234 1.00 1.19 H new ATOM 0 HD22 LEU A 861 -23.465 -23.671 -28.534 1.00 1.19 H new ATOM 0 HD23 LEU A 861 -21.920 -23.482 -29.397 1.00 1.19 H new ATOM 678 N ASN A 862 -19.181 -24.761 -25.184 1.00 0.58 N ATOM 679 CA ASN A 862 -18.778 -25.641 -24.088 1.00 0.59 C ATOM 680 C ASN A 862 -17.753 -24.940 -23.197 1.00 0.53 C ATOM 681 O ASN A 862 -17.957 -24.789 -21.987 1.00 0.55 O ATOM 682 CB ASN A 862 -18.202 -26.951 -24.649 1.00 0.66 C ATOM 683 CG ASN A 862 -17.347 -27.719 -23.650 1.00 1.02 C ATOM 684 OD1 ASN A 862 -17.694 -27.845 -22.474 1.00 1.21 O ATOM 685 ND2 ASN A 862 -16.221 -28.244 -24.114 1.00 1.72 N ATOM 0 H ASN A 862 -18.915 -25.094 -26.110 1.00 0.58 H new ATOM 0 HA ASN A 862 -19.654 -25.878 -23.483 1.00 0.59 H new ATOM 0 HB2 ASN A 862 -19.023 -27.588 -24.977 1.00 0.66 H new ATOM 0 HB3 ASN A 862 -17.602 -26.726 -25.531 1.00 0.66 H new ATOM 0 HD21 ASN A 862 -15.610 -28.773 -23.491 1.00 1.72 H new ATOM 0 HD22 ASN A 862 -15.966 -28.119 -25.094 1.00 1.72 H new ATOM 692 N VAL A 863 -16.666 -24.484 -23.805 1.00 0.48 N ATOM 693 CA VAL A 863 -15.623 -23.782 -23.076 1.00 0.48 C ATOM 694 C VAL A 863 -16.149 -22.455 -22.534 1.00 0.47 C ATOM 695 O VAL A 863 -15.715 -21.995 -21.486 1.00 0.50 O ATOM 696 CB VAL A 863 -14.356 -23.561 -23.941 1.00 0.51 C ATOM 697 CG1 VAL A 863 -14.548 -22.438 -24.948 1.00 0.81 C ATOM 698 CG2 VAL A 863 -13.143 -23.296 -23.059 1.00 0.89 C ATOM 0 H VAL A 863 -16.485 -24.589 -24.803 1.00 0.48 H new ATOM 0 HA VAL A 863 -15.331 -24.412 -22.236 1.00 0.48 H new ATOM 0 HB VAL A 863 -14.181 -24.477 -24.506 1.00 0.51 H new ATOM 0 HG11 VAL A 863 -13.637 -22.315 -25.534 1.00 0.81 H new ATOM 0 HG12 VAL A 863 -15.377 -22.683 -25.612 1.00 0.81 H new ATOM 0 HG13 VAL A 863 -14.768 -21.510 -24.420 1.00 0.81 H new ATOM 0 HG21 VAL A 863 -12.264 -23.144 -23.685 1.00 0.89 H new ATOM 0 HG22 VAL A 863 -13.319 -22.404 -22.457 1.00 0.89 H new ATOM 0 HG23 VAL A 863 -12.977 -24.150 -22.403 1.00 0.89 H new ATOM 708 N LEU A 864 -17.096 -21.854 -23.254 1.00 0.46 N ATOM 709 CA LEU A 864 -17.735 -20.615 -22.818 1.00 0.50 C ATOM 710 C LEU A 864 -18.586 -20.842 -21.571 1.00 0.55 C ATOM 711 O LEU A 864 -18.729 -19.950 -20.736 1.00 0.59 O ATOM 712 CB LEU A 864 -18.607 -20.037 -23.932 1.00 0.54 C ATOM 713 CG LEU A 864 -18.360 -18.564 -24.250 1.00 0.79 C ATOM 714 CD1 LEU A 864 -18.415 -18.326 -25.750 1.00 1.66 C ATOM 715 CD2 LEU A 864 -19.376 -17.692 -23.532 1.00 1.06 C ATOM 0 H LEU A 864 -17.438 -22.209 -24.147 1.00 0.46 H new ATOM 0 HA LEU A 864 -16.943 -19.906 -22.577 1.00 0.50 H new ATOM 0 HB2 LEU A 864 -18.445 -20.620 -24.838 1.00 0.54 H new ATOM 0 HB3 LEU A 864 -19.654 -20.162 -23.655 1.00 0.54 H new ATOM 0 HG LEU A 864 -17.364 -18.295 -23.898 1.00 0.79 H new ATOM 0 HD11 LEU A 864 -18.237 -17.271 -25.958 1.00 1.66 H new ATOM 0 HD12 LEU A 864 -17.650 -18.927 -26.242 1.00 1.66 H new ATOM 0 HD13 LEU A 864 -19.398 -18.609 -26.128 1.00 1.66 H new ATOM 0 HD21 LEU A 864 -19.188 -16.645 -23.768 1.00 1.06 H new ATOM 0 HD22 LEU A 864 -20.381 -17.962 -23.856 1.00 1.06 H new ATOM 0 HD23 LEU A 864 -19.289 -17.843 -22.456 1.00 1.06 H new ATOM 727 N SER A 865 -19.166 -22.031 -21.460 1.00 0.58 N ATOM 728 CA SER A 865 -19.953 -22.384 -20.289 1.00 0.67 C ATOM 729 C SER A 865 -19.052 -22.468 -19.063 1.00 0.66 C ATOM 730 O SER A 865 -19.466 -22.141 -17.952 1.00 0.77 O ATOM 731 CB SER A 865 -20.684 -23.712 -20.508 1.00 0.75 C ATOM 732 OG SER A 865 -21.622 -23.606 -21.566 1.00 0.82 O ATOM 0 H SER A 865 -19.105 -22.765 -22.166 1.00 0.58 H new ATOM 0 HA SER A 865 -20.701 -21.608 -20.125 1.00 0.67 H new ATOM 0 HB2 SER A 865 -19.962 -24.496 -20.735 1.00 0.75 H new ATOM 0 HB3 SER A 865 -21.196 -24.005 -19.591 1.00 0.75 H new ATOM 0 HG SER A 865 -21.153 -23.388 -22.398 1.00 0.82 H new ATOM 738 N LYS A 866 -17.818 -22.907 -19.278 1.00 0.61 N ATOM 739 CA LYS A 866 -16.831 -22.941 -18.207 1.00 0.66 C ATOM 740 C LYS A 866 -16.325 -21.531 -17.900 1.00 0.66 C ATOM 741 O LYS A 866 -16.430 -21.051 -16.772 1.00 0.83 O ATOM 742 CB LYS A 866 -15.661 -23.853 -18.584 1.00 0.73 C ATOM 743 CG LYS A 866 -15.889 -25.320 -18.243 1.00 1.12 C ATOM 744 CD LYS A 866 -16.618 -25.486 -16.916 1.00 1.85 C ATOM 745 CE LYS A 866 -15.678 -25.944 -15.812 1.00 2.63 C ATOM 746 NZ LYS A 866 -15.902 -25.190 -14.550 1.00 3.46 N ATOM 0 H LYS A 866 -17.478 -23.243 -20.179 1.00 0.61 H new ATOM 0 HA LYS A 866 -17.309 -23.341 -17.313 1.00 0.66 H new ATOM 0 HB2 LYS A 866 -15.473 -23.764 -19.654 1.00 0.73 H new ATOM 0 HB3 LYS A 866 -14.763 -23.506 -18.073 1.00 0.73 H new ATOM 0 HG2 LYS A 866 -16.468 -25.792 -19.037 1.00 1.12 H new ATOM 0 HG3 LYS A 866 -14.930 -25.836 -18.198 1.00 1.12 H new ATOM 0 HD2 LYS A 866 -17.078 -24.539 -16.633 1.00 1.85 H new ATOM 0 HD3 LYS A 866 -17.424 -26.211 -17.032 1.00 1.85 H new ATOM 0 HE2 LYS A 866 -15.822 -27.009 -15.630 1.00 2.63 H new ATOM 0 HE3 LYS A 866 -14.645 -25.813 -16.136 1.00 2.63 H new ATOM 0 HZ1 LYS A 866 -15.243 -25.530 -13.821 1.00 3.46 H new ATOM 0 HZ2 LYS A 866 -15.740 -24.176 -14.718 1.00 3.46 H new ATOM 0 HZ3 LYS A 866 -16.880 -25.335 -14.228 1.00 3.46 H new ATOM 760 N ASN A 867 -15.791 -20.871 -18.914 1.00 0.61 N ATOM 761 CA ASN A 867 -15.295 -19.509 -18.779 1.00 0.68 C ATOM 762 C ASN A 867 -15.972 -18.616 -19.809 1.00 0.76 C ATOM 763 O ASN A 867 -15.921 -18.891 -21.008 1.00 1.40 O ATOM 764 CB ASN A 867 -13.769 -19.469 -18.951 1.00 0.77 C ATOM 765 CG ASN A 867 -13.241 -18.094 -19.345 1.00 1.08 C ATOM 766 OD1 ASN A 867 -12.552 -17.948 -20.358 1.00 1.86 O ATOM 767 ND2 ASN A 867 -13.546 -17.079 -18.545 1.00 1.40 N ATOM 0 H ASN A 867 -15.689 -21.261 -19.851 1.00 0.61 H new ATOM 0 HA ASN A 867 -15.531 -19.143 -17.780 1.00 0.68 H new ATOM 0 HB2 ASN A 867 -13.297 -19.778 -18.018 1.00 0.77 H new ATOM 0 HB3 ASN A 867 -13.477 -20.194 -19.711 1.00 0.77 H new ATOM 0 HD21 ASN A 867 -13.208 -16.141 -18.760 1.00 1.40 H new ATOM 0 HD22 ASN A 867 -14.118 -17.237 -17.716 1.00 1.40 H new ATOM 774 N HIS A 868 -16.613 -17.557 -19.336 1.00 0.78 N ATOM 775 CA HIS A 868 -17.344 -16.654 -20.213 1.00 0.81 C ATOM 776 C HIS A 868 -16.386 -15.824 -21.059 1.00 0.89 C ATOM 777 O HIS A 868 -15.959 -14.743 -20.656 1.00 1.90 O ATOM 778 CB HIS A 868 -18.263 -15.732 -19.400 1.00 1.06 C ATOM 779 CG HIS A 868 -19.057 -14.767 -20.236 1.00 1.68 C ATOM 780 ND1 HIS A 868 -18.937 -13.399 -20.120 1.00 2.38 N ATOM 781 CD2 HIS A 868 -19.983 -14.978 -21.202 1.00 2.48 C ATOM 782 CE1 HIS A 868 -19.752 -12.813 -20.976 1.00 3.08 C ATOM 783 NE2 HIS A 868 -20.397 -13.745 -21.646 1.00 3.12 N ATOM 0 H HIS A 868 -16.642 -17.302 -18.349 1.00 0.78 H new ATOM 0 HA HIS A 868 -17.958 -17.260 -20.879 1.00 0.81 H new ATOM 0 HB2 HIS A 868 -18.952 -16.344 -18.818 1.00 1.06 H new ATOM 0 HB3 HIS A 868 -17.658 -15.169 -18.689 1.00 1.06 H new ATOM 0 HD2 HIS A 868 -20.331 -15.937 -21.557 1.00 2.48 H new ATOM 0 HE1 HIS A 868 -19.870 -11.747 -21.105 1.00 3.08 H new ATOM 0 HE2 HIS A 868 -21.091 -13.579 -22.375 1.00 3.12 H new ATOM 792 N ILE A 869 -16.035 -16.356 -22.217 1.00 0.51 N ATOM 793 CA ILE A 869 -15.254 -15.622 -23.197 1.00 0.41 C ATOM 794 C ILE A 869 -16.090 -14.476 -23.763 1.00 0.46 C ATOM 795 O ILE A 869 -17.304 -14.601 -23.899 1.00 0.68 O ATOM 796 CB ILE A 869 -14.787 -16.563 -24.334 1.00 0.45 C ATOM 797 CG1 ILE A 869 -13.599 -17.405 -23.868 1.00 0.74 C ATOM 798 CG2 ILE A 869 -14.421 -15.783 -25.589 1.00 0.82 C ATOM 799 CD1 ILE A 869 -13.917 -18.877 -23.719 1.00 1.06 C ATOM 0 H ILE A 869 -16.282 -17.303 -22.503 1.00 0.51 H new ATOM 0 HA ILE A 869 -14.369 -15.212 -22.711 1.00 0.41 H new ATOM 0 HB ILE A 869 -15.617 -17.224 -24.583 1.00 0.45 H new ATOM 0 HG12 ILE A 869 -12.782 -17.289 -24.580 1.00 0.74 H new ATOM 0 HG13 ILE A 869 -13.245 -17.020 -22.911 1.00 0.74 H new ATOM 0 HG21 ILE A 869 -14.098 -16.475 -26.366 1.00 0.82 H new ATOM 0 HG22 ILE A 869 -15.291 -15.226 -25.938 1.00 0.82 H new ATOM 0 HG23 ILE A 869 -13.612 -15.088 -25.363 1.00 0.82 H new ATOM 0 HD11 ILE A 869 -13.026 -19.410 -23.386 1.00 1.06 H new ATOM 0 HD12 ILE A 869 -14.712 -19.005 -22.985 1.00 1.06 H new ATOM 0 HD13 ILE A 869 -14.241 -19.278 -24.679 1.00 1.06 H new ATOM 811 N ASP A 870 -15.442 -13.362 -24.073 1.00 0.41 N ATOM 812 CA ASP A 870 -16.148 -12.194 -24.574 1.00 0.48 C ATOM 813 C ASP A 870 -16.300 -12.253 -26.088 1.00 0.44 C ATOM 814 O ASP A 870 -17.399 -12.441 -26.606 1.00 0.56 O ATOM 815 CB ASP A 870 -15.414 -10.917 -24.174 1.00 0.58 C ATOM 816 CG ASP A 870 -16.353 -9.741 -24.017 1.00 1.07 C ATOM 817 OD1 ASP A 870 -17.566 -9.962 -23.807 1.00 1.48 O ATOM 818 OD2 ASP A 870 -15.884 -8.591 -24.077 1.00 1.64 O ATOM 0 H ASP A 870 -14.433 -13.244 -23.987 1.00 0.41 H new ATOM 0 HA ASP A 870 -17.143 -12.188 -24.129 1.00 0.48 H new ATOM 0 HB2 ASP A 870 -14.884 -11.084 -23.236 1.00 0.58 H new ATOM 0 HB3 ASP A 870 -14.662 -10.681 -24.927 1.00 0.58 H new ATOM 823 N ILE A 871 -15.186 -12.116 -26.790 1.00 0.38 N ATOM 824 CA ILE A 871 -15.195 -12.107 -28.246 1.00 0.39 C ATOM 825 C ILE A 871 -14.792 -13.475 -28.782 1.00 0.36 C ATOM 826 O ILE A 871 -13.785 -14.047 -28.357 1.00 0.37 O ATOM 827 CB ILE A 871 -14.248 -11.023 -28.807 1.00 0.46 C ATOM 828 CG1 ILE A 871 -14.545 -9.667 -28.157 1.00 0.53 C ATOM 829 CG2 ILE A 871 -14.389 -10.926 -30.319 1.00 0.74 C ATOM 830 CD1 ILE A 871 -13.323 -8.787 -28.002 1.00 1.03 C ATOM 0 H ILE A 871 -14.261 -12.009 -26.374 1.00 0.38 H new ATOM 0 HA ILE A 871 -16.209 -11.875 -28.573 1.00 0.39 H new ATOM 0 HB ILE A 871 -13.222 -11.305 -28.571 1.00 0.46 H new ATOM 0 HG12 ILE A 871 -15.287 -9.141 -28.757 1.00 0.53 H new ATOM 0 HG13 ILE A 871 -14.989 -9.834 -27.176 1.00 0.53 H new ATOM 0 HG21 ILE A 871 -13.715 -10.158 -30.699 1.00 0.74 H new ATOM 0 HG22 ILE A 871 -14.136 -11.886 -30.770 1.00 0.74 H new ATOM 0 HG23 ILE A 871 -15.416 -10.665 -30.573 1.00 0.74 H new ATOM 0 HD11 ILE A 871 -13.610 -7.845 -27.535 1.00 1.03 H new ATOM 0 HD12 ILE A 871 -12.587 -9.293 -27.376 1.00 1.03 H new ATOM 0 HD13 ILE A 871 -12.890 -8.589 -28.983 1.00 1.03 H new ATOM 842 N VAL A 872 -15.576 -14.003 -29.712 1.00 0.38 N ATOM 843 CA VAL A 872 -15.354 -15.357 -30.202 1.00 0.40 C ATOM 844 C VAL A 872 -15.010 -15.366 -31.685 1.00 0.41 C ATOM 845 O VAL A 872 -15.690 -14.733 -32.491 1.00 0.46 O ATOM 846 CB VAL A 872 -16.589 -16.256 -29.974 1.00 0.49 C ATOM 847 CG1 VAL A 872 -16.160 -17.677 -29.659 1.00 0.59 C ATOM 848 CG2 VAL A 872 -17.472 -15.707 -28.866 1.00 0.67 C ATOM 0 H VAL A 872 -16.366 -13.519 -30.140 1.00 0.38 H new ATOM 0 HA VAL A 872 -14.512 -15.753 -29.634 1.00 0.40 H new ATOM 0 HB VAL A 872 -17.173 -16.264 -30.894 1.00 0.49 H new ATOM 0 HG11 VAL A 872 -17.043 -18.297 -29.501 1.00 0.59 H new ATOM 0 HG12 VAL A 872 -15.581 -18.075 -30.492 1.00 0.59 H new ATOM 0 HG13 VAL A 872 -15.548 -17.681 -28.757 1.00 0.59 H new ATOM 0 HG21 VAL A 872 -18.333 -16.361 -28.729 1.00 0.67 H new ATOM 0 HG22 VAL A 872 -16.903 -15.657 -27.938 1.00 0.67 H new ATOM 0 HG23 VAL A 872 -17.815 -14.708 -29.135 1.00 0.67 H new ATOM 858 N LEU A 873 -13.948 -16.084 -32.033 1.00 0.41 N ATOM 859 CA LEU A 873 -13.565 -16.271 -33.425 1.00 0.44 C ATOM 860 C LEU A 873 -13.671 -17.746 -33.792 1.00 0.42 C ATOM 861 O LEU A 873 -12.776 -18.535 -33.481 1.00 0.50 O ATOM 862 CB LEU A 873 -12.129 -15.787 -33.673 1.00 0.52 C ATOM 863 CG LEU A 873 -11.644 -14.646 -32.775 1.00 0.51 C ATOM 864 CD1 LEU A 873 -10.406 -15.068 -31.998 1.00 0.78 C ATOM 865 CD2 LEU A 873 -11.350 -13.408 -33.606 1.00 0.87 C ATOM 0 H LEU A 873 -13.334 -16.549 -31.364 1.00 0.41 H new ATOM 0 HA LEU A 873 -14.241 -15.683 -34.046 1.00 0.44 H new ATOM 0 HB2 LEU A 873 -11.454 -16.634 -33.548 1.00 0.52 H new ATOM 0 HB3 LEU A 873 -12.049 -15.466 -34.711 1.00 0.52 H new ATOM 0 HG LEU A 873 -12.434 -14.408 -32.063 1.00 0.51 H new ATOM 0 HD11 LEU A 873 -10.075 -14.244 -31.365 1.00 0.78 H new ATOM 0 HD12 LEU A 873 -10.643 -15.931 -31.376 1.00 0.78 H new ATOM 0 HD13 LEU A 873 -9.611 -15.331 -32.696 1.00 0.78 H new ATOM 0 HD21 LEU A 873 -11.006 -12.605 -32.954 1.00 0.87 H new ATOM 0 HD22 LEU A 873 -10.576 -13.637 -34.339 1.00 0.87 H new ATOM 0 HD23 LEU A 873 -12.257 -13.093 -34.122 1.00 0.87 H new ATOM 877 N SER A 874 -14.763 -18.118 -34.442 1.00 0.38 N ATOM 878 CA SER A 874 -14.983 -19.502 -34.826 1.00 0.40 C ATOM 879 C SER A 874 -14.301 -19.785 -36.156 1.00 0.33 C ATOM 880 O SER A 874 -14.807 -19.421 -37.216 1.00 0.34 O ATOM 881 CB SER A 874 -16.481 -19.783 -34.922 1.00 0.53 C ATOM 882 OG SER A 874 -17.179 -18.633 -35.371 1.00 0.73 O ATOM 0 H SER A 874 -15.511 -17.480 -34.714 1.00 0.38 H new ATOM 0 HA SER A 874 -14.554 -20.158 -34.068 1.00 0.40 H new ATOM 0 HB2 SER A 874 -16.657 -20.612 -35.607 1.00 0.53 H new ATOM 0 HB3 SER A 874 -16.862 -20.088 -33.947 1.00 0.53 H new ATOM 0 HG SER A 874 -18.137 -18.833 -35.428 1.00 0.73 H new ATOM 888 N ASP A 875 -13.155 -20.436 -36.085 1.00 0.40 N ATOM 889 CA ASP A 875 -12.317 -20.653 -37.250 1.00 0.44 C ATOM 890 C ASP A 875 -12.412 -22.095 -37.732 1.00 0.48 C ATOM 891 O ASP A 875 -12.177 -23.043 -36.975 1.00 0.55 O ATOM 892 CB ASP A 875 -10.872 -20.299 -36.911 1.00 0.59 C ATOM 893 CG ASP A 875 -10.089 -19.838 -38.120 1.00 0.92 C ATOM 894 OD1 ASP A 875 -10.432 -20.242 -39.250 1.00 1.19 O ATOM 895 OD2 ASP A 875 -9.116 -19.079 -37.947 1.00 1.34 O ATOM 0 H ASP A 875 -12.780 -20.828 -35.221 1.00 0.40 H new ATOM 0 HA ASP A 875 -12.667 -20.009 -38.057 1.00 0.44 H new ATOM 0 HB2 ASP A 875 -10.862 -19.514 -36.155 1.00 0.59 H new ATOM 0 HB3 ASP A 875 -10.381 -21.169 -36.474 1.00 0.59 H new ATOM 900 N VAL A 876 -12.764 -22.260 -38.994 1.00 0.57 N ATOM 901 CA VAL A 876 -12.915 -23.582 -39.576 1.00 0.68 C ATOM 902 C VAL A 876 -12.067 -23.718 -40.832 1.00 0.80 C ATOM 903 O VAL A 876 -12.218 -22.951 -41.784 1.00 1.07 O ATOM 904 CB VAL A 876 -14.385 -23.904 -39.922 1.00 0.77 C ATOM 905 CG1 VAL A 876 -15.056 -24.640 -38.775 1.00 1.29 C ATOM 906 CG2 VAL A 876 -15.155 -22.638 -40.267 1.00 1.03 C ATOM 0 H VAL A 876 -12.951 -21.492 -39.638 1.00 0.57 H new ATOM 0 HA VAL A 876 -12.577 -24.293 -38.822 1.00 0.68 H new ATOM 0 HB VAL A 876 -14.390 -24.552 -40.799 1.00 0.77 H new ATOM 0 HG11 VAL A 876 -16.091 -24.858 -39.038 1.00 1.29 H new ATOM 0 HG12 VAL A 876 -14.527 -25.573 -38.582 1.00 1.29 H new ATOM 0 HG13 VAL A 876 -15.033 -24.018 -37.880 1.00 1.29 H new ATOM 0 HG21 VAL A 876 -16.187 -22.894 -40.507 1.00 1.03 H new ATOM 0 HG22 VAL A 876 -15.138 -21.958 -39.415 1.00 1.03 H new ATOM 0 HG23 VAL A 876 -14.692 -22.154 -41.127 1.00 1.03 H new ATOM 1011 N TYR A 884 -21.053 -22.354 -40.136 1.00 1.69 N ATOM 1012 CA TYR A 884 -22.436 -21.899 -40.155 1.00 1.56 C ATOM 1013 C TYR A 884 -23.245 -22.485 -38.990 1.00 1.24 C ATOM 1014 O TYR A 884 -23.656 -21.771 -38.066 1.00 1.24 O ATOM 1015 CB TYR A 884 -23.088 -22.243 -41.512 1.00 1.85 C ATOM 1016 CG TYR A 884 -23.299 -23.728 -41.792 1.00 1.85 C ATOM 1017 CD1 TYR A 884 -22.239 -24.632 -41.764 1.00 1.99 C ATOM 1018 CD2 TYR A 884 -24.569 -24.226 -42.067 1.00 2.07 C ATOM 1019 CE1 TYR A 884 -22.438 -25.979 -42.009 1.00 2.24 C ATOM 1020 CE2 TYR A 884 -24.774 -25.571 -42.311 1.00 2.36 C ATOM 1021 CZ TYR A 884 -23.705 -26.444 -42.278 1.00 2.40 C ATOM 1022 OH TYR A 884 -23.907 -27.785 -42.516 1.00 2.84 O ATOM 0 HA TYR A 884 -22.437 -20.816 -40.029 1.00 1.56 H new ATOM 0 HB2 TYR A 884 -24.054 -21.742 -41.566 1.00 1.85 H new ATOM 0 HB3 TYR A 884 -22.468 -21.828 -42.307 1.00 1.85 H new ATOM 0 HD1 TYR A 884 -21.243 -24.274 -41.547 1.00 1.99 H new ATOM 0 HD2 TYR A 884 -25.410 -23.549 -42.090 1.00 2.07 H new ATOM 0 HE1 TYR A 884 -21.602 -26.663 -41.989 1.00 2.24 H new ATOM 0 HE2 TYR A 884 -25.767 -25.938 -42.527 1.00 2.36 H new ATOM 0 HH TYR A 884 -24.858 -27.947 -42.688 1.00 2.84 H new ATOM 1032 N ARG A 885 -23.421 -23.794 -39.002 1.00 1.14 N ATOM 1033 CA ARG A 885 -24.353 -24.456 -38.112 1.00 1.03 C ATOM 1034 C ARG A 885 -23.991 -24.232 -36.646 1.00 0.90 C ATOM 1035 O ARG A 885 -24.859 -24.194 -35.780 1.00 0.84 O ATOM 1036 CB ARG A 885 -24.411 -25.952 -38.426 1.00 1.24 C ATOM 1037 CG ARG A 885 -25.327 -26.736 -37.502 1.00 1.61 C ATOM 1038 CD ARG A 885 -24.589 -27.179 -36.243 1.00 1.94 C ATOM 1039 NE ARG A 885 -23.563 -28.187 -36.522 1.00 2.47 N ATOM 1040 CZ ARG A 885 -23.568 -29.422 -36.030 1.00 2.81 C ATOM 1041 NH1 ARG A 885 -24.544 -29.820 -35.224 1.00 3.10 N ATOM 1042 NH2 ARG A 885 -22.585 -30.255 -36.340 1.00 3.36 N ATOM 0 H ARG A 885 -22.922 -24.426 -39.628 1.00 1.14 H new ATOM 0 HA ARG A 885 -25.338 -24.019 -38.277 1.00 1.03 H new ATOM 0 HB2 ARG A 885 -24.747 -26.085 -39.454 1.00 1.24 H new ATOM 0 HB3 ARG A 885 -23.405 -26.367 -38.363 1.00 1.24 H new ATOM 0 HG2 ARG A 885 -26.184 -26.121 -37.227 1.00 1.61 H new ATOM 0 HG3 ARG A 885 -25.716 -27.609 -38.026 1.00 1.61 H new ATOM 0 HD2 ARG A 885 -24.124 -26.312 -35.774 1.00 1.94 H new ATOM 0 HD3 ARG A 885 -25.306 -27.583 -35.528 1.00 1.94 H new ATOM 0 HE ARG A 885 -22.792 -27.923 -37.136 1.00 2.47 H new ATOM 0 HH11 ARG A 885 -25.297 -29.177 -34.978 1.00 3.10 H new ATOM 0 HH12 ARG A 885 -24.542 -30.769 -34.850 1.00 3.10 H new ATOM 0 HH21 ARG A 885 -21.830 -29.947 -36.953 1.00 3.36 H new ATOM 0 HH22 ARG A 885 -22.583 -31.204 -35.966 1.00 3.36 H new ATOM 1056 N LEU A 886 -22.713 -24.077 -36.369 1.00 0.97 N ATOM 1057 CA LEU A 886 -22.254 -24.016 -34.983 1.00 0.97 C ATOM 1058 C LEU A 886 -22.577 -22.646 -34.436 1.00 0.82 C ATOM 1059 O LEU A 886 -22.646 -22.422 -33.229 1.00 0.79 O ATOM 1060 CB LEU A 886 -20.758 -24.326 -34.853 1.00 1.21 C ATOM 1061 CG LEU A 886 -19.833 -23.650 -35.864 1.00 1.54 C ATOM 1062 CD1 LEU A 886 -19.287 -22.340 -35.310 1.00 1.90 C ATOM 1063 CD2 LEU A 886 -18.691 -24.584 -36.239 1.00 2.34 C ATOM 0 H LEU A 886 -21.977 -23.991 -37.069 1.00 0.97 H new ATOM 0 HA LEU A 886 -22.771 -24.782 -34.404 1.00 0.97 H new ATOM 0 HB2 LEU A 886 -20.436 -24.041 -33.851 1.00 1.21 H new ATOM 0 HB3 LEU A 886 -20.624 -25.405 -34.936 1.00 1.21 H new ATOM 0 HG LEU A 886 -20.412 -23.424 -36.760 1.00 1.54 H new ATOM 0 HD11 LEU A 886 -18.631 -21.878 -36.048 1.00 1.90 H new ATOM 0 HD12 LEU A 886 -20.114 -21.666 -35.087 1.00 1.90 H new ATOM 0 HD13 LEU A 886 -18.724 -22.537 -34.398 1.00 1.90 H new ATOM 0 HD21 LEU A 886 -18.039 -24.091 -36.960 1.00 2.34 H new ATOM 0 HD22 LEU A 886 -18.119 -24.836 -35.346 1.00 2.34 H new ATOM 0 HD23 LEU A 886 -19.096 -25.495 -36.680 1.00 2.34 H new ATOM 1075 N THR A 887 -22.803 -21.748 -35.371 1.00 0.80 N ATOM 1076 CA THR A 887 -23.265 -20.412 -35.081 1.00 0.77 C ATOM 1077 C THR A 887 -24.712 -20.501 -34.598 1.00 0.66 C ATOM 1078 O THR A 887 -25.141 -19.773 -33.701 1.00 0.65 O ATOM 1079 CB THR A 887 -23.159 -19.546 -36.354 1.00 0.94 C ATOM 1080 OG1 THR A 887 -21.786 -19.432 -36.751 1.00 1.28 O ATOM 1081 CG2 THR A 887 -23.742 -18.165 -36.155 1.00 1.09 C ATOM 0 H THR A 887 -22.669 -21.930 -36.366 1.00 0.80 H new ATOM 0 HA THR A 887 -22.655 -19.950 -34.305 1.00 0.77 H new ATOM 0 HB THR A 887 -23.737 -20.042 -37.134 1.00 0.94 H new ATOM 0 HG1 THR A 887 -21.701 -19.650 -37.703 1.00 1.28 H new ATOM 0 HG21 THR A 887 -23.645 -17.593 -37.077 1.00 1.09 H new ATOM 0 HG22 THR A 887 -24.796 -18.250 -35.890 1.00 1.09 H new ATOM 0 HG23 THR A 887 -23.206 -17.656 -35.354 1.00 1.09 H new ATOM 1089 N GLN A 888 -25.441 -21.442 -35.192 1.00 0.66 N ATOM 1090 CA GLN A 888 -26.804 -21.765 -34.755 1.00 0.66 C ATOM 1091 C GLN A 888 -26.801 -22.327 -33.335 1.00 0.63 C ATOM 1092 O GLN A 888 -27.686 -22.021 -32.537 1.00 0.65 O ATOM 1093 CB GLN A 888 -27.439 -22.781 -35.708 1.00 0.77 C ATOM 1094 CG GLN A 888 -28.798 -23.301 -35.268 1.00 1.06 C ATOM 1095 CD GLN A 888 -29.103 -24.673 -35.837 1.00 1.38 C ATOM 1096 OE1 GLN A 888 -29.372 -25.622 -35.099 1.00 2.17 O ATOM 1097 NE2 GLN A 888 -29.048 -24.792 -37.154 1.00 1.84 N ATOM 0 H GLN A 888 -25.112 -21.999 -35.981 1.00 0.66 H new ATOM 0 HA GLN A 888 -27.389 -20.845 -34.766 1.00 0.66 H new ATOM 0 HB2 GLN A 888 -27.542 -22.322 -36.691 1.00 0.77 H new ATOM 0 HB3 GLN A 888 -26.761 -23.627 -35.821 1.00 0.77 H new ATOM 0 HG2 GLN A 888 -28.832 -23.346 -34.179 1.00 1.06 H new ATOM 0 HG3 GLN A 888 -29.571 -22.600 -35.582 1.00 1.06 H new ATOM 0 HE21 GLN A 888 -28.822 -23.981 -37.730 1.00 1.84 H new ATOM 0 HE22 GLN A 888 -29.232 -25.694 -37.593 1.00 1.84 H new ATOM 1106 N ARG A 889 -25.806 -23.151 -33.025 1.00 0.64 N ATOM 1107 CA ARG A 889 -25.700 -23.746 -31.697 1.00 0.66 C ATOM 1108 C ARG A 889 -25.449 -22.668 -30.648 1.00 0.63 C ATOM 1109 O ARG A 889 -25.969 -22.745 -29.534 1.00 0.67 O ATOM 1110 CB ARG A 889 -24.591 -24.802 -31.654 1.00 0.71 C ATOM 1111 CG ARG A 889 -25.047 -26.145 -31.091 1.00 0.94 C ATOM 1112 CD ARG A 889 -25.978 -25.968 -29.900 1.00 1.02 C ATOM 1113 NE ARG A 889 -26.778 -27.165 -29.625 1.00 1.36 N ATOM 1114 CZ ARG A 889 -27.958 -27.431 -30.198 1.00 1.67 C ATOM 1115 NH1 ARG A 889 -28.432 -26.640 -31.153 1.00 2.05 N ATOM 1116 NH2 ARG A 889 -28.655 -28.501 -29.827 1.00 2.36 N ATOM 0 H ARG A 889 -25.065 -23.421 -33.671 1.00 0.64 H new ATOM 0 HA ARG A 889 -26.646 -24.239 -31.472 1.00 0.66 H new ATOM 0 HB2 ARG A 889 -24.205 -24.952 -32.662 1.00 0.71 H new ATOM 0 HB3 ARG A 889 -23.766 -24.426 -31.050 1.00 0.71 H new ATOM 0 HG2 ARG A 889 -25.556 -26.712 -31.870 1.00 0.94 H new ATOM 0 HG3 ARG A 889 -24.177 -26.728 -30.789 1.00 0.94 H new ATOM 0 HD2 ARG A 889 -25.389 -25.719 -29.017 1.00 1.02 H new ATOM 0 HD3 ARG A 889 -26.644 -25.126 -30.087 1.00 1.02 H new ATOM 0 HE ARG A 889 -26.412 -27.839 -28.953 1.00 1.36 H new ATOM 0 HH11 ARG A 889 -27.896 -25.825 -31.453 1.00 2.05 H new ATOM 0 HH12 ARG A 889 -29.332 -26.847 -31.587 1.00 2.05 H new ATOM 0 HH21 ARG A 889 -28.291 -29.121 -29.104 1.00 2.36 H new ATOM 0 HH22 ARG A 889 -29.554 -28.701 -30.265 1.00 2.36 H new ATOM 1130 N ILE A 890 -24.666 -21.662 -31.011 1.00 0.61 N ATOM 1131 CA ILE A 890 -24.422 -20.530 -30.128 1.00 0.63 C ATOM 1132 C ILE A 890 -25.722 -19.758 -29.896 1.00 0.62 C ATOM 1133 O ILE A 890 -25.981 -19.270 -28.795 1.00 0.67 O ATOM 1134 CB ILE A 890 -23.306 -19.611 -30.698 1.00 0.69 C ATOM 1135 CG1 ILE A 890 -22.036 -19.748 -29.858 1.00 1.22 C ATOM 1136 CG2 ILE A 890 -23.736 -18.154 -30.763 1.00 0.71 C ATOM 1137 CD1 ILE A 890 -20.986 -20.638 -30.489 1.00 1.71 C ATOM 0 H ILE A 890 -24.189 -21.606 -31.911 1.00 0.61 H new ATOM 0 HA ILE A 890 -24.071 -20.903 -29.166 1.00 0.63 H new ATOM 0 HB ILE A 890 -23.107 -19.935 -31.719 1.00 0.69 H new ATOM 0 HG12 ILE A 890 -21.610 -18.758 -29.694 1.00 1.22 H new ATOM 0 HG13 ILE A 890 -22.299 -20.148 -28.879 1.00 1.22 H new ATOM 0 HG21 ILE A 890 -22.922 -17.552 -31.168 1.00 0.71 H new ATOM 0 HG22 ILE A 890 -24.611 -18.061 -31.406 1.00 0.71 H new ATOM 0 HG23 ILE A 890 -23.983 -17.803 -29.761 1.00 0.71 H new ATOM 0 HD11 ILE A 890 -20.113 -20.689 -29.838 1.00 1.71 H new ATOM 0 HD12 ILE A 890 -21.394 -21.639 -30.628 1.00 1.71 H new ATOM 0 HD13 ILE A 890 -20.694 -20.227 -31.456 1.00 1.71 H new ATOM 1149 N ARG A 891 -26.551 -19.693 -30.933 1.00 0.61 N ATOM 1150 CA ARG A 891 -27.860 -19.064 -30.835 1.00 0.67 C ATOM 1151 C ARG A 891 -28.755 -19.846 -29.872 1.00 0.72 C ATOM 1152 O ARG A 891 -29.434 -19.263 -29.028 1.00 0.80 O ATOM 1153 CB ARG A 891 -28.509 -18.981 -32.225 1.00 0.73 C ATOM 1154 CG ARG A 891 -30.009 -18.735 -32.197 1.00 0.95 C ATOM 1155 CD ARG A 891 -30.746 -19.688 -33.123 1.00 1.10 C ATOM 1156 NE ARG A 891 -31.224 -19.026 -34.337 1.00 1.37 N ATOM 1157 CZ ARG A 891 -31.334 -19.631 -35.521 1.00 1.59 C ATOM 1158 NH1 ARG A 891 -31.030 -20.917 -35.642 1.00 1.97 N ATOM 1159 NH2 ARG A 891 -31.757 -18.952 -36.581 1.00 2.24 N ATOM 0 H ARG A 891 -26.336 -20.071 -31.856 1.00 0.61 H new ATOM 0 HA ARG A 891 -27.737 -18.053 -30.446 1.00 0.67 H new ATOM 0 HB2 ARG A 891 -28.031 -18.181 -32.790 1.00 0.73 H new ATOM 0 HB3 ARG A 891 -28.314 -19.910 -32.761 1.00 0.73 H new ATOM 0 HG2 ARG A 891 -30.380 -18.855 -31.179 1.00 0.95 H new ATOM 0 HG3 ARG A 891 -30.216 -17.706 -32.492 1.00 0.95 H new ATOM 0 HD2 ARG A 891 -30.084 -20.509 -33.397 1.00 1.10 H new ATOM 0 HD3 ARG A 891 -31.593 -20.124 -32.593 1.00 1.10 H new ATOM 0 HE ARG A 891 -31.489 -18.043 -34.274 1.00 1.37 H new ATOM 0 HH11 ARG A 891 -30.712 -21.444 -34.829 1.00 1.97 H new ATOM 0 HH12 ARG A 891 -31.115 -21.378 -36.548 1.00 1.97 H new ATOM 0 HH21 ARG A 891 -31.999 -17.965 -36.491 1.00 2.24 H new ATOM 0 HH22 ARG A 891 -31.840 -19.417 -37.485 1.00 2.24 H new ATOM 1173 N GLN A 892 -28.732 -21.167 -29.993 1.00 0.74 N ATOM 1174 CA GLN A 892 -29.556 -22.039 -29.158 1.00 0.84 C ATOM 1175 C GLN A 892 -29.125 -21.976 -27.693 1.00 0.87 C ATOM 1176 O GLN A 892 -29.956 -22.041 -26.784 1.00 0.99 O ATOM 1177 CB GLN A 892 -29.463 -23.479 -29.659 1.00 0.91 C ATOM 1178 CG GLN A 892 -30.693 -23.944 -30.418 1.00 1.23 C ATOM 1179 CD GLN A 892 -31.798 -24.429 -29.500 1.00 1.87 C ATOM 1180 OE1 GLN A 892 -32.952 -24.022 -29.632 1.00 2.62 O ATOM 1181 NE2 GLN A 892 -31.454 -25.296 -28.561 1.00 2.39 N ATOM 0 H GLN A 892 -28.148 -21.663 -30.666 1.00 0.74 H new ATOM 0 HA GLN A 892 -30.587 -21.692 -29.225 1.00 0.84 H new ATOM 0 HB2 GLN A 892 -28.591 -23.573 -30.306 1.00 0.91 H new ATOM 0 HB3 GLN A 892 -29.301 -24.140 -28.808 1.00 0.91 H new ATOM 0 HG2 GLN A 892 -31.069 -23.124 -31.030 1.00 1.23 H new ATOM 0 HG3 GLN A 892 -30.413 -24.748 -31.099 1.00 1.23 H new ATOM 0 HE21 GLN A 892 -30.486 -25.608 -28.485 1.00 2.39 H new ATOM 0 HE22 GLN A 892 -32.157 -25.652 -27.913 1.00 2.39 H new ATOM 1190 N LEU A 893 -27.823 -21.850 -27.474 1.00 0.81 N ATOM 1191 CA LEU A 893 -27.268 -21.819 -26.127 1.00 0.87 C ATOM 1192 C LEU A 893 -27.615 -20.505 -25.425 1.00 0.88 C ATOM 1193 O LEU A 893 -27.651 -20.432 -24.195 1.00 1.05 O ATOM 1194 CB LEU A 893 -25.746 -22.011 -26.188 1.00 0.90 C ATOM 1195 CG LEU A 893 -24.946 -21.351 -25.060 1.00 1.12 C ATOM 1196 CD1 LEU A 893 -24.370 -22.405 -24.127 1.00 1.48 C ATOM 1197 CD2 LEU A 893 -23.842 -20.476 -25.633 1.00 1.91 C ATOM 0 H LEU A 893 -27.128 -21.767 -28.216 1.00 0.81 H new ATOM 0 HA LEU A 893 -27.706 -22.633 -25.550 1.00 0.87 H new ATOM 0 HB2 LEU A 893 -25.533 -23.080 -26.182 1.00 0.90 H new ATOM 0 HB3 LEU A 893 -25.387 -21.620 -27.140 1.00 0.90 H new ATOM 0 HG LEU A 893 -25.619 -20.717 -24.483 1.00 1.12 H new ATOM 0 HD11 LEU A 893 -23.805 -21.918 -23.332 1.00 1.48 H new ATOM 0 HD12 LEU A 893 -25.182 -22.987 -23.691 1.00 1.48 H new ATOM 0 HD13 LEU A 893 -23.710 -23.066 -24.688 1.00 1.48 H new ATOM 0 HD21 LEU A 893 -23.284 -20.015 -24.818 1.00 1.91 H new ATOM 0 HD22 LEU A 893 -23.169 -21.087 -26.234 1.00 1.91 H new ATOM 0 HD23 LEU A 893 -24.281 -19.698 -26.258 1.00 1.91 H new ATOM 1209 N GLY A 894 -27.898 -19.479 -26.213 1.00 0.82 N ATOM 1210 CA GLY A 894 -28.142 -18.164 -25.659 1.00 0.87 C ATOM 1211 C GLY A 894 -26.905 -17.305 -25.753 1.00 0.82 C ATOM 1212 O GLY A 894 -26.136 -17.195 -24.794 1.00 1.12 O ATOM 0 H GLY A 894 -27.963 -19.534 -27.229 1.00 0.82 H new ATOM 0 HA2 GLY A 894 -28.963 -17.686 -26.193 1.00 0.87 H new ATOM 0 HA3 GLY A 894 -28.449 -18.255 -24.617 1.00 0.87 H new ATOM 1216 N LEU A 895 -26.707 -16.706 -26.915 1.00 0.75 N ATOM 1217 CA LEU A 895 -25.481 -15.989 -27.200 1.00 0.81 C ATOM 1218 C LEU A 895 -25.463 -14.599 -26.572 1.00 0.85 C ATOM 1219 O LEU A 895 -26.399 -13.816 -26.706 1.00 1.21 O ATOM 1220 CB LEU A 895 -25.254 -15.894 -28.712 1.00 1.19 C ATOM 1221 CG LEU A 895 -26.138 -14.894 -29.462 1.00 2.21 C ATOM 1222 CD1 LEU A 895 -25.285 -13.930 -30.273 1.00 2.89 C ATOM 1223 CD2 LEU A 895 -27.117 -15.625 -30.367 1.00 2.82 C ATOM 0 H LEU A 895 -27.384 -16.704 -27.678 1.00 0.75 H new ATOM 0 HA LEU A 895 -24.666 -16.557 -26.751 1.00 0.81 H new ATOM 0 HB2 LEU A 895 -24.211 -15.629 -28.887 1.00 1.19 H new ATOM 0 HB3 LEU A 895 -25.409 -16.882 -29.145 1.00 1.19 H new ATOM 0 HG LEU A 895 -26.705 -14.320 -28.729 1.00 2.21 H new ATOM 0 HD11 LEU A 895 -25.931 -13.227 -30.799 1.00 2.89 H new ATOM 0 HD12 LEU A 895 -24.620 -13.382 -29.605 1.00 2.89 H new ATOM 0 HD13 LEU A 895 -24.692 -14.489 -30.997 1.00 2.89 H new ATOM 0 HD21 LEU A 895 -27.738 -14.900 -30.893 1.00 2.82 H new ATOM 0 HD22 LEU A 895 -26.565 -16.223 -31.092 1.00 2.82 H new ATOM 0 HD23 LEU A 895 -27.751 -16.277 -29.766 1.00 2.82 H new ATOM 1235 N THR A 896 -24.386 -14.330 -25.861 1.00 0.91 N ATOM 1236 CA THR A 896 -24.081 -13.001 -25.353 1.00 1.21 C ATOM 1237 C THR A 896 -22.851 -12.505 -26.094 1.00 1.12 C ATOM 1238 O THR A 896 -22.302 -11.436 -25.816 1.00 1.48 O ATOM 1239 CB THR A 896 -23.796 -13.040 -23.826 1.00 1.68 C ATOM 1240 OG1 THR A 896 -22.409 -12.778 -23.547 1.00 2.49 O ATOM 1241 CG2 THR A 896 -24.147 -14.400 -23.250 1.00 1.70 C ATOM 0 H THR A 896 -23.689 -15.033 -25.615 1.00 0.91 H new ATOM 0 HA THR A 896 -24.931 -12.337 -25.511 1.00 1.21 H new ATOM 0 HB THR A 896 -24.412 -12.267 -23.367 1.00 1.68 H new ATOM 0 HG1 THR A 896 -22.339 -12.167 -22.784 1.00 2.49 H new ATOM 0 HG21 THR A 896 -23.940 -14.406 -22.180 1.00 1.70 H new ATOM 0 HG22 THR A 896 -25.205 -14.604 -23.416 1.00 1.70 H new ATOM 0 HG23 THR A 896 -23.548 -15.168 -23.740 1.00 1.70 H new ATOM 1249 N LEU A 897 -22.458 -13.302 -27.071 1.00 0.81 N ATOM 1250 CA LEU A 897 -21.144 -13.214 -27.669 1.00 0.78 C ATOM 1251 C LEU A 897 -21.196 -12.584 -29.053 1.00 0.56 C ATOM 1252 O LEU A 897 -22.011 -12.977 -29.888 1.00 0.57 O ATOM 1253 CB LEU A 897 -20.539 -14.620 -27.790 1.00 0.98 C ATOM 1254 CG LEU A 897 -20.402 -15.436 -26.498 1.00 0.92 C ATOM 1255 CD1 LEU A 897 -20.035 -14.543 -25.330 1.00 1.20 C ATOM 1256 CD2 LEU A 897 -21.679 -16.211 -26.206 1.00 1.40 C ATOM 0 H LEU A 897 -23.047 -14.032 -27.472 1.00 0.81 H new ATOM 0 HA LEU A 897 -20.530 -12.584 -27.025 1.00 0.78 H new ATOM 0 HB2 LEU A 897 -21.150 -15.192 -28.488 1.00 0.98 H new ATOM 0 HB3 LEU A 897 -19.549 -14.525 -28.237 1.00 0.98 H new ATOM 0 HG LEU A 897 -19.595 -16.155 -26.640 1.00 0.92 H new ATOM 0 HD11 LEU A 897 -19.944 -15.145 -24.426 1.00 1.20 H new ATOM 0 HD12 LEU A 897 -19.085 -14.049 -25.534 1.00 1.20 H new ATOM 0 HD13 LEU A 897 -20.812 -13.792 -25.188 1.00 1.20 H new ATOM 0 HD21 LEU A 897 -21.556 -16.781 -25.285 1.00 1.40 H new ATOM 0 HD22 LEU A 897 -22.510 -15.514 -26.093 1.00 1.40 H new ATOM 0 HD23 LEU A 897 -21.887 -16.893 -27.030 1.00 1.40 H new ATOM 1268 N PRO A 898 -20.337 -11.588 -29.305 1.00 0.49 N ATOM 1269 CA PRO A 898 -20.085 -11.087 -30.651 1.00 0.42 C ATOM 1270 C PRO A 898 -19.209 -12.077 -31.414 1.00 0.38 C ATOM 1271 O PRO A 898 -18.012 -12.214 -31.128 1.00 0.42 O ATOM 1272 CB PRO A 898 -19.343 -9.757 -30.424 1.00 0.50 C ATOM 1273 CG PRO A 898 -19.381 -9.516 -28.947 1.00 0.73 C ATOM 1274 CD PRO A 898 -19.550 -10.861 -28.306 1.00 0.63 C ATOM 0 HA PRO A 898 -20.994 -10.955 -31.238 1.00 0.42 H new ATOM 0 HB2 PRO A 898 -18.316 -9.816 -30.784 1.00 0.50 H new ATOM 0 HB3 PRO A 898 -19.825 -8.943 -30.966 1.00 0.50 H new ATOM 0 HG2 PRO A 898 -18.463 -9.036 -28.608 1.00 0.73 H new ATOM 0 HG3 PRO A 898 -20.204 -8.853 -28.682 1.00 0.73 H new ATOM 0 HD2 PRO A 898 -18.591 -11.343 -28.114 1.00 0.63 H new ATOM 0 HD3 PRO A 898 -20.069 -10.793 -27.350 1.00 0.63 H new ATOM 1282 N VAL A 899 -19.804 -12.793 -32.357 1.00 0.36 N ATOM 1283 CA VAL A 899 -19.102 -13.885 -33.010 1.00 0.39 C ATOM 1284 C VAL A 899 -18.606 -13.500 -34.399 1.00 0.39 C ATOM 1285 O VAL A 899 -19.377 -13.071 -35.262 1.00 0.47 O ATOM 1286 CB VAL A 899 -19.986 -15.146 -33.104 1.00 0.47 C ATOM 1287 CG1 VAL A 899 -19.201 -16.317 -33.679 1.00 0.64 C ATOM 1288 CG2 VAL A 899 -20.550 -15.504 -31.735 1.00 0.50 C ATOM 0 H VAL A 899 -20.758 -12.640 -32.683 1.00 0.36 H new ATOM 0 HA VAL A 899 -18.234 -14.107 -32.389 1.00 0.39 H new ATOM 0 HB VAL A 899 -20.816 -14.930 -33.777 1.00 0.47 H new ATOM 0 HG11 VAL A 899 -19.845 -17.194 -33.735 1.00 0.64 H new ATOM 0 HG12 VAL A 899 -18.847 -16.062 -34.678 1.00 0.64 H new ATOM 0 HG13 VAL A 899 -18.348 -16.534 -33.036 1.00 0.64 H new ATOM 0 HG21 VAL A 899 -21.171 -16.396 -31.819 1.00 0.50 H new ATOM 0 HG22 VAL A 899 -19.730 -15.697 -31.043 1.00 0.50 H new ATOM 0 HG23 VAL A 899 -21.153 -14.676 -31.362 1.00 0.50 H new ATOM 1298 N ILE A 900 -17.310 -13.649 -34.599 1.00 0.37 N ATOM 1299 CA ILE A 900 -16.711 -13.458 -35.906 1.00 0.38 C ATOM 1300 C ILE A 900 -16.379 -14.817 -36.503 1.00 0.40 C ATOM 1301 O ILE A 900 -15.521 -15.538 -35.993 1.00 0.48 O ATOM 1302 CB ILE A 900 -15.432 -12.592 -35.846 1.00 0.42 C ATOM 1303 CG1 ILE A 900 -15.239 -11.996 -34.447 1.00 0.53 C ATOM 1304 CG2 ILE A 900 -15.504 -11.489 -36.890 1.00 0.61 C ATOM 1305 CD1 ILE A 900 -14.006 -11.127 -34.318 1.00 0.64 C ATOM 0 H ILE A 900 -16.648 -13.904 -33.866 1.00 0.37 H new ATOM 0 HA ILE A 900 -17.431 -12.929 -36.529 1.00 0.38 H new ATOM 0 HB ILE A 900 -14.573 -13.228 -36.061 1.00 0.42 H new ATOM 0 HG12 ILE A 900 -16.118 -11.404 -34.190 1.00 0.53 H new ATOM 0 HG13 ILE A 900 -15.178 -12.807 -33.722 1.00 0.53 H new ATOM 0 HG21 ILE A 900 -14.599 -10.883 -36.842 1.00 0.61 H new ATOM 0 HG22 ILE A 900 -15.591 -11.932 -37.882 1.00 0.61 H new ATOM 0 HG23 ILE A 900 -16.373 -10.860 -36.696 1.00 0.61 H new ATOM 0 HD11 ILE A 900 -13.937 -10.742 -33.301 1.00 0.64 H new ATOM 0 HD12 ILE A 900 -13.119 -11.719 -34.543 1.00 0.64 H new ATOM 0 HD13 ILE A 900 -14.073 -10.294 -35.018 1.00 0.64 H new ATOM 1317 N GLY A 901 -17.081 -15.176 -37.564 1.00 0.39 N ATOM 1318 CA GLY A 901 -16.907 -16.483 -38.159 1.00 0.44 C ATOM 1319 C GLY A 901 -15.872 -16.483 -39.258 1.00 0.40 C ATOM 1320 O GLY A 901 -15.994 -15.746 -40.230 1.00 0.48 O ATOM 0 H GLY A 901 -17.771 -14.584 -38.026 1.00 0.39 H new ATOM 0 HA2 GLY A 901 -16.613 -17.194 -37.387 1.00 0.44 H new ATOM 0 HA3 GLY A 901 -17.860 -16.826 -38.562 1.00 0.44 H new ATOM 1324 N VAL A 902 -14.850 -17.300 -39.095 1.00 0.38 N ATOM 1325 CA VAL A 902 -13.809 -17.447 -40.098 1.00 0.39 C ATOM 1326 C VAL A 902 -14.082 -18.699 -40.926 1.00 0.40 C ATOM 1327 O VAL A 902 -13.713 -19.806 -40.537 1.00 0.59 O ATOM 1328 CB VAL A 902 -12.410 -17.546 -39.451 1.00 0.51 C ATOM 1329 CG1 VAL A 902 -11.353 -16.952 -40.364 1.00 0.89 C ATOM 1330 CG2 VAL A 902 -12.384 -16.856 -38.094 1.00 1.04 C ATOM 0 H VAL A 902 -14.716 -17.880 -38.267 1.00 0.38 H new ATOM 0 HA VAL A 902 -13.821 -16.564 -40.737 1.00 0.39 H new ATOM 0 HB VAL A 902 -12.186 -18.602 -39.301 1.00 0.51 H new ATOM 0 HG11 VAL A 902 -10.375 -17.032 -39.889 1.00 0.89 H new ATOM 0 HG12 VAL A 902 -11.343 -17.494 -41.310 1.00 0.89 H new ATOM 0 HG13 VAL A 902 -11.581 -15.903 -40.550 1.00 0.89 H new ATOM 0 HG21 VAL A 902 -11.387 -16.941 -37.662 1.00 1.04 H new ATOM 0 HG22 VAL A 902 -12.638 -15.803 -38.216 1.00 1.04 H new ATOM 0 HG23 VAL A 902 -13.109 -17.329 -37.431 1.00 1.04 H new ATOM 1340 N THR A 903 -14.750 -18.516 -42.053 1.00 0.44 N ATOM 1341 CA THR A 903 -15.203 -19.633 -42.862 1.00 0.53 C ATOM 1342 C THR A 903 -14.233 -19.933 -44.005 1.00 0.59 C ATOM 1343 O THR A 903 -13.386 -19.107 -44.348 1.00 0.72 O ATOM 1344 CB THR A 903 -16.604 -19.338 -43.418 1.00 0.67 C ATOM 1345 OG1 THR A 903 -16.820 -17.921 -43.452 1.00 0.89 O ATOM 1346 CG2 THR A 903 -17.669 -19.975 -42.544 1.00 0.83 C ATOM 0 H THR A 903 -14.991 -17.599 -42.429 1.00 0.44 H new ATOM 0 HA THR A 903 -15.243 -20.516 -42.225 1.00 0.53 H new ATOM 0 HB THR A 903 -16.670 -19.752 -44.424 1.00 0.67 H new ATOM 0 HG1 THR A 903 -16.655 -17.587 -44.358 1.00 0.89 H new ATOM 0 HG21 THR A 903 -18.655 -19.755 -42.953 1.00 0.83 H new ATOM 0 HG22 THR A 903 -17.520 -21.054 -42.517 1.00 0.83 H new ATOM 0 HG23 THR A 903 -17.598 -19.573 -41.533 1.00 0.83 H new ATOM 1354 N ALA A 904 -14.346 -21.119 -44.591 1.00 0.72 N ATOM 1355 CA ALA A 904 -13.440 -21.518 -45.657 1.00 0.84 C ATOM 1356 C ALA A 904 -14.192 -21.851 -46.941 1.00 0.92 C ATOM 1357 O ALA A 904 -14.794 -22.920 -47.051 1.00 1.19 O ATOM 1358 CB ALA A 904 -12.603 -22.709 -45.211 1.00 1.07 C ATOM 0 H ALA A 904 -15.051 -21.815 -44.347 1.00 0.72 H new ATOM 0 HA ALA A 904 -12.783 -20.675 -45.870 1.00 0.84 H new ATOM 0 HB1 ALA A 904 -11.928 -23.001 -46.015 1.00 1.07 H new ATOM 0 HB2 ALA A 904 -12.022 -22.436 -44.330 1.00 1.07 H new ATOM 0 HB3 ALA A 904 -13.260 -23.544 -44.968 1.00 1.07 H new ATOM 1364 N ASN A 905 -14.128 -20.922 -47.898 1.00 1.03 N ATOM 1365 CA ASN A 905 -14.698 -21.093 -49.245 1.00 1.27 C ATOM 1366 C ASN A 905 -16.057 -21.783 -49.236 1.00 1.48 C ATOM 1367 O ASN A 905 -16.236 -22.843 -49.844 1.00 2.14 O ATOM 1368 CB ASN A 905 -13.730 -21.863 -50.143 1.00 1.73 C ATOM 1369 CG ASN A 905 -13.640 -21.263 -51.531 1.00 2.13 C ATOM 1370 OD1 ASN A 905 -13.122 -20.161 -51.710 1.00 2.42 O ATOM 1371 ND2 ASN A 905 -14.143 -21.982 -52.524 1.00 2.70 N ATOM 0 H ASN A 905 -13.675 -20.018 -47.762 1.00 1.03 H new ATOM 0 HA ASN A 905 -14.852 -20.090 -49.643 1.00 1.27 H new ATOM 0 HB2 ASN A 905 -12.740 -21.870 -49.687 1.00 1.73 H new ATOM 0 HB3 ASN A 905 -14.053 -22.901 -50.218 1.00 1.73 H new ATOM 0 HD21 ASN A 905 -14.109 -21.626 -53.479 1.00 2.70 H new ATOM 0 HD22 ASN A 905 -14.564 -22.891 -52.333 1.00 2.70 H new ATOM 1378 N ALA A 906 -17.016 -21.177 -48.563 1.00 1.42 N ATOM 1379 CA ALA A 906 -18.364 -21.708 -48.523 1.00 1.94 C ATOM 1380 C ALA A 906 -19.320 -20.704 -49.141 1.00 2.10 C ATOM 1381 O ALA A 906 -19.802 -19.807 -48.459 1.00 2.81 O ATOM 1382 CB ALA A 906 -18.770 -22.039 -47.095 1.00 2.30 C ATOM 0 H ALA A 906 -16.886 -20.314 -48.035 1.00 1.42 H new ATOM 0 HA ALA A 906 -18.402 -22.633 -49.098 1.00 1.94 H new ATOM 0 HB1 ALA A 906 -19.785 -22.436 -47.088 1.00 2.30 H new ATOM 0 HB2 ALA A 906 -18.087 -22.783 -46.686 1.00 2.30 H new ATOM 0 HB3 ALA A 906 -18.730 -21.136 -46.487 1.00 2.30 H new ATOM 1388 N LEU A 907 -19.557 -20.848 -50.445 1.00 1.83 N ATOM 1389 CA LEU A 907 -20.402 -19.918 -51.202 1.00 2.05 C ATOM 1390 C LEU A 907 -21.647 -19.516 -50.414 1.00 1.86 C ATOM 1391 O LEU A 907 -22.382 -20.375 -49.924 1.00 2.51 O ATOM 1392 CB LEU A 907 -20.810 -20.539 -52.540 1.00 2.52 C ATOM 1393 CG LEU A 907 -20.127 -19.940 -53.774 1.00 3.20 C ATOM 1394 CD1 LEU A 907 -20.695 -18.566 -54.088 1.00 3.93 C ATOM 1395 CD2 LEU A 907 -18.622 -19.860 -53.567 1.00 3.55 C ATOM 0 H LEU A 907 -19.172 -21.608 -51.006 1.00 1.83 H new ATOM 0 HA LEU A 907 -19.816 -19.018 -51.385 1.00 2.05 H new ATOM 0 HB2 LEU A 907 -20.594 -21.607 -52.507 1.00 2.52 H new ATOM 0 HB3 LEU A 907 -21.889 -20.436 -52.656 1.00 2.52 H new ATOM 0 HG LEU A 907 -20.323 -20.594 -54.623 1.00 3.20 H new ATOM 0 HD11 LEU A 907 -20.196 -18.158 -54.967 1.00 3.93 H new ATOM 0 HD12 LEU A 907 -21.764 -18.650 -54.283 1.00 3.93 H new ATOM 0 HD13 LEU A 907 -20.533 -17.902 -53.239 1.00 3.93 H new ATOM 0 HD21 LEU A 907 -18.155 -19.432 -54.454 1.00 3.55 H new ATOM 0 HD22 LEU A 907 -18.406 -19.230 -52.704 1.00 3.55 H new ATOM 0 HD23 LEU A 907 -18.225 -20.860 -53.395 1.00 3.55 H new ATOM 1407 N ALA A 908 -21.844 -18.201 -50.287 1.00 1.67 N ATOM 1408 CA ALA A 908 -22.949 -17.628 -49.519 1.00 1.75 C ATOM 1409 C ALA A 908 -22.735 -17.825 -48.019 1.00 1.63 C ATOM 1410 O ALA A 908 -23.657 -18.201 -47.291 1.00 1.53 O ATOM 1411 CB ALA A 908 -24.293 -18.201 -49.962 1.00 2.09 C ATOM 0 H ALA A 908 -21.238 -17.502 -50.717 1.00 1.67 H new ATOM 0 HA ALA A 908 -22.967 -16.556 -49.718 1.00 1.75 H new ATOM 0 HB1 ALA A 908 -25.092 -17.754 -49.371 1.00 2.09 H new ATOM 0 HB2 ALA A 908 -24.454 -17.978 -51.017 1.00 2.09 H new ATOM 0 HB3 ALA A 908 -24.294 -19.281 -49.815 1.00 2.09 H new ATOM 1417 N GLU A 909 -21.511 -17.556 -47.564 1.00 1.71 N ATOM 1418 CA GLU A 909 -21.173 -17.640 -46.143 1.00 1.70 C ATOM 1419 C GLU A 909 -22.063 -16.707 -45.334 1.00 1.59 C ATOM 1420 O GLU A 909 -22.572 -17.066 -44.269 1.00 1.46 O ATOM 1421 CB GLU A 909 -19.714 -17.247 -45.917 1.00 1.97 C ATOM 1422 CG GLU A 909 -18.729 -18.402 -46.025 1.00 2.30 C ATOM 1423 CD GLU A 909 -17.384 -17.982 -46.594 1.00 2.85 C ATOM 1424 OE1 GLU A 909 -16.760 -17.053 -46.038 1.00 3.31 O ATOM 1425 OE2 GLU A 909 -16.944 -18.589 -47.595 1.00 3.28 O ATOM 0 H GLU A 909 -20.734 -17.277 -48.162 1.00 1.71 H new ATOM 0 HA GLU A 909 -21.328 -18.669 -45.819 1.00 1.70 H new ATOM 0 HB2 GLU A 909 -19.440 -16.482 -46.643 1.00 1.97 H new ATOM 0 HB3 GLU A 909 -19.620 -16.797 -44.929 1.00 1.97 H new ATOM 0 HG2 GLU A 909 -18.580 -18.839 -45.038 1.00 2.30 H new ATOM 0 HG3 GLU A 909 -19.158 -19.180 -46.656 1.00 2.30 H new ATOM 1432 N GLU A 910 -22.257 -15.509 -45.870 1.00 1.70 N ATOM 1433 CA GLU A 910 -23.073 -14.489 -45.234 1.00 1.71 C ATOM 1434 C GLU A 910 -24.517 -14.962 -45.083 1.00 1.51 C ATOM 1435 O GLU A 910 -25.215 -14.578 -44.140 1.00 1.45 O ATOM 1436 CB GLU A 910 -23.007 -13.186 -46.045 1.00 1.95 C ATOM 1437 CG GLU A 910 -23.744 -13.236 -47.381 1.00 2.30 C ATOM 1438 CD GLU A 910 -22.984 -13.979 -48.469 1.00 2.97 C ATOM 1439 OE1 GLU A 910 -21.817 -14.360 -48.243 1.00 3.58 O ATOM 1440 OE2 GLU A 910 -23.561 -14.196 -49.557 1.00 3.43 O ATOM 0 H GLU A 910 -21.851 -15.219 -46.760 1.00 1.70 H new ATOM 0 HA GLU A 910 -22.680 -14.300 -44.235 1.00 1.71 H new ATOM 0 HB2 GLU A 910 -23.423 -12.377 -45.444 1.00 1.95 H new ATOM 0 HB3 GLU A 910 -21.961 -12.940 -46.230 1.00 1.95 H new ATOM 0 HG2 GLU A 910 -24.712 -13.715 -47.234 1.00 2.30 H new ATOM 0 HG3 GLU A 910 -23.939 -12.218 -47.717 1.00 2.30 H new ATOM 1447 N LYS A 911 -24.950 -15.821 -45.997 1.00 1.45 N ATOM 1448 CA LYS A 911 -26.302 -16.342 -45.963 1.00 1.34 C ATOM 1449 C LYS A 911 -26.428 -17.410 -44.885 1.00 1.19 C ATOM 1450 O LYS A 911 -27.452 -17.497 -44.210 1.00 1.13 O ATOM 1451 CB LYS A 911 -26.700 -16.917 -47.323 1.00 1.41 C ATOM 1452 CG LYS A 911 -28.195 -16.863 -47.585 1.00 1.46 C ATOM 1453 CD LYS A 911 -28.746 -18.233 -47.938 1.00 1.59 C ATOM 1454 CE LYS A 911 -30.263 -18.228 -47.988 1.00 1.83 C ATOM 1455 NZ LYS A 911 -30.772 -18.446 -49.370 1.00 2.29 N ATOM 0 H LYS A 911 -24.381 -16.169 -46.769 1.00 1.45 H new ATOM 0 HA LYS A 911 -26.978 -15.520 -45.728 1.00 1.34 H new ATOM 0 HB2 LYS A 911 -26.181 -16.367 -48.108 1.00 1.41 H new ATOM 0 HB3 LYS A 911 -26.365 -17.952 -47.384 1.00 1.41 H new ATOM 0 HG2 LYS A 911 -28.707 -16.480 -46.702 1.00 1.46 H new ATOM 0 HG3 LYS A 911 -28.398 -16.167 -48.399 1.00 1.46 H new ATOM 0 HD2 LYS A 911 -28.350 -18.547 -48.904 1.00 1.59 H new ATOM 0 HD3 LYS A 911 -28.408 -18.963 -47.202 1.00 1.59 H new ATOM 0 HE2 LYS A 911 -30.651 -19.006 -47.331 1.00 1.83 H new ATOM 0 HE3 LYS A 911 -30.636 -17.276 -47.609 1.00 1.83 H new ATOM 0 HZ1 LYS A 911 -31.812 -18.436 -49.363 1.00 2.29 H new ATOM 0 HZ2 LYS A 911 -30.423 -17.689 -49.992 1.00 2.29 H new ATOM 0 HZ3 LYS A 911 -30.437 -19.366 -49.722 1.00 2.29 H new ATOM 1469 N GLN A 912 -25.377 -18.209 -44.701 1.00 1.20 N ATOM 1470 CA GLN A 912 -25.418 -19.256 -43.689 1.00 1.16 C ATOM 1471 C GLN A 912 -25.345 -18.635 -42.302 1.00 1.08 C ATOM 1472 O GLN A 912 -25.985 -19.108 -41.365 1.00 1.00 O ATOM 1473 CB GLN A 912 -24.288 -20.271 -43.880 1.00 1.35 C ATOM 1474 CG GLN A 912 -24.699 -21.525 -44.648 1.00 1.50 C ATOM 1475 CD GLN A 912 -26.057 -21.407 -45.324 1.00 2.04 C ATOM 1476 OE1 GLN A 912 -27.092 -21.937 -44.688 1.00 2.65 O flip ATOM 1477 NE2 GLN A 912 -26.177 -20.846 -46.415 1.00 2.53 N flip ATOM 0 H GLN A 912 -24.506 -18.152 -45.228 1.00 1.20 H new ATOM 0 HA GLN A 912 -26.361 -19.793 -43.796 1.00 1.16 H new ATOM 0 HB2 GLN A 912 -23.466 -19.788 -44.408 1.00 1.35 H new ATOM 0 HB3 GLN A 912 -23.909 -20.565 -42.901 1.00 1.35 H new ATOM 0 HG2 GLN A 912 -23.944 -21.742 -45.404 1.00 1.50 H new ATOM 0 HG3 GLN A 912 -24.716 -22.372 -43.962 1.00 1.50 H new ATOM 0 HE21 GLN A 912 -25.359 -20.449 -46.877 1.00 2.53 H new ATOM 0 HE22 GLN A 912 -27.094 -20.779 -46.856 1.00 2.53 H new ATOM 1486 N ARG A 913 -24.578 -17.556 -42.190 1.00 1.17 N ATOM 1487 CA ARG A 913 -24.510 -16.791 -40.952 1.00 1.19 C ATOM 1488 C ARG A 913 -25.897 -16.270 -40.581 1.00 1.09 C ATOM 1489 O ARG A 913 -26.288 -16.292 -39.414 1.00 1.07 O ATOM 1490 CB ARG A 913 -23.532 -15.616 -41.091 1.00 1.40 C ATOM 1491 CG ARG A 913 -23.694 -14.559 -40.007 1.00 1.47 C ATOM 1492 CD ARG A 913 -22.908 -13.297 -40.325 1.00 1.72 C ATOM 1493 NE ARG A 913 -23.697 -12.335 -41.091 1.00 2.36 N ATOM 1494 CZ ARG A 913 -24.294 -11.266 -40.563 1.00 3.09 C ATOM 1495 NH1 ARG A 913 -24.228 -11.037 -39.254 1.00 3.38 N ATOM 1496 NH2 ARG A 913 -24.962 -10.436 -41.348 1.00 4.05 N ATOM 0 H ARG A 913 -23.994 -17.192 -42.943 1.00 1.17 H new ATOM 0 HA ARG A 913 -24.150 -17.450 -40.162 1.00 1.19 H new ATOM 0 HB2 ARG A 913 -22.511 -15.998 -41.065 1.00 1.40 H new ATOM 0 HB3 ARG A 913 -23.673 -15.150 -42.066 1.00 1.40 H new ATOM 0 HG2 ARG A 913 -24.750 -14.311 -39.896 1.00 1.47 H new ATOM 0 HG3 ARG A 913 -23.360 -14.964 -39.052 1.00 1.47 H new ATOM 0 HD2 ARG A 913 -22.576 -12.834 -39.396 1.00 1.72 H new ATOM 0 HD3 ARG A 913 -22.013 -13.561 -40.888 1.00 1.72 H new ATOM 0 HE ARG A 913 -23.798 -12.491 -42.094 1.00 2.36 H new ATOM 0 HH11 ARG A 913 -23.719 -11.681 -38.649 1.00 3.38 H new ATOM 0 HH12 ARG A 913 -24.687 -10.218 -38.856 1.00 3.38 H new ATOM 0 HH21 ARG A 913 -25.018 -10.616 -42.350 1.00 4.05 H new ATOM 0 HH22 ARG A 913 -25.421 -9.616 -40.951 1.00 4.05 H new ATOM 1510 N CYS A 914 -26.637 -15.814 -41.586 1.00 1.12 N ATOM 1511 CA CYS A 914 -27.976 -15.289 -41.371 1.00 1.16 C ATOM 1512 C CYS A 914 -28.936 -16.395 -40.943 1.00 1.02 C ATOM 1513 O CYS A 914 -29.828 -16.168 -40.131 1.00 1.08 O ATOM 1514 CB CYS A 914 -28.490 -14.611 -42.642 1.00 1.36 C ATOM 1515 SG CYS A 914 -28.205 -12.826 -42.696 1.00 1.65 S ATOM 0 H CYS A 914 -26.329 -15.798 -42.558 1.00 1.12 H new ATOM 0 HA CYS A 914 -27.925 -14.552 -40.570 1.00 1.16 H new ATOM 0 HB2 CYS A 914 -28.009 -15.071 -43.506 1.00 1.36 H new ATOM 0 HB3 CYS A 914 -29.560 -14.800 -42.734 1.00 1.36 H new ATOM 0 HG CYS A 914 -28.673 -12.345 -43.810 1.00 1.65 H new ATOM 1521 N LEU A 915 -28.739 -17.589 -41.487 1.00 0.93 N ATOM 1522 CA LEU A 915 -29.616 -18.722 -41.201 1.00 0.94 C ATOM 1523 C LEU A 915 -29.437 -19.230 -39.769 1.00 0.87 C ATOM 1524 O LEU A 915 -30.413 -19.447 -39.052 1.00 0.96 O ATOM 1525 CB LEU A 915 -29.349 -19.861 -42.188 1.00 1.01 C ATOM 1526 CG LEU A 915 -30.486 -20.141 -43.174 1.00 1.21 C ATOM 1527 CD1 LEU A 915 -30.361 -19.253 -44.400 1.00 1.82 C ATOM 1528 CD2 LEU A 915 -30.496 -21.607 -43.575 1.00 1.88 C ATOM 0 H LEU A 915 -27.977 -17.800 -42.131 1.00 0.93 H new ATOM 0 HA LEU A 915 -30.644 -18.375 -41.311 1.00 0.94 H new ATOM 0 HB2 LEU A 915 -28.447 -19.628 -42.753 1.00 1.01 H new ATOM 0 HB3 LEU A 915 -29.145 -20.771 -41.623 1.00 1.01 H new ATOM 0 HG LEU A 915 -31.431 -19.913 -42.681 1.00 1.21 H new ATOM 0 HD11 LEU A 915 -31.178 -19.467 -45.089 1.00 1.82 H new ATOM 0 HD12 LEU A 915 -30.406 -18.207 -44.098 1.00 1.82 H new ATOM 0 HD13 LEU A 915 -29.409 -19.447 -44.894 1.00 1.82 H new ATOM 0 HD21 LEU A 915 -31.311 -21.787 -44.276 1.00 1.88 H new ATOM 0 HD22 LEU A 915 -29.548 -21.861 -44.048 1.00 1.88 H new ATOM 0 HD23 LEU A 915 -30.637 -22.226 -42.689 1.00 1.88 H new ATOM 1540 N GLU A 916 -28.186 -19.427 -39.369 1.00 0.82 N ATOM 1541 CA GLU A 916 -27.865 -19.950 -38.040 1.00 0.84 C ATOM 1542 C GLU A 916 -27.990 -18.855 -36.961 1.00 0.74 C ATOM 1543 O GLU A 916 -28.177 -19.154 -35.782 1.00 0.76 O ATOM 1544 CB GLU A 916 -26.484 -20.618 -38.074 1.00 1.00 C ATOM 1545 CG GLU A 916 -26.325 -21.572 -39.256 1.00 1.74 C ATOM 1546 CD GLU A 916 -27.300 -22.744 -39.240 1.00 2.82 C ATOM 1547 OE1 GLU A 916 -28.400 -22.622 -38.667 1.00 3.40 O ATOM 1548 OE2 GLU A 916 -26.970 -23.800 -39.819 1.00 3.47 O ATOM 0 H GLU A 916 -27.370 -19.232 -39.949 1.00 0.82 H new ATOM 0 HA GLU A 916 -28.590 -20.714 -37.761 1.00 0.84 H new ATOM 0 HB2 GLU A 916 -25.713 -19.849 -38.126 1.00 1.00 H new ATOM 0 HB3 GLU A 916 -26.326 -21.166 -37.145 1.00 1.00 H new ATOM 0 HG2 GLU A 916 -26.459 -21.013 -40.182 1.00 1.74 H new ATOM 0 HG3 GLU A 916 -25.306 -21.960 -39.263 1.00 1.74 H new ATOM 1555 N SER A 917 -27.874 -17.591 -37.390 1.00 0.74 N ATOM 1556 CA SER A 917 -28.216 -16.414 -36.568 1.00 0.80 C ATOM 1557 C SER A 917 -27.554 -16.382 -35.182 1.00 0.76 C ATOM 1558 O SER A 917 -28.241 -16.229 -34.169 1.00 0.86 O ATOM 1559 CB SER A 917 -29.730 -16.328 -36.389 1.00 0.95 C ATOM 1560 OG SER A 917 -30.422 -16.590 -37.599 1.00 1.35 O ATOM 0 H SER A 917 -27.538 -17.351 -38.323 1.00 0.74 H new ATOM 0 HA SER A 917 -27.825 -15.558 -37.118 1.00 0.80 H new ATOM 0 HB2 SER A 917 -30.047 -17.041 -35.628 1.00 0.95 H new ATOM 0 HB3 SER A 917 -29.997 -15.335 -36.026 1.00 0.95 H new ATOM 0 HG SER A 917 -29.880 -16.289 -38.358 1.00 1.35 H new ATOM 1566 N GLY A 918 -26.240 -16.519 -35.126 1.00 0.73 N ATOM 1567 CA GLY A 918 -25.553 -16.434 -33.843 1.00 0.82 C ATOM 1568 C GLY A 918 -24.160 -15.838 -33.951 1.00 0.77 C ATOM 1569 O GLY A 918 -23.301 -16.109 -33.119 1.00 1.02 O ATOM 0 H GLY A 918 -25.637 -16.686 -35.932 1.00 0.73 H new ATOM 0 HA2 GLY A 918 -26.148 -15.830 -33.158 1.00 0.82 H new ATOM 0 HA3 GLY A 918 -25.482 -17.431 -33.409 1.00 0.82 H new ATOM 1573 N MET A 919 -23.928 -15.033 -34.976 1.00 0.62 N ATOM 1574 CA MET A 919 -22.584 -14.537 -35.267 1.00 0.59 C ATOM 1575 C MET A 919 -22.473 -13.033 -35.018 1.00 0.55 C ATOM 1576 O MET A 919 -22.750 -12.553 -33.915 1.00 0.54 O ATOM 1577 CB MET A 919 -22.226 -14.862 -36.720 1.00 0.73 C ATOM 1578 CG MET A 919 -20.907 -15.593 -36.887 1.00 0.90 C ATOM 1579 SD MET A 919 -20.342 -15.588 -38.598 1.00 1.46 S ATOM 1580 CE MET A 919 -20.348 -17.343 -38.964 1.00 2.01 C ATOM 0 H MET A 919 -24.648 -14.708 -35.621 1.00 0.62 H new ATOM 0 HA MET A 919 -21.883 -15.032 -34.595 1.00 0.59 H new ATOM 0 HB2 MET A 919 -23.022 -15.469 -37.152 1.00 0.73 H new ATOM 0 HB3 MET A 919 -22.189 -13.933 -37.290 1.00 0.73 H new ATOM 0 HG2 MET A 919 -20.152 -15.126 -36.255 1.00 0.90 H new ATOM 0 HG3 MET A 919 -21.017 -16.622 -36.545 1.00 0.90 H new ATOM 0 HE1 MET A 919 -19.872 -17.515 -39.929 1.00 2.01 H new ATOM 0 HE2 MET A 919 -19.800 -17.878 -38.189 1.00 2.01 H new ATOM 0 HE3 MET A 919 -21.376 -17.704 -38.997 1.00 2.01 H new ATOM 1590 N ASP A 920 -22.030 -12.315 -36.049 1.00 0.60 N ATOM 1591 CA ASP A 920 -21.969 -10.854 -36.055 1.00 0.66 C ATOM 1592 C ASP A 920 -21.350 -10.390 -37.361 1.00 0.62 C ATOM 1593 O ASP A 920 -21.913 -9.563 -38.071 1.00 0.76 O ATOM 1594 CB ASP A 920 -21.149 -10.294 -34.886 1.00 0.72 C ATOM 1595 CG ASP A 920 -21.074 -8.778 -34.922 1.00 0.83 C ATOM 1596 OD1 ASP A 920 -21.973 -8.118 -34.360 1.00 1.26 O ATOM 1597 OD2 ASP A 920 -20.105 -8.240 -35.499 1.00 1.01 O ATOM 0 H ASP A 920 -21.699 -12.738 -36.916 1.00 0.60 H new ATOM 0 HA ASP A 920 -22.988 -10.482 -35.948 1.00 0.66 H new ATOM 0 HB2 ASP A 920 -21.595 -10.613 -33.944 1.00 0.72 H new ATOM 0 HB3 ASP A 920 -20.141 -10.708 -34.918 1.00 0.72 H new ATOM 1602 N SER A 921 -20.192 -10.951 -37.676 1.00 0.54 N ATOM 1603 CA SER A 921 -19.500 -10.629 -38.918 1.00 0.59 C ATOM 1604 C SER A 921 -18.882 -11.884 -39.526 1.00 0.51 C ATOM 1605 O SER A 921 -18.511 -12.814 -38.805 1.00 0.61 O ATOM 1606 CB SER A 921 -18.423 -9.567 -38.670 1.00 0.76 C ATOM 1607 OG SER A 921 -18.997 -8.350 -38.214 1.00 1.26 O ATOM 0 H SER A 921 -19.710 -11.632 -37.089 1.00 0.54 H new ATOM 0 HA SER A 921 -20.226 -10.226 -39.624 1.00 0.59 H new ATOM 0 HB2 SER A 921 -17.709 -9.934 -37.933 1.00 0.76 H new ATOM 0 HB3 SER A 921 -17.867 -9.388 -39.590 1.00 0.76 H new ATOM 0 HG SER A 921 -19.324 -8.466 -37.297 1.00 1.26 H new ATOM 1613 N CYS A 922 -18.782 -11.912 -40.850 1.00 0.49 N ATOM 1614 CA CYS A 922 -18.257 -13.076 -41.550 1.00 0.48 C ATOM 1615 C CYS A 922 -16.942 -12.747 -42.247 1.00 0.49 C ATOM 1616 O CYS A 922 -16.794 -11.684 -42.857 1.00 0.60 O ATOM 1617 CB CYS A 922 -19.279 -13.591 -42.571 1.00 0.59 C ATOM 1618 SG CYS A 922 -20.665 -12.465 -42.854 1.00 1.13 S ATOM 0 H CYS A 922 -19.058 -11.142 -41.459 1.00 0.49 H new ATOM 0 HA CYS A 922 -18.068 -13.856 -40.812 1.00 0.48 H new ATOM 0 HB2 CYS A 922 -18.771 -13.772 -43.519 1.00 0.59 H new ATOM 0 HB3 CYS A 922 -19.667 -14.550 -42.229 1.00 0.59 H new ATOM 0 HG CYS A 922 -21.095 -12.604 -44.073 1.00 1.13 H new ATOM 1624 N LEU A 923 -15.990 -13.660 -42.129 1.00 0.44 N ATOM 1625 CA LEU A 923 -14.685 -13.538 -42.765 1.00 0.46 C ATOM 1626 C LEU A 923 -14.268 -14.895 -43.308 1.00 0.43 C ATOM 1627 O LEU A 923 -15.029 -15.853 -43.226 1.00 0.43 O ATOM 1628 CB LEU A 923 -13.631 -13.042 -41.770 1.00 0.53 C ATOM 1629 CG LEU A 923 -14.161 -12.635 -40.395 1.00 0.55 C ATOM 1630 CD1 LEU A 923 -13.302 -13.238 -39.295 1.00 0.69 C ATOM 1631 CD2 LEU A 923 -14.205 -11.119 -40.271 1.00 0.66 C ATOM 0 H LEU A 923 -16.102 -14.515 -41.584 1.00 0.44 H new ATOM 0 HA LEU A 923 -14.759 -12.812 -43.575 1.00 0.46 H new ATOM 0 HB2 LEU A 923 -12.887 -13.827 -41.635 1.00 0.53 H new ATOM 0 HB3 LEU A 923 -13.117 -12.187 -42.209 1.00 0.53 H new ATOM 0 HG LEU A 923 -15.176 -13.018 -40.286 1.00 0.55 H new ATOM 0 HD11 LEU A 923 -13.693 -12.938 -38.323 1.00 0.69 H new ATOM 0 HD12 LEU A 923 -13.320 -14.325 -39.374 1.00 0.69 H new ATOM 0 HD13 LEU A 923 -12.276 -12.883 -39.399 1.00 0.69 H new ATOM 0 HD21 LEU A 923 -14.585 -10.845 -39.287 1.00 0.66 H new ATOM 0 HD22 LEU A 923 -13.201 -10.714 -40.398 1.00 0.66 H new ATOM 0 HD23 LEU A 923 -14.861 -10.710 -41.039 1.00 0.66 H new ATOM 1643 N SER A 924 -13.061 -14.994 -43.841 1.00 0.48 N ATOM 1644 CA SER A 924 -12.591 -16.255 -44.380 1.00 0.53 C ATOM 1645 C SER A 924 -11.227 -16.618 -43.806 1.00 0.50 C ATOM 1646 O SER A 924 -10.497 -15.748 -43.330 1.00 0.51 O ATOM 1647 CB SER A 924 -12.531 -16.191 -45.904 1.00 0.67 C ATOM 1648 OG SER A 924 -13.655 -15.504 -46.436 1.00 0.89 O ATOM 0 H SER A 924 -12.396 -14.223 -43.911 1.00 0.48 H new ATOM 0 HA SER A 924 -13.297 -17.034 -44.091 1.00 0.53 H new ATOM 0 HB2 SER A 924 -11.615 -15.688 -46.213 1.00 0.67 H new ATOM 0 HB3 SER A 924 -12.493 -17.201 -46.311 1.00 0.67 H new ATOM 0 HG SER A 924 -13.589 -15.477 -47.413 1.00 0.89 H new ATOM 1654 N LYS A 925 -10.908 -17.912 -43.863 1.00 0.54 N ATOM 1655 CA LYS A 925 -9.651 -18.467 -43.340 1.00 0.57 C ATOM 1656 C LYS A 925 -8.400 -17.652 -43.726 1.00 0.61 C ATOM 1657 O LYS A 925 -7.520 -17.472 -42.888 1.00 0.64 O ATOM 1658 CB LYS A 925 -9.487 -19.920 -43.799 1.00 0.64 C ATOM 1659 CG LYS A 925 -8.467 -20.709 -42.992 1.00 0.60 C ATOM 1660 CD LYS A 925 -9.122 -21.461 -41.847 1.00 0.86 C ATOM 1661 CE LYS A 925 -8.090 -21.983 -40.859 1.00 1.03 C ATOM 1662 NZ LYS A 925 -7.943 -21.089 -39.683 1.00 1.11 N ATOM 0 H LYS A 925 -11.520 -18.615 -44.278 1.00 0.54 H new ATOM 0 HA LYS A 925 -9.727 -18.416 -42.254 1.00 0.57 H new ATOM 0 HB2 LYS A 925 -10.453 -20.422 -43.736 1.00 0.64 H new ATOM 0 HB3 LYS A 925 -9.191 -19.928 -44.848 1.00 0.64 H new ATOM 0 HG2 LYS A 925 -7.953 -21.415 -43.645 1.00 0.60 H new ATOM 0 HG3 LYS A 925 -7.711 -20.030 -42.597 1.00 0.60 H new ATOM 0 HD2 LYS A 925 -9.821 -20.803 -41.331 1.00 0.86 H new ATOM 0 HD3 LYS A 925 -9.702 -22.295 -42.243 1.00 0.86 H new ATOM 0 HE2 LYS A 925 -8.381 -22.978 -40.523 1.00 1.03 H new ATOM 0 HE3 LYS A 925 -7.127 -22.084 -41.360 1.00 1.03 H new ATOM 0 HZ1 LYS A 925 -7.018 -20.616 -39.720 1.00 1.11 H new ATOM 0 HZ2 LYS A 925 -8.698 -20.374 -39.694 1.00 1.11 H new ATOM 0 HZ3 LYS A 925 -8.010 -21.650 -38.810 1.00 1.11 H new ATOM 1676 N PRO A 926 -8.259 -17.186 -44.993 1.00 0.68 N ATOM 1677 CA PRO A 926 -7.131 -16.325 -45.387 1.00 0.77 C ATOM 1678 C PRO A 926 -7.144 -14.946 -44.707 1.00 0.70 C ATOM 1679 O PRO A 926 -7.363 -13.922 -45.357 1.00 0.80 O ATOM 1680 CB PRO A 926 -7.302 -16.171 -46.903 1.00 0.94 C ATOM 1681 CG PRO A 926 -8.736 -16.472 -47.163 1.00 1.01 C ATOM 1682 CD PRO A 926 -9.123 -17.504 -46.146 1.00 0.73 C ATOM 0 HA PRO A 926 -6.181 -16.768 -45.088 1.00 0.77 H new ATOM 0 HB2 PRO A 926 -7.045 -15.163 -47.228 1.00 0.94 H new ATOM 0 HB3 PRO A 926 -6.651 -16.856 -47.445 1.00 0.94 H new ATOM 0 HG2 PRO A 926 -9.349 -15.576 -47.065 1.00 1.01 H new ATOM 0 HG3 PRO A 926 -8.880 -16.847 -48.176 1.00 1.01 H new ATOM 0 HD2 PRO A 926 -10.180 -17.437 -45.887 1.00 0.73 H new ATOM 0 HD3 PRO A 926 -8.948 -18.515 -46.513 1.00 0.73 H new ATOM 1690 N VAL A 927 -6.920 -14.932 -43.398 1.00 0.63 N ATOM 1691 CA VAL A 927 -6.750 -13.686 -42.653 1.00 0.63 C ATOM 1692 C VAL A 927 -5.267 -13.346 -42.527 1.00 0.69 C ATOM 1693 O VAL A 927 -4.407 -14.110 -42.973 1.00 1.10 O ATOM 1694 CB VAL A 927 -7.358 -13.753 -41.230 1.00 0.63 C ATOM 1695 CG1 VAL A 927 -8.197 -12.519 -40.947 1.00 1.36 C ATOM 1696 CG2 VAL A 927 -8.188 -15.012 -41.035 1.00 1.14 C ATOM 0 H VAL A 927 -6.851 -15.774 -42.826 1.00 0.63 H new ATOM 0 HA VAL A 927 -7.279 -12.916 -43.215 1.00 0.63 H new ATOM 0 HB VAL A 927 -6.530 -13.786 -40.521 1.00 0.63 H new ATOM 0 HG11 VAL A 927 -8.615 -12.586 -39.943 1.00 1.36 H new ATOM 0 HG12 VAL A 927 -7.572 -11.629 -41.022 1.00 1.36 H new ATOM 0 HG13 VAL A 927 -9.007 -12.455 -41.674 1.00 1.36 H new ATOM 0 HG21 VAL A 927 -8.598 -15.024 -40.025 1.00 1.14 H new ATOM 0 HG22 VAL A 927 -9.003 -15.026 -41.758 1.00 1.14 H new ATOM 0 HG23 VAL A 927 -7.558 -15.889 -41.181 1.00 1.14 H new ATOM 1706 N THR A 928 -4.973 -12.203 -41.919 1.00 0.51 N ATOM 1707 CA THR A 928 -3.598 -11.769 -41.719 1.00 0.58 C ATOM 1708 C THR A 928 -3.466 -11.003 -40.404 1.00 0.50 C ATOM 1709 O THR A 928 -4.472 -10.616 -39.809 1.00 0.46 O ATOM 1710 CB THR A 928 -3.122 -10.879 -42.884 1.00 0.71 C ATOM 1711 OG1 THR A 928 -4.234 -10.545 -43.726 1.00 0.80 O ATOM 1712 CG2 THR A 928 -2.048 -11.584 -43.701 1.00 0.92 C ATOM 0 H THR A 928 -5.674 -11.558 -41.555 1.00 0.51 H new ATOM 0 HA THR A 928 -2.971 -12.660 -41.682 1.00 0.58 H new ATOM 0 HB THR A 928 -2.694 -9.967 -42.468 1.00 0.71 H new ATOM 0 HG1 THR A 928 -3.927 -9.978 -44.464 1.00 0.80 H new ATOM 0 HG21 THR A 928 -1.728 -10.936 -44.517 1.00 0.92 H new ATOM 0 HG22 THR A 928 -1.195 -11.811 -43.062 1.00 0.92 H new ATOM 0 HG23 THR A 928 -2.451 -12.510 -44.110 1.00 0.92 H new ATOM 1720 N LEU A 929 -2.227 -10.777 -39.965 1.00 0.52 N ATOM 1721 CA LEU A 929 -1.945 -10.124 -38.681 1.00 0.51 C ATOM 1722 C LEU A 929 -2.649 -8.770 -38.566 1.00 0.49 C ATOM 1723 O LEU A 929 -3.295 -8.481 -37.556 1.00 0.51 O ATOM 1724 CB LEU A 929 -0.422 -9.950 -38.525 1.00 0.59 C ATOM 1725 CG LEU A 929 0.088 -9.428 -37.165 1.00 0.67 C ATOM 1726 CD1 LEU A 929 0.273 -7.917 -37.202 1.00 0.92 C ATOM 1727 CD2 LEU A 929 -0.841 -9.826 -36.023 1.00 0.71 C ATOM 0 H LEU A 929 -1.391 -11.040 -40.486 1.00 0.52 H new ATOM 0 HA LEU A 929 -2.330 -10.757 -37.881 1.00 0.51 H new ATOM 0 HB2 LEU A 929 0.050 -10.913 -38.717 1.00 0.59 H new ATOM 0 HB3 LEU A 929 -0.078 -9.266 -39.301 1.00 0.59 H new ATOM 0 HG LEU A 929 1.056 -9.893 -36.980 1.00 0.67 H new ATOM 0 HD11 LEU A 929 0.633 -7.571 -36.233 1.00 0.92 H new ATOM 0 HD12 LEU A 929 0.999 -7.658 -37.973 1.00 0.92 H new ATOM 0 HD13 LEU A 929 -0.681 -7.439 -37.427 1.00 0.92 H new ATOM 0 HD21 LEU A 929 -0.448 -9.440 -35.083 1.00 0.71 H new ATOM 0 HD22 LEU A 929 -1.833 -9.410 -36.199 1.00 0.71 H new ATOM 0 HD23 LEU A 929 -0.907 -10.913 -35.970 1.00 0.71 H new ATOM 1739 N ASP A 930 -2.551 -7.958 -39.607 1.00 0.54 N ATOM 1740 CA ASP A 930 -3.100 -6.609 -39.564 1.00 0.63 C ATOM 1741 C ASP A 930 -4.617 -6.651 -39.519 1.00 0.53 C ATOM 1742 O ASP A 930 -5.241 -5.972 -38.708 1.00 0.52 O ATOM 1743 CB ASP A 930 -2.642 -5.793 -40.768 1.00 0.85 C ATOM 1744 CG ASP A 930 -3.159 -4.370 -40.711 1.00 1.34 C ATOM 1745 OD1 ASP A 930 -2.818 -3.648 -39.755 1.00 1.73 O ATOM 1746 OD2 ASP A 930 -3.918 -3.969 -41.621 1.00 1.85 O ATOM 0 H ASP A 930 -2.100 -8.206 -40.487 1.00 0.54 H new ATOM 0 HA ASP A 930 -2.730 -6.129 -38.658 1.00 0.63 H new ATOM 0 HB2 ASP A 930 -1.553 -5.783 -40.808 1.00 0.85 H new ATOM 0 HB3 ASP A 930 -2.990 -6.270 -41.684 1.00 0.85 H new ATOM 1751 N VAL A 931 -5.202 -7.474 -40.379 1.00 0.52 N ATOM 1752 CA VAL A 931 -6.650 -7.627 -40.436 1.00 0.50 C ATOM 1753 C VAL A 931 -7.192 -8.135 -39.105 1.00 0.43 C ATOM 1754 O VAL A 931 -8.237 -7.684 -38.629 1.00 0.44 O ATOM 1755 CB VAL A 931 -7.064 -8.598 -41.558 1.00 0.60 C ATOM 1756 CG1 VAL A 931 -8.568 -8.580 -41.757 1.00 0.70 C ATOM 1757 CG2 VAL A 931 -6.352 -8.252 -42.855 1.00 0.93 C ATOM 0 H VAL A 931 -4.693 -8.049 -41.050 1.00 0.52 H new ATOM 0 HA VAL A 931 -7.073 -6.645 -40.647 1.00 0.50 H new ATOM 0 HB VAL A 931 -6.770 -9.605 -41.261 1.00 0.60 H new ATOM 0 HG11 VAL A 931 -8.838 -9.273 -42.554 1.00 0.70 H new ATOM 0 HG12 VAL A 931 -9.061 -8.881 -40.832 1.00 0.70 H new ATOM 0 HG13 VAL A 931 -8.887 -7.574 -42.028 1.00 0.70 H new ATOM 0 HG21 VAL A 931 -6.658 -8.949 -43.635 1.00 0.93 H new ATOM 0 HG22 VAL A 931 -6.613 -7.237 -43.153 1.00 0.93 H new ATOM 0 HG23 VAL A 931 -5.274 -8.322 -42.708 1.00 0.93 H new ATOM 1767 N ILE A 932 -6.466 -9.068 -38.504 1.00 0.40 N ATOM 1768 CA ILE A 932 -6.836 -9.620 -37.211 1.00 0.41 C ATOM 1769 C ILE A 932 -6.837 -8.526 -36.144 1.00 0.39 C ATOM 1770 O ILE A 932 -7.796 -8.390 -35.389 1.00 0.39 O ATOM 1771 CB ILE A 932 -5.891 -10.786 -36.809 1.00 0.49 C ATOM 1772 CG1 ILE A 932 -6.502 -12.121 -37.234 1.00 0.77 C ATOM 1773 CG2 ILE A 932 -5.596 -10.796 -35.311 1.00 0.57 C ATOM 1774 CD1 ILE A 932 -5.557 -12.995 -38.031 1.00 1.18 C ATOM 0 H ILE A 932 -5.610 -9.460 -38.897 1.00 0.40 H new ATOM 0 HA ILE A 932 -7.845 -10.024 -37.290 1.00 0.41 H new ATOM 0 HB ILE A 932 -4.943 -10.635 -37.326 1.00 0.49 H new ATOM 0 HG12 ILE A 932 -6.822 -12.664 -36.345 1.00 0.77 H new ATOM 0 HG13 ILE A 932 -7.395 -11.929 -37.829 1.00 0.77 H new ATOM 0 HG21 ILE A 932 -4.932 -11.628 -35.077 1.00 0.57 H new ATOM 0 HG22 ILE A 932 -5.117 -9.859 -35.028 1.00 0.57 H new ATOM 0 HG23 ILE A 932 -6.528 -10.909 -34.757 1.00 0.57 H new ATOM 0 HD11 ILE A 932 -6.059 -13.925 -38.298 1.00 1.18 H new ATOM 0 HD12 ILE A 932 -5.256 -12.472 -38.939 1.00 1.18 H new ATOM 0 HD13 ILE A 932 -4.675 -13.218 -37.431 1.00 1.18 H new ATOM 1786 N LYS A 933 -5.780 -7.726 -36.114 1.00 0.40 N ATOM 1787 CA LYS A 933 -5.651 -6.666 -35.122 1.00 0.43 C ATOM 1788 C LYS A 933 -6.714 -5.592 -35.314 1.00 0.43 C ATOM 1789 O LYS A 933 -7.279 -5.096 -34.340 1.00 0.44 O ATOM 1790 CB LYS A 933 -4.256 -6.048 -35.191 1.00 0.50 C ATOM 1791 CG LYS A 933 -3.598 -5.915 -33.830 1.00 0.79 C ATOM 1792 CD LYS A 933 -3.713 -4.498 -33.293 1.00 1.08 C ATOM 1793 CE LYS A 933 -2.360 -3.807 -33.262 1.00 1.50 C ATOM 1794 NZ LYS A 933 -1.936 -3.349 -34.609 1.00 1.90 N ATOM 0 H LYS A 933 -4.998 -7.791 -36.766 1.00 0.40 H new ATOM 0 HA LYS A 933 -5.798 -7.108 -34.137 1.00 0.43 H new ATOM 0 HB2 LYS A 933 -3.625 -6.660 -35.835 1.00 0.50 H new ATOM 0 HB3 LYS A 933 -4.323 -5.063 -35.654 1.00 0.50 H new ATOM 0 HG2 LYS A 933 -4.063 -6.609 -33.130 1.00 0.79 H new ATOM 0 HG3 LYS A 933 -2.547 -6.193 -33.904 1.00 0.79 H new ATOM 0 HD2 LYS A 933 -4.402 -3.926 -33.915 1.00 1.08 H new ATOM 0 HD3 LYS A 933 -4.135 -4.521 -32.288 1.00 1.08 H new ATOM 0 HE2 LYS A 933 -2.405 -2.953 -32.587 1.00 1.50 H new ATOM 0 HE3 LYS A 933 -1.613 -4.492 -32.860 1.00 1.50 H new ATOM 0 HZ1 LYS A 933 -1.008 -2.884 -34.541 1.00 1.90 H new ATOM 0 HZ2 LYS A 933 -1.867 -4.167 -35.248 1.00 1.90 H new ATOM 0 HZ3 LYS A 933 -2.635 -2.675 -34.983 1.00 1.90 H new ATOM 1808 N GLN A 934 -6.988 -5.248 -36.564 1.00 0.47 N ATOM 1809 CA GLN A 934 -7.994 -4.243 -36.885 1.00 0.53 C ATOM 1810 C GLN A 934 -9.359 -4.664 -36.351 1.00 0.46 C ATOM 1811 O GLN A 934 -10.001 -3.930 -35.596 1.00 0.47 O ATOM 1812 CB GLN A 934 -8.070 -4.030 -38.400 1.00 0.69 C ATOM 1813 CG GLN A 934 -6.866 -3.300 -38.981 1.00 0.79 C ATOM 1814 CD GLN A 934 -7.188 -2.578 -40.275 1.00 1.51 C ATOM 1815 OE1 GLN A 934 -8.174 -1.847 -40.361 1.00 2.06 O ATOM 1816 NE2 GLN A 934 -6.361 -2.771 -41.289 1.00 2.25 N ATOM 0 H GLN A 934 -6.525 -5.652 -37.378 1.00 0.47 H new ATOM 0 HA GLN A 934 -7.705 -3.305 -36.410 1.00 0.53 H new ATOM 0 HB2 GLN A 934 -8.166 -4.999 -38.889 1.00 0.69 H new ATOM 0 HB3 GLN A 934 -8.973 -3.465 -38.633 1.00 0.69 H new ATOM 0 HG2 GLN A 934 -6.495 -2.581 -38.251 1.00 0.79 H new ATOM 0 HG3 GLN A 934 -6.063 -4.016 -39.159 1.00 0.79 H new ATOM 0 HE21 GLN A 934 -5.554 -3.385 -41.179 1.00 2.25 H new ATOM 0 HE22 GLN A 934 -6.530 -2.306 -42.181 1.00 2.25 H new ATOM 1825 N THR A 935 -9.783 -5.863 -36.723 1.00 0.44 N ATOM 1826 CA THR A 935 -11.081 -6.380 -36.317 1.00 0.43 C ATOM 1827 C THR A 935 -11.150 -6.600 -34.804 1.00 0.38 C ATOM 1828 O THR A 935 -12.142 -6.252 -34.161 1.00 0.40 O ATOM 1829 CB THR A 935 -11.400 -7.698 -37.052 1.00 0.51 C ATOM 1830 OG1 THR A 935 -10.893 -7.641 -38.396 1.00 0.62 O ATOM 1831 CG2 THR A 935 -12.900 -7.953 -37.087 1.00 0.57 C ATOM 0 H THR A 935 -9.243 -6.499 -37.309 1.00 0.44 H new ATOM 0 HA THR A 935 -11.826 -5.632 -36.588 1.00 0.43 H new ATOM 0 HB THR A 935 -10.921 -8.514 -36.511 1.00 0.51 H new ATOM 0 HG1 THR A 935 -9.971 -7.974 -38.412 1.00 0.62 H new ATOM 0 HG21 THR A 935 -13.098 -8.888 -37.611 1.00 0.57 H new ATOM 0 HG22 THR A 935 -13.282 -8.020 -36.068 1.00 0.57 H new ATOM 0 HG23 THR A 935 -13.396 -7.134 -37.607 1.00 0.57 H new ATOM 1839 N LEU A 936 -10.089 -7.158 -34.236 1.00 0.37 N ATOM 1840 CA LEU A 936 -10.057 -7.464 -32.809 1.00 0.40 C ATOM 1841 C LEU A 936 -10.135 -6.195 -31.971 1.00 0.40 C ATOM 1842 O LEU A 936 -10.866 -6.141 -30.984 1.00 0.43 O ATOM 1843 CB LEU A 936 -8.793 -8.247 -32.459 1.00 0.46 C ATOM 1844 CG LEU A 936 -9.012 -9.719 -32.091 1.00 0.55 C ATOM 1845 CD1 LEU A 936 -10.286 -9.892 -31.276 1.00 0.86 C ATOM 1846 CD2 LEU A 936 -9.062 -10.583 -33.343 1.00 0.67 C ATOM 0 H LEU A 936 -9.238 -7.409 -34.740 1.00 0.37 H new ATOM 0 HA LEU A 936 -10.929 -8.077 -32.580 1.00 0.40 H new ATOM 0 HB2 LEU A 936 -8.110 -8.200 -33.307 1.00 0.46 H new ATOM 0 HB3 LEU A 936 -8.298 -7.751 -31.624 1.00 0.46 H new ATOM 0 HG LEU A 936 -8.169 -10.042 -31.480 1.00 0.55 H new ATOM 0 HD11 LEU A 936 -10.419 -10.945 -31.028 1.00 0.86 H new ATOM 0 HD12 LEU A 936 -10.213 -9.309 -30.358 1.00 0.86 H new ATOM 0 HD13 LEU A 936 -11.140 -9.546 -31.858 1.00 0.86 H new ATOM 0 HD21 LEU A 936 -9.218 -11.624 -33.061 1.00 0.67 H new ATOM 0 HD22 LEU A 936 -9.882 -10.253 -33.980 1.00 0.67 H new ATOM 0 HD23 LEU A 936 -8.121 -10.491 -33.886 1.00 0.67 H new ATOM 1858 N THR A 937 -9.394 -5.174 -32.376 1.00 0.43 N ATOM 1859 CA THR A 937 -9.394 -3.903 -31.668 1.00 0.51 C ATOM 1860 C THR A 937 -10.743 -3.193 -31.820 1.00 0.48 C ATOM 1861 O THR A 937 -11.192 -2.485 -30.915 1.00 0.52 O ATOM 1862 CB THR A 937 -8.250 -2.999 -32.168 1.00 0.62 C ATOM 1863 OG1 THR A 937 -7.003 -3.703 -32.067 1.00 0.67 O ATOM 1864 CG2 THR A 937 -8.174 -1.703 -31.368 1.00 0.87 C ATOM 0 H THR A 937 -8.784 -5.202 -33.193 1.00 0.43 H new ATOM 0 HA THR A 937 -9.233 -4.108 -30.610 1.00 0.51 H new ATOM 0 HB THR A 937 -8.450 -2.742 -33.208 1.00 0.62 H new ATOM 0 HG1 THR A 937 -6.901 -4.299 -32.838 1.00 0.67 H new ATOM 0 HG21 THR A 937 -7.357 -1.089 -31.747 1.00 0.87 H new ATOM 0 HG22 THR A 937 -9.113 -1.159 -31.467 1.00 0.87 H new ATOM 0 HG23 THR A 937 -7.998 -1.934 -30.317 1.00 0.87 H new ATOM 1872 N LEU A 938 -11.395 -3.400 -32.958 1.00 0.45 N ATOM 1873 CA LEU A 938 -12.726 -2.855 -33.188 1.00 0.49 C ATOM 1874 C LEU A 938 -13.731 -3.479 -32.222 1.00 0.45 C ATOM 1875 O LEU A 938 -14.566 -2.789 -31.638 1.00 0.50 O ATOM 1876 CB LEU A 938 -13.162 -3.117 -34.632 1.00 0.55 C ATOM 1877 CG LEU A 938 -14.206 -2.147 -35.186 1.00 0.99 C ATOM 1878 CD1 LEU A 938 -13.628 -1.354 -36.348 1.00 1.42 C ATOM 1879 CD2 LEU A 938 -15.455 -2.901 -35.620 1.00 1.39 C ATOM 0 H LEU A 938 -11.022 -3.943 -33.737 1.00 0.45 H new ATOM 0 HA LEU A 938 -12.693 -1.779 -33.016 1.00 0.49 H new ATOM 0 HB2 LEU A 938 -12.281 -3.081 -35.272 1.00 0.55 H new ATOM 0 HB3 LEU A 938 -13.561 -4.129 -34.696 1.00 0.55 H new ATOM 0 HG LEU A 938 -14.484 -1.448 -34.397 1.00 0.99 H new ATOM 0 HD11 LEU A 938 -14.383 -0.668 -36.732 1.00 1.42 H new ATOM 0 HD12 LEU A 938 -12.762 -0.787 -36.006 1.00 1.42 H new ATOM 0 HD13 LEU A 938 -13.324 -2.038 -37.140 1.00 1.42 H new ATOM 0 HD21 LEU A 938 -16.188 -2.196 -36.012 1.00 1.39 H new ATOM 0 HD22 LEU A 938 -15.194 -3.621 -36.395 1.00 1.39 H new ATOM 0 HD23 LEU A 938 -15.879 -3.426 -34.764 1.00 1.39 H new ATOM 1891 N TYR A 939 -13.629 -4.790 -32.045 1.00 0.40 N ATOM 1892 CA TYR A 939 -14.522 -5.512 -31.149 1.00 0.43 C ATOM 1893 C TYR A 939 -14.233 -5.162 -29.692 1.00 0.42 C ATOM 1894 O TYR A 939 -15.153 -5.015 -28.888 1.00 0.48 O ATOM 1895 CB TYR A 939 -14.382 -7.019 -31.361 1.00 0.51 C ATOM 1896 CG TYR A 939 -15.272 -7.567 -32.452 1.00 0.68 C ATOM 1897 CD1 TYR A 939 -15.017 -7.289 -33.789 1.00 0.92 C ATOM 1898 CD2 TYR A 939 -16.361 -8.372 -32.148 1.00 1.21 C ATOM 1899 CE1 TYR A 939 -15.822 -7.793 -34.789 1.00 1.13 C ATOM 1900 CE2 TYR A 939 -17.173 -8.879 -33.144 1.00 1.47 C ATOM 1901 CZ TYR A 939 -16.896 -8.590 -34.462 1.00 1.27 C ATOM 1902 OH TYR A 939 -17.692 -9.102 -35.456 1.00 1.59 O ATOM 0 H TYR A 939 -12.936 -5.375 -32.511 1.00 0.40 H new ATOM 0 HA TYR A 939 -15.545 -5.213 -31.379 1.00 0.43 H new ATOM 0 HB2 TYR A 939 -13.344 -7.247 -31.603 1.00 0.51 H new ATOM 0 HB3 TYR A 939 -14.612 -7.531 -30.426 1.00 0.51 H new ATOM 0 HD1 TYR A 939 -14.173 -6.667 -34.050 1.00 0.92 H new ATOM 0 HD2 TYR A 939 -16.577 -8.606 -31.116 1.00 1.21 H new ATOM 0 HE1 TYR A 939 -15.611 -7.564 -35.823 1.00 1.13 H new ATOM 0 HE2 TYR A 939 -18.020 -9.499 -32.891 1.00 1.47 H new ATOM 0 HH TYR A 939 -18.621 -8.828 -35.305 1.00 1.59 H new ATOM 1912 N ALA A 940 -12.949 -5.024 -29.366 1.00 0.43 N ATOM 1913 CA ALA A 940 -12.522 -4.698 -28.008 1.00 0.52 C ATOM 1914 C ALA A 940 -13.090 -3.357 -27.556 1.00 0.55 C ATOM 1915 O ALA A 940 -13.522 -3.209 -26.412 1.00 0.61 O ATOM 1916 CB ALA A 940 -11.003 -4.685 -27.920 1.00 0.61 C ATOM 0 H ALA A 940 -12.182 -5.134 -30.030 1.00 0.43 H new ATOM 0 HA ALA A 940 -12.908 -5.468 -27.341 1.00 0.52 H new ATOM 0 HB1 ALA A 940 -10.700 -4.441 -26.902 1.00 0.61 H new ATOM 0 HB2 ALA A 940 -10.615 -5.667 -28.188 1.00 0.61 H new ATOM 0 HB3 ALA A 940 -10.605 -3.938 -28.607 1.00 0.61 H new ATOM 1922 N GLU A 941 -13.102 -2.383 -28.459 1.00 0.56 N ATOM 1923 CA GLU A 941 -13.654 -1.077 -28.141 1.00 0.67 C ATOM 1924 C GLU A 941 -15.173 -1.165 -27.998 1.00 0.65 C ATOM 1925 O GLU A 941 -15.756 -0.509 -27.141 1.00 0.73 O ATOM 1926 CB GLU A 941 -13.250 -0.038 -29.202 1.00 0.79 C ATOM 1927 CG GLU A 941 -14.304 0.228 -30.268 1.00 0.99 C ATOM 1928 CD GLU A 941 -14.670 1.695 -30.372 1.00 1.36 C ATOM 1929 OE1 GLU A 941 -13.796 2.507 -30.747 1.00 1.72 O ATOM 1930 OE2 GLU A 941 -15.830 2.049 -30.077 1.00 1.87 O ATOM 0 H GLU A 941 -12.739 -2.474 -29.408 1.00 0.56 H new ATOM 0 HA GLU A 941 -13.242 -0.748 -27.187 1.00 0.67 H new ATOM 0 HB2 GLU A 941 -13.016 0.901 -28.700 1.00 0.79 H new ATOM 0 HB3 GLU A 941 -12.336 -0.375 -29.691 1.00 0.79 H new ATOM 0 HG2 GLU A 941 -13.935 -0.120 -31.233 1.00 0.99 H new ATOM 0 HG3 GLU A 941 -15.199 -0.351 -30.041 1.00 0.99 H new ATOM 1937 N ARG A 942 -15.793 -2.016 -28.818 1.00 0.60 N ATOM 1938 CA ARG A 942 -17.240 -2.184 -28.820 1.00 0.67 C ATOM 1939 C ARG A 942 -17.732 -2.674 -27.465 1.00 0.65 C ATOM 1940 O ARG A 942 -18.659 -2.107 -26.891 1.00 0.74 O ATOM 1941 CB ARG A 942 -17.656 -3.189 -29.896 1.00 0.74 C ATOM 1942 CG ARG A 942 -17.765 -2.601 -31.292 1.00 1.10 C ATOM 1943 CD ARG A 942 -18.368 -3.603 -32.265 1.00 1.46 C ATOM 1944 NE ARG A 942 -18.794 -2.967 -33.508 1.00 1.84 N ATOM 1945 CZ ARG A 942 -19.554 -3.558 -34.428 1.00 2.35 C ATOM 1946 NH1 ARG A 942 -19.988 -4.796 -34.247 1.00 2.73 N ATOM 1947 NH2 ARG A 942 -19.896 -2.900 -35.527 1.00 3.11 N ATOM 0 H ARG A 942 -15.305 -2.603 -29.495 1.00 0.60 H new ATOM 0 HA ARG A 942 -17.688 -1.213 -29.031 1.00 0.67 H new ATOM 0 HB2 ARG A 942 -16.933 -4.005 -29.913 1.00 0.74 H new ATOM 0 HB3 ARG A 942 -18.618 -3.621 -29.620 1.00 0.74 H new ATOM 0 HG2 ARG A 942 -18.380 -1.702 -31.264 1.00 1.10 H new ATOM 0 HG3 ARG A 942 -16.777 -2.300 -31.641 1.00 1.10 H new ATOM 0 HD2 ARG A 942 -17.636 -4.379 -32.487 1.00 1.46 H new ATOM 0 HD3 ARG A 942 -19.221 -4.094 -31.798 1.00 1.46 H new ATOM 0 HE ARG A 942 -18.490 -2.009 -33.683 1.00 1.84 H new ATOM 0 HH11 ARG A 942 -19.741 -5.304 -33.398 1.00 2.73 H new ATOM 0 HH12 ARG A 942 -20.570 -5.241 -34.957 1.00 2.73 H new ATOM 0 HH21 ARG A 942 -19.577 -1.941 -35.668 1.00 3.11 H new ATOM 0 HH22 ARG A 942 -20.478 -3.352 -36.232 1.00 3.11 H new ATOM 1961 N VAL A 943 -17.088 -3.708 -26.943 1.00 0.59 N ATOM 1962 CA VAL A 943 -17.498 -4.287 -25.671 1.00 0.64 C ATOM 1963 C VAL A 943 -17.134 -3.370 -24.512 1.00 0.67 C ATOM 1964 O VAL A 943 -17.838 -3.318 -23.505 1.00 0.75 O ATOM 1965 CB VAL A 943 -16.885 -5.685 -25.444 1.00 0.66 C ATOM 1966 CG1 VAL A 943 -17.567 -6.713 -26.332 1.00 0.75 C ATOM 1967 CG2 VAL A 943 -15.385 -5.678 -25.693 1.00 0.61 C ATOM 0 H VAL A 943 -16.284 -4.161 -27.377 1.00 0.59 H new ATOM 0 HA VAL A 943 -18.582 -4.398 -25.713 1.00 0.64 H new ATOM 0 HB VAL A 943 -17.049 -5.958 -24.401 1.00 0.66 H new ATOM 0 HG11 VAL A 943 -17.123 -7.694 -26.160 1.00 0.75 H new ATOM 0 HG12 VAL A 943 -18.631 -6.749 -26.096 1.00 0.75 H new ATOM 0 HG13 VAL A 943 -17.437 -6.434 -27.378 1.00 0.75 H new ATOM 0 HG21 VAL A 943 -14.984 -6.677 -25.525 1.00 0.61 H new ATOM 0 HG22 VAL A 943 -15.188 -5.377 -26.722 1.00 0.61 H new ATOM 0 HG23 VAL A 943 -14.906 -4.975 -25.011 1.00 0.61 H new ATOM 1977 N ARG A 944 -16.044 -2.627 -24.671 1.00 0.67 N ATOM 1978 CA ARG A 944 -15.603 -1.689 -23.650 1.00 0.79 C ATOM 1979 C ARG A 944 -16.627 -0.572 -23.459 1.00 0.88 C ATOM 1980 O ARG A 944 -17.045 -0.291 -22.337 1.00 0.98 O ATOM 1981 CB ARG A 944 -14.242 -1.100 -24.023 1.00 0.85 C ATOM 1982 CG ARG A 944 -13.432 -0.624 -22.827 1.00 1.10 C ATOM 1983 CD ARG A 944 -12.492 -1.707 -22.321 1.00 1.67 C ATOM 1984 NE ARG A 944 -12.087 -1.474 -20.933 1.00 2.12 N ATOM 1985 CZ ARG A 944 -10.829 -1.555 -20.497 1.00 2.78 C ATOM 1986 NH1 ARG A 944 -9.857 -1.927 -21.322 1.00 3.17 N ATOM 1987 NH2 ARG A 944 -10.548 -1.293 -19.226 1.00 3.58 N ATOM 0 H ARG A 944 -15.450 -2.658 -25.500 1.00 0.67 H new ATOM 0 HA ARG A 944 -15.507 -2.230 -22.709 1.00 0.79 H new ATOM 0 HB2 ARG A 944 -13.667 -1.852 -24.564 1.00 0.85 H new ATOM 0 HB3 ARG A 944 -14.393 -0.263 -24.704 1.00 0.85 H new ATOM 0 HG2 ARG A 944 -12.855 0.258 -23.105 1.00 1.10 H new ATOM 0 HG3 ARG A 944 -14.107 -0.324 -22.026 1.00 1.10 H new ATOM 0 HD2 ARG A 944 -12.982 -2.678 -22.398 1.00 1.67 H new ATOM 0 HD3 ARG A 944 -11.607 -1.745 -22.956 1.00 1.67 H new ATOM 0 HE ARG A 944 -12.813 -1.235 -20.257 1.00 2.12 H new ATOM 0 HH11 ARG A 944 -10.071 -2.152 -22.294 1.00 3.17 H new ATOM 0 HH12 ARG A 944 -8.897 -1.987 -20.984 1.00 3.17 H new ATOM 0 HH21 ARG A 944 -11.294 -1.030 -18.583 1.00 3.58 H new ATOM 0 HH22 ARG A 944 -9.586 -1.355 -18.893 1.00 3.58 H new ATOM 2001 N LYS A 945 -17.050 0.047 -24.558 1.00 0.91 N ATOM 2002 CA LYS A 945 -17.996 1.159 -24.483 1.00 1.09 C ATOM 2003 C LYS A 945 -19.417 0.676 -24.195 1.00 1.10 C ATOM 2004 O LYS A 945 -20.211 1.396 -23.593 1.00 1.22 O ATOM 2005 CB LYS A 945 -17.977 1.988 -25.773 1.00 1.25 C ATOM 2006 CG LYS A 945 -18.147 1.175 -27.047 1.00 1.04 C ATOM 2007 CD LYS A 945 -18.895 1.959 -28.112 1.00 1.40 C ATOM 2008 CE LYS A 945 -20.385 1.662 -28.093 1.00 2.02 C ATOM 2009 NZ LYS A 945 -21.161 2.707 -28.811 1.00 2.78 N ATOM 0 H LYS A 945 -16.757 -0.199 -25.503 1.00 0.91 H new ATOM 0 HA LYS A 945 -17.678 1.791 -23.654 1.00 1.09 H new ATOM 0 HB2 LYS A 945 -18.772 2.733 -25.723 1.00 1.25 H new ATOM 0 HB3 LYS A 945 -17.034 2.532 -25.827 1.00 1.25 H new ATOM 0 HG2 LYS A 945 -17.168 0.885 -27.428 1.00 1.04 H new ATOM 0 HG3 LYS A 945 -18.688 0.255 -26.824 1.00 1.04 H new ATOM 0 HD2 LYS A 945 -18.736 3.026 -27.956 1.00 1.40 H new ATOM 0 HD3 LYS A 945 -18.489 1.716 -29.094 1.00 1.40 H new ATOM 0 HE2 LYS A 945 -20.569 0.691 -28.553 1.00 2.02 H new ATOM 0 HE3 LYS A 945 -20.730 1.596 -27.061 1.00 2.02 H new ATOM 0 HZ1 LYS A 945 -22.174 2.472 -28.778 1.00 2.78 H new ATOM 0 HZ2 LYS A 945 -21.005 3.629 -28.356 1.00 2.78 H new ATOM 0 HZ3 LYS A 945 -20.848 2.752 -29.802 1.00 2.78 H new ATOM 2023 N SER A 946 -19.746 -0.533 -24.630 1.00 1.04 N ATOM 2024 CA SER A 946 -21.082 -1.073 -24.405 1.00 1.14 C ATOM 2025 C SER A 946 -21.285 -1.466 -22.943 1.00 1.18 C ATOM 2026 O SER A 946 -22.293 -1.109 -22.330 1.00 1.34 O ATOM 2027 CB SER A 946 -21.339 -2.271 -25.316 1.00 1.15 C ATOM 2028 OG SER A 946 -21.311 -1.884 -26.679 1.00 1.20 O ATOM 0 H SER A 946 -19.114 -1.154 -25.136 1.00 1.04 H new ATOM 0 HA SER A 946 -21.800 -0.289 -24.646 1.00 1.14 H new ATOM 0 HB2 SER A 946 -20.586 -3.038 -25.136 1.00 1.15 H new ATOM 0 HB3 SER A 946 -22.307 -2.713 -25.079 1.00 1.15 H new ATOM 0 HG SER A 946 -20.441 -2.114 -27.067 1.00 1.20 H new ATOM 2034 N ARG A 947 -20.322 -2.191 -22.384 1.00 1.11 N ATOM 2035 CA ARG A 947 -20.417 -2.642 -21.001 1.00 1.21 C ATOM 2036 C ARG A 947 -20.044 -1.522 -20.040 1.00 1.25 C ATOM 2037 O ARG A 947 -20.412 -1.559 -18.863 1.00 1.40 O ATOM 2038 CB ARG A 947 -19.512 -3.851 -20.772 1.00 1.29 C ATOM 2039 CG ARG A 947 -20.157 -4.940 -19.933 1.00 1.48 C ATOM 2040 CD ARG A 947 -19.866 -6.323 -20.489 1.00 1.79 C ATOM 2041 NE ARG A 947 -18.440 -6.529 -20.720 1.00 2.18 N ATOM 2042 CZ ARG A 947 -17.940 -7.225 -21.738 1.00 2.70 C ATOM 2043 NH1 ARG A 947 -18.746 -7.849 -22.589 1.00 2.98 N ATOM 2044 NH2 ARG A 947 -16.628 -7.317 -21.895 1.00 3.53 N ATOM 0 H ARG A 947 -19.470 -2.478 -22.865 1.00 1.11 H new ATOM 0 HA ARG A 947 -21.450 -2.932 -20.809 1.00 1.21 H new ATOM 0 HB2 ARG A 947 -19.226 -4.269 -21.737 1.00 1.29 H new ATOM 0 HB3 ARG A 947 -18.595 -3.521 -20.283 1.00 1.29 H new ATOM 0 HG2 ARG A 947 -19.791 -4.875 -18.908 1.00 1.48 H new ATOM 0 HG3 ARG A 947 -21.235 -4.781 -19.897 1.00 1.48 H new ATOM 0 HD2 ARG A 947 -20.234 -7.078 -19.794 1.00 1.79 H new ATOM 0 HD3 ARG A 947 -20.408 -6.459 -21.425 1.00 1.79 H new ATOM 0 HE ARG A 947 -17.784 -6.113 -20.059 1.00 2.18 H new ATOM 0 HH11 ARG A 947 -19.757 -7.797 -22.465 1.00 2.98 H new ATOM 0 HH12 ARG A 947 -18.354 -8.380 -23.367 1.00 2.98 H new ATOM 0 HH21 ARG A 947 -16.002 -6.855 -21.236 1.00 3.53 H new ATOM 0 HH22 ARG A 947 -16.244 -7.850 -22.675 1.00 3.53 H new