#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nkn h MET 846 N 0.00 0.00 -0.75 5.31 4.05 -2.06 -3.26 114.93 118.22 1nkn h MET 846 Ca 0.00 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.39 1nkn h MET 846 Cb 0.00 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.77 1nkn h MET 846 CO 0.00 0.95 0.35 0.87 0.23 0.00 0.00 176.91 179.31 1nkn h LYS 847 N -1.00 1.08 -0.95 0.39 1.57 -2.05 -1.75 116.57 113.86 1nkn h LYS 847 Ca -0.04 -0.16 0.21 0.00 -1.87 0.00 0.00 60.65 58.78 1nkn h LYS 847 Cb 0.99 -0.19 -0.08 0.00 0.08 0.00 0.00 32.23 33.03 1nkn h LYS 847 CO -0.03 0.85 0.61 1.49 -0.57 0.00 0.00 179.45 181.80 1nkn h GLU 848 N 1.05 0.48 0.23 3.15 4.57 -2.00 0.04 114.58 122.11 1nkn h GLU 848 Ca 0.26 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.40 1nkn h GLU 848 Cb 0.13 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 1nkn h GLU 848 CO -0.03 0.32 -0.11 0.37 -1.18 0.00 0.00 179.01 178.37 1nkn h GLN 849 N 0.49 -0.30 -0.67 1.92 5.75 -1.36 0.22 115.11 121.16 1nkn h GLN 849 Ca 0.51 0.02 0.08 0.00 -0.15 0.00 0.00 58.65 59.11 1nkn h GLN 849 Cb 1.15 0.07 -0.04 0.00 1.07 0.00 0.00 27.48 29.72 1nkn h GLN 849 CO -0.23 0.06 0.44 -0.07 -2.65 0.00 0.00 178.83 176.38 1nkn h LEU 850 N -0.77 0.52 -0.03 -2.39 3.38 -1.06 0.12 115.31 115.08 1nkn h LEU 850 Ca -0.03 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1nkn h LEU 850 Cb 0.50 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1nkn h LEU 850 CO 0.05 0.33 -0.04 0.50 0.09 0.00 0.00 178.44 179.36 1nkn h LYS 851 N 0.59 0.09 -0.54 1.13 1.63 -0.93 -2.59 116.57 115.95 1nkn h LYS 851 Ca 0.30 -0.05 0.10 0.00 -0.85 0.00 0.00 60.65 60.15 1nkn h LYS 851 Cb 0.40 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.00 1nkn h LYS 851 CO -0.10 0.58 0.37 0.37 -3.45 0.00 0.00 179.45 177.23 1nkn h GLN 852 N -0.40 0.29 -0.64 1.90 5.75 0.04 -0.39 115.11 121.67 1nkn h GLN 852 Ca 0.00 -0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 58.42 1nkn h GLN 852 Cb 0.57 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 29.03 1nkn h GLN 852 CO 0.01 0.19 0.15 1.98 -2.65 0.00 0.00 178.83 178.51 1nkn h MET 853 N 0.30 1.02 0.03 1.69 4.05 -0.51 -2.82 114.93 118.69 1nkn h MET 853 Ca 0.25 -0.25 -0.23 0.00 -0.28 0.00 0.00 59.70 59.19 1nkn h MET 853 Cb 0.60 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 31.25 1nkn h MET 853 CO -0.06 0.93 -1.13 -0.44 0.23 0.00 0.00 176.91 176.44 1nkn h ASP 854 N 0.94 0.10 -0.96 1.39 3.45 -0.87 0.07 116.42 120.55 1nkn h ASP 854 Ca 0.20 -0.12 0.06 0.00 0.43 0.00 0.00 57.03 57.60 1nkn h ASP 854 Cb 0.37 -0.03 -0.06 0.00 -0.56 0.00 0.00 39.33 39.05 1nkn h ASP 854 CO 0.00 1.09 0.62 0.07 -1.57 0.00 0.00 179.24 179.46 1nkn h LYS 855 N 0.02 1.09 0.24 3.56 2.10 -1.03 -0.62 116.57 121.93 1nkn h LYS 855 Ca -0.07 -0.07 -0.33 0.00 -2.00 0.00 0.00 60.65 58.18 1nkn h LYS 855 Cb 1.84 -0.25 0.03 0.00 -0.90 0.00 0.00 32.23 32.96 1nkn h LYS 855 CO 0.14 0.72 -1.51 1.98 -2.00 0.00 0.00 179.45 178.78 1nkn h MET 856 N 1.12 0.51 -0.74 0.07 4.05 -1.50 -2.73 114.93 115.71 1nkn h MET 856 Ca 0.41 -0.86 0.19 0.00 -0.28 0.00 0.00 59.70 59.15 1nkn h MET 856 Cb 0.15 0.32 -0.04 0.00 -0.80 0.00 0.00 31.60 31.24 1nkn h MET 856 CO -0.15 1.41 0.51 -0.22 0.23 0.00 0.00 176.91 178.70 1nkn h LYS 857 N 0.11 0.14 0.18 0.39 1.63 -0.39 0.02 116.57 118.66 1nkn h LYS 857 Ca -0.27 -0.01 -0.33 0.00 -0.85 0.00 0.00 60.65 59.19 1nkn h LYS 857 Cb 2.13 -0.03 0.01 0.00 -0.60 0.00 0.00 32.23 33.75 1nkn h LYS 857 CO 0.25 0.09 -1.56 0.93 -3.45 0.00 0.00 179.45 175.72 1nkn h GLU 858 N 0.15 0.38 -0.15 1.90 4.39 -1.15 -2.74 114.58 117.37 1nkn h GLU 858 Ca 0.36 -0.66 -0.04 0.00 0.34 0.00 0.00 59.36 59.37 1nkn h GLU 858 Cb 1.20 0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 30.09 1nkn h GLU 858 CO -0.05 1.29 -0.07 -0.44 -1.16 0.00 0.00 179.01 178.57 1nkn h ASP 859 N 0.10 0.20 -0.14 1.42 5.19 -0.97 0.29 116.42 122.51 1nkn h ASP 859 Ca -0.27 -0.03 -0.09 0.00 -0.62 0.00 0.00 57.03 56.02 1nkn h ASP 859 Cb 2.08 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 41.54 1nkn h ASP 859 CO 0.21 0.31 -0.25 0.25 -3.12 0.00 0.00 179.24 176.63 1nkn h LEU 860 N 0.21 0.47 -0.40 1.55 5.85 -1.08 -0.62 115.31 121.29 1nkn h LEU 860 Ca 0.05 -0.54 -0.15 0.00 0.84 0.00 0.00 57.88 58.07 1nkn h LEU 860 Cb 0.27 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 1nkn h LEU 860 CO 0.01 0.92 -0.35 0.00 -0.34 0.00 0.00 178.44 178.69 1nkn h ALA 861 N 0.56 0.58 -0.11 1.25 0.00 -1.14 -1.58 119.26 118.82 1nkn h ALA 861 Ca 0.01 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1nkn h ALA 861 Cb 0.84 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1nkn h ALA 861 CO 0.06 0.66 0.03 -0.22 0.00 0.00 0.00 179.25 179.78 1nkn h LYS 862 N 0.77 0.17 -0.64 0.00 3.64 -0.44 -1.41 116.57 118.66 1nkn h LYS 862 Ca 0.07 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1nkn h LYS 862 Cb 0.94 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.71 1nkn h LYS 862 CO 0.09 0.35 0.30 1.15 -2.27 0.00 0.00 179.45 179.07 1nkn h THR 863 N -0.03 1.22 0.00 1.00 2.02 -1.11 -1.80 112.91 114.20 1nkn h THR 863 Ca 0.03 -0.64 -0.03 0.00 0.77 0.00 0.00 66.41 66.55 1nkn h THR 863 Cb 0.26 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 67.13 1nkn h THR 863 CO 0.00 0.26 -0.12 -0.08 0.37 0.00 0.00 175.52 175.95 1nkn h GLU 864 N 0.88 0.00 0.25 6.66 4.57 -1.20 -0.49 114.58 125.24 1nkn h GLU 864 Ca 0.22 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.38 1nkn h GLU 864 Cb 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1nkn h GLU 864 CO -0.03 0.12 -0.12 -0.09 -1.18 0.00 0.00 179.01 177.72 1nkn h ARG 865 N 0.00 -0.32 -0.42 1.92 2.43 -0.43 -2.42 114.38 115.14 1nkn h ARG 865 Ca -0.00 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1nkn h ARG 865 Cb 0.23 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 1nkn h ARG 865 CO 0.02 0.02 0.28 0.82 -1.51 0.00 0.00 179.97 179.60 1nkn h ILE 866 N -0.73 1.05 -0.69 1.20 2.04 -1.07 -0.04 117.51 119.27 1nkn h ILE 866 Ca -0.03 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 1nkn h ILE 866 Cb 0.49 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1nkn h ILE 866 CO 0.06 0.09 0.35 0.50 0.00 0.00 0.00 178.15 179.14 1nkn h LYS 867 N 0.47 0.99 -0.31 2.37 3.64 -0.96 0.16 116.57 122.94 1nkn h LYS 867 Ca 0.17 -0.14 -0.11 0.00 -1.27 0.00 0.00 60.65 59.30 1nkn h LYS 867 Cb 0.09 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1nkn h LYS 867 CO -0.04 0.77 -0.23 0.87 -2.27 0.00 0.00 179.45 178.55 1nkn h LYS 868 N 0.96 0.70 -0.80 1.90 1.57 -0.73 -1.81 116.57 118.35 1nkn h LYS 868 Ca 0.24 -0.34 0.09 0.00 -1.87 0.00 0.00 60.65 58.77 1nkn h LYS 868 Cb 0.10 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.35 1nkn h LYS 868 CO -0.03 0.95 0.52 0.93 -0.57 0.00 0.00 179.45 181.25 1nkn h GLU 869 N 0.45 0.73 -0.07 3.15 5.08 -0.59 -1.27 114.58 122.07 1nkn h GLU 869 Ca 0.06 -0.04 -0.24 0.00 -1.00 0.00 0.00 59.36 58.14 1nkn h GLU 869 Cb 0.79 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.89 1nkn h GLU 869 CO 0.06 0.48 -0.90 -0.07 -1.00 0.00 0.00 179.01 177.58 1nkn h LEU 870 N 0.75 0.85 -1.48 1.33 3.38 -0.79 -1.50 115.31 117.85 1nkn h LEU 870 Ca 0.37 -0.62 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 1nkn h LEU 870 Cb 0.43 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1nkn h LEU 870 CO -0.14 1.42 -0.00 -0.33 0.09 0.00 0.00 178.44 179.47 1nkn h GLU 871 N 0.43 0.33 -0.06 1.13 5.08 -0.59 0.48 114.58 121.38 1nkn h GLU 871 Ca -0.09 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 1nkn h GLU 871 Cb 1.54 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.73 1nkn h GLU 871 CO 0.18 0.37 -0.11 1.49 -1.00 0.00 0.00 179.01 179.93 1nkn h GLU 872 N 0.33 0.18 -0.56 2.33 4.57 -1.12 -2.63 114.58 117.67 1nkn h GLU 872 Ca 0.08 -0.11 0.04 0.00 -1.18 0.00 0.00 59.36 58.18 1nkn h GLU 872 Cb 0.23 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.79 1nkn h GLU 872 CO 0.01 0.69 0.31 0.37 -1.18 0.00 0.00 179.01 179.21 1nkn h GLN 873 N -0.32 0.59 -0.34 1.92 4.15 -0.85 -1.15 115.11 119.12 1nkn h GLN 873 Ca 0.00 -0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.46 1nkn h GLN 873 Cb 0.68 -0.13 -0.08 0.00 0.21 0.00 0.00 27.48 28.16 1nkn h GLN 873 CO 0.02 0.39 -0.21 -0.97 -1.93 0.00 0.00 178.83 176.14 1nkn h ASN 874 N 0.61 -0.69 -0.20 -0.69 -1.24 -0.89 0.16 115.58 112.64 1nkn h ASN 874 Ca 0.24 0.15 -0.09 0.00 0.71 0.00 0.00 56.30 57.30 1nkn h ASN 874 Cb 0.09 0.36 -0.02 0.00 0.73 0.00 0.00 38.32 39.49 1nkn h ASN 874 CO -0.14 -0.24 -0.18 0.58 -1.29 0.00 0.00 177.43 176.16 1nkn h VAL 875 N -0.16 1.26 -0.70 2.57 2.07 -1.07 -2.24 116.25 117.97 1nkn h VAL 875 Ca 0.17 -1.21 -0.04 0.00 0.82 0.00 0.00 66.70 66.44 1nkn h VAL 875 Cb 0.43 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1nkn h VAL 875 CO -0.44 0.40 0.28 0.74 0.02 0.00 0.00 177.57 178.57 1nkn h THR 876 N 0.56 1.25 -0.61 2.57 2.02 -0.09 -1.71 112.91 116.89 1nkn h THR 876 Ca 0.09 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 66.51 1nkn h THR 876 Cb 0.63 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 1nkn h THR 876 CO 0.04 0.31 0.39 -0.07 0.37 0.00 0.00 175.52 176.56 1nkn h LEU 877 N 1.01 0.65 -0.92 2.58 3.38 -0.37 0.26 115.31 121.89 1nkn h LEU 877 Ca 0.23 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.23 1nkn h LEU 877 Cb 0.21 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1nkn h LEU 877 CO -0.02 0.46 0.60 -0.07 0.09 0.00 0.00 178.44 179.50 1nkn h LEU 878 N 0.78 1.01 -0.41 1.67 3.38 -0.86 0.28 115.31 121.15 1nkn h LEU 878 Ca 0.24 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 1nkn h LEU 878 Cb -0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1nkn h LEU 878 CO -0.08 0.70 -0.22 -0.33 0.09 0.00 0.00 178.44 178.60 1nkn h GLU 879 N 1.18 0.88 -0.25 1.13 5.08 -0.65 -1.50 114.58 120.44 1nkn h GLU 879 Ca 0.36 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1nkn h GLU 879 Cb -0.03 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1nkn h GLU 879 CO -0.11 1.04 0.03 1.96 -1.00 0.00 0.00 179.01 180.93 1nkn h GLN 880 N 0.70 0.42 -0.65 2.33 4.20 -0.30 -1.41 115.11 120.40 1nkn h GLN 880 Ca 0.09 -0.12 0.03 0.00 0.06 0.00 0.00 58.65 58.71 1nkn h GLN 880 Cb 0.79 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.48 1nkn h GLN 880 CO 0.06 0.56 0.40 0.87 -0.67 0.00 0.00 178.83 180.06 1nkn h LYS 881 N 0.22 0.76 -0.97 1.46 1.57 -0.42 -1.09 116.57 118.09 1nkn h LYS 881 Ca 0.07 -0.05 0.09 0.00 -1.87 0.00 0.00 60.65 58.90 1nkn h LYS 881 Cb 0.35 -0.17 -0.07 0.00 0.08 0.00 0.00 32.23 32.42 1nkn h LYS 881 CO 0.01 0.50 0.62 -0.97 -0.57 0.00 0.00 179.45 179.04 1nkn h ASN 882 N 0.78 0.93 -0.08 0.86 -0.73 -0.88 -0.63 115.58 115.84 1nkn h ASN 882 Ca 0.27 0.03 -0.02 0.00 1.87 0.00 0.00 56.30 58.45 1nkn h ASN 882 Cb 0.04 -0.17 -0.00 0.00 0.27 0.00 0.00 38.32 38.46 1nkn h ASN 882 CO -0.11 0.55 -0.02 0.44 -0.37 0.00 0.00 177.43 177.92 1nkn h ASP 883 N 1.03 0.16 -0.89 1.15 3.45 -0.26 -1.50 116.42 119.56 1nkn h ASP 883 Ca 0.45 -0.36 0.11 0.00 0.43 0.00 0.00 57.03 57.66 1nkn h ASP 883 Cb 0.35 -0.04 -0.08 0.00 -0.56 0.00 0.00 39.33 39.00 1nkn h ASP 883 CO -0.21 0.48 0.52 -0.07 -1.57 0.00 0.00 179.24 178.40 1nkn h LEU 884 N -0.17 0.74 -1.20 1.55 3.38 -0.53 0.50 115.31 119.57 1nkn h LEU 884 Ca 0.02 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1nkn h LEU 884 Cb 0.41 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1nkn h LEU 884 CO 0.01 0.39 0.21 -0.26 0.09 0.00 0.00 178.44 178.88 1nkn h PHE 885 N 0.83 0.76 0.38 1.13 0.04 -0.97 0.80 116.94 119.91 1nkn h PHE 885 Ca 0.44 -0.04 -0.02 0.00 2.80 0.00 0.00 57.97 61.16 1nkn h PHE 885 Cb 0.45 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 38.37 1nkn h PHE 885 CO -0.05 0.60 -0.18 0.78 -0.60 0.00 0.00 178.31 178.86 1nkn h GLY 886 N 0.89 -0.53 0.89 -1.45 0.00 0.91 -2.73 103.07 101.05 1nkn h GLY 886 Ca 0.18 0.20 0.02 0.00 0.00 0.00 0.00 47.33 47.73 1nkn h GLY 886 CO -0.02 -0.19 0.38 1.76 0.00 0.00 0.00 176.54 178.47 1nkn h SER 887 N -0.55 0.63 -0.71 0.19 0.02 -0.06 -2.59 113.55 110.48 1nkn h SER 887 Ca -0.05 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1nkn h SER 887 Cb 0.41 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 1nkn h SER 887 CO 0.08 0.44 0.47 0.24 -1.14 0.00 0.00 176.83 176.93 1nkn h MET 888 N 0.76 0.91 -0.40 3.45 2.07 -0.82 -0.56 114.93 120.34 1nkn h MET 888 Ca 0.24 -0.05 -0.04 0.00 -2.07 0.00 0.00 59.70 57.78 1nkn h MET 888 Cb 0.01 -0.21 -0.02 0.00 -1.87 0.00 0.00 31.60 29.51 1nkn h MET 888 CO -0.09 0.60 0.08 -0.22 1.07 0.00 0.00 176.91 178.34 1nkn h LYS 889 N 0.94 0.66 -0.82 1.72 3.11 -1.15 0.29 116.57 121.32 1nkn h LYS 889 Ca 0.27 -0.17 -0.03 0.00 -2.81 0.00 0.00 60.65 57.90 1nkn h LYS 889 Cb -0.07 -0.08 -0.04 0.00 -1.00 0.00 0.00 32.23 31.04 1nkn h LYS 889 CO -0.06 0.70 0.38 1.96 -2.81 0.00 0.00 179.45 179.62 1nkn h GLN 890 N 0.51 1.19 0.02 1.90 4.20 -1.20 -0.90 115.11 120.83 1nkn h GLN 890 Ca 0.12 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 1nkn h GLN 890 Cb 0.35 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1nkn h GLN 890 CO 0.01 0.92 -0.01 -0.07 -0.67 0.00 0.00 178.83 179.01 1nkn h LEU 891 N 1.17 -0.02 -0.45 1.46 3.38 -0.67 -1.78 115.31 118.41 1nkn h LEU 891 Ca 0.28 -0.28 0.07 0.00 0.09 0.00 0.00 57.88 58.04 1nkn h LEU 891 Cb 0.13 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 1nkn h LEU 891 CO -0.03 0.27 0.10 -0.33 0.09 0.00 0.00 178.44 178.54 1nkn h GLU 892 N -0.32 0.23 -0.17 1.13 5.08 -0.20 0.67 114.58 121.00 1nkn h GLU 892 Ca -0.00 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1nkn h GLU 892 Cb 0.30 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1nkn h GLU 892 CO 0.00 0.15 0.10 -0.44 -1.00 0.00 0.00 179.01 177.83 1nkn h ASP 893 N 0.24 0.20 -0.16 1.42 3.32 -1.08 -1.34 116.42 119.02 1nkn h ASP 893 Ca 0.22 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.17 1nkn h ASP 893 Cb 0.27 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 1nkn h ASP 893 CO -0.27 0.16 -0.24 0.50 -1.72 0.00 0.00 179.24 177.67 1nkn h LYS 894 N 0.24 0.44 -0.96 3.56 1.63 -0.07 -0.89 116.57 120.51 1nkn h LYS 894 Ca 0.06 -0.26 0.06 0.00 -0.85 0.00 0.00 60.65 59.66 1nkn h LYS 894 Cb -0.00 0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 31.59 1nkn h LYS 894 CO -0.01 0.85 0.61 0.28 -3.45 0.00 0.00 179.45 177.73 1nkn h VAL 895 N 0.07 1.08 -0.54 2.00 2.07 -0.32 0.16 116.25 120.77 1nkn h VAL 895 Ca 0.02 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.05 1nkn h VAL 895 Cb 0.81 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1nkn h VAL 895 CO 0.05 0.20 -0.05 -0.33 0.02 0.00 0.00 177.57 177.47 1nkn h GLU 896 N 1.12 0.99 -0.16 1.57 4.39 -1.08 -1.08 114.58 120.34 1nkn h GLU 896 Ca 0.41 -0.34 0.01 0.00 0.34 0.00 0.00 59.36 59.78 1nkn h GLU 896 Cb 0.16 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1nkn h GLU 896 CO -0.17 1.02 0.08 1.49 -1.16 0.00 0.00 179.01 180.26 1nkn h GLU 897 N 0.87 0.16 -0.62 2.33 4.81 0.13 -2.43 114.58 119.84 1nkn h GLU 897 Ca 0.15 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1nkn h GLU 897 Cb 0.61 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1nkn h GLU 897 CO 0.04 0.11 0.39 -0.07 -0.73 0.00 0.00 179.01 178.74 1nkn h LEU 898 N 0.16 0.73 -0.87 1.64 3.38 -0.55 -0.68 115.31 119.13 1nkn h LEU 898 Ca 0.06 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1nkn h LEU 898 Cb 0.01 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 1nkn h LEU 898 CO -0.04 0.56 0.57 -0.07 0.09 0.00 0.00 178.44 179.54 1nkn h LEU 899 N 0.84 1.01 0.04 1.67 4.07 -1.05 0.83 115.31 122.72 1nkn h LEU 899 Ca 0.22 -0.04 -0.00 0.00 0.08 0.00 0.00 57.88 58.15 1nkn h LEU 899 Cb -0.05 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.44 1nkn h LEU 899 CO -0.04 0.74 -0.02 -1.28 -1.08 0.00 0.00 178.44 176.75 1nkn h SER 900 N 1.18 -0.05 -0.79 -0.43 0.87 -1.08 -1.03 113.55 112.23 1nkn h SER 900 Ca 0.32 -0.35 0.08 0.00 -1.23 0.00 0.00 61.79 60.60 1nkn h SER 900 Cb -0.12 0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 61.79 1nkn h SER 900 CO -0.07 0.33 0.46 0.11 -0.53 0.00 0.00 176.83 177.13 1nkn h LYS 901 N -0.44 0.78 0.00 2.24 1.57 -0.88 -1.05 116.57 118.79 1nkn h LYS 901 Ca -0.01 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 1nkn h LYS 901 Cb 0.40 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1nkn h LYS 901 CO 0.01 0.52 -0.34 -0.91 -0.57 0.00 0.00 179.45 178.16 1nkn h ASN 902 N 0.81 0.00 0.03 0.86 4.21 -0.77 -1.03 115.58 119.68 1nkn h ASN 902 Ca 0.36 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.87 1nkn h ASN 902 Cb 0.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.46 1nkn h ASN 902 CO -0.21 0.34 -0.01 0.22 -1.29 0.00 0.00 177.43 176.47 1nkn h TYR 903 N 0.00 -0.04 0.00 1.19 5.03 0.07 -0.35 116.97 122.88 1nkn h TYR 903 Ca -0.00 -0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.27 1nkn h TYR 903 Cb 0.62 0.01 -0.00 0.00 1.55 0.00 0.00 36.73 38.91 1nkn h TYR 903 CO 0.00 0.39 -0.15 0.45 -1.32 0.00 0.00 178.16 177.53 1nkn h HIS 904 N -0.48 0.00 -0.03 -3.82 3.86 -1.17 -1.94 115.15 111.57 1nkn h HIS 904 Ca -0.00 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 1nkn h HIS 904 Cb 0.45 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.92 1nkn h HIS 904 CO 0.07 0.15 -0.11 -0.07 0.86 0.00 0.00 177.93 178.83 1nkn h LEU 905 N 0.00 0.15 -1.12 2.43 3.38 -0.98 -2.23 115.31 116.94 1nkn h LEU 905 Ca -0.00 -0.64 0.06 0.00 0.09 0.00 0.00 57.88 57.39 1nkn h LEU 905 Cb 0.35 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 1nkn h LEU 905 CO 0.02 0.77 0.60 -0.33 0.09 0.00 0.00 178.44 179.59 1nkn h GLU 906 N -0.46 1.03 -0.71 1.13 5.08 -0.74 -1.10 114.58 118.80 1nkn h GLU 906 Ca -0.01 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1nkn h GLU 906 Cb 0.76 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 1nkn h GLU 906 CO 0.02 0.68 0.33 -0.91 -1.00 0.00 0.00 179.01 178.13 1nkn h ASN 907 N 1.06 0.95 1.01 1.42 -0.26 -1.33 -2.02 115.58 116.42 1nkn h ASN 907 Ca 0.40 -0.14 -0.06 0.00 -0.56 0.00 0.00 56.30 55.93 1nkn h ASN 907 Cb 0.19 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.20 1nkn h ASN 907 CO -0.15 0.83 -0.31 -0.33 -1.06 0.00 0.00 177.43 176.41 1nkn h GLU 908 N 1.00 0.00 0.00 0.81 5.08 -0.70 -0.98 114.58 119.79 1nkn h GLU 908 Ca 0.24 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.51 1nkn h GLU 908 Cb 0.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1nkn h GLU 908 CO -0.03 0.31 -0.43 0.28 -1.00 0.00 0.00 179.01 178.14 1nkn h VAL 909 N 0.00 1.03 0.14 3.13 2.07 -0.69 -1.71 116.25 120.22 1nkn h VAL 909 Ca -0.00 -1.64 -0.30 0.00 0.82 0.00 0.00 66.70 65.57 1nkn h VAL 909 Cb 0.90 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1nkn h VAL 909 CO 0.04 0.42 -1.47 0.00 0.02 0.00 0.00 177.57 176.58 1nkn h ALA 910 N 1.57 0.19 -0.15 1.67 0.00 -0.80 -1.49 119.26 120.24 1nkn h ALA 910 Ca -0.00 -1.04 -0.02 0.00 0.00 0.00 0.00 54.91 53.85 1nkn h ALA 910 Cb 0.93 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1nkn h ALA 910 CO 0.06 1.06 0.01 -0.09 0.00 0.00 0.00 179.25 180.29 1nkn h ARG 911 N 0.08 0.26 0.00 0.00 2.43 -1.08 -1.78 114.38 114.28 1nkn h ARG 911 Ca -0.22 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 58.78 1nkn h ARG 911 Cb 2.02 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.53 1nkn h ARG 911 CO 0.18 0.46 -0.42 -0.07 -1.51 0.00 0.00 179.97 178.61 1nkn h LEU 912 N 0.02 0.00 -0.15 3.80 3.38 -1.43 -2.84 115.31 118.09 1nkn h LEU 912 Ca 0.04 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 1nkn h LEU 912 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1nkn h LEU 912 CO 0.01 0.42 -0.33 0.50 0.09 0.00 0.00 178.44 179.12 1nkn h LYS 913 N 0.00 0.48 -0.00 1.13 3.64 -1.11 -1.35 116.57 119.36 1nkn h LYS 913 Ca -0.00 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1nkn h LYS 913 Cb 0.98 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1nkn h LYS 913 CO 0.05 0.93 0.00 1.63 -2.27 0.00 0.00 179.45 179.80 1nkn n LYS 914 N -4.36 1.05 -0.10 1.90 5.02 -0.68 -0.79 118.16 120.20 1nkn n LYS 914 Ca -0.07 -0.08 -0.15 0.00 -2.02 0.00 0.00 58.31 55.99 1nkn n LYS 914 Cb 0.49 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.96 1nkn n LYS 914 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1nkn n LEU 915 N -0.89 1.88 0.13 -0.35 7.94 -1.07 -4.37 117.00 120.27 1nkn n LEU 915 Ca 0.23 0.46 -0.01 0.00 -1.11 0.00 0.00 56.01 55.57 1nkn n LEU 915 Cb 0.13 -0.86 0.21 0.00 0.53 0.00 0.00 43.42 43.42 1nkn n LEU 915 CO 0.17 -0.02 0.57 0.58 -1.11 0.00 0.00 177.39 177.59 1nkn h VAL 916 N -1.00 1.37 -1.45 1.96 2.07 -1.29 -3.49 116.25 114.42 1nkn h VAL 916 Ca -0.24 -1.80 0.00 0.00 0.82 0.00 0.00 66.70 65.48 1nkn h VAL 916 Cb 1.05 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.75 1nkn h VAL 916 CO -0.14 0.52 0.00 0.61 0.02 0.00 0.00 177.57 178.58 1nkn n GLY 917 N 0.02 -1.41 1.80 2.17 0.00 0.03 -5.08 105.19 102.71 1nkn n GLY 917 Ca -0.02 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1nkn n GLY 917 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nkn n GLU 918 N 0.23 0.00 0.00 1.61 1.02 -1.07 -5.03 120.64 117.40 1nkn n GLU 918 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1nkn n GLU 918 Cb 0.00 -0.01 0.00 0.00 -0.02 0.00 0.00 31.44 31.41 1nkn n GLU 918 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85