#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nkn n GLU 844 N 0.00 0.00 0.16 3.49 2.13 -1.26 -2.95 120.64 122.21 1nkn n GLU 844 Ca 0.00 0.10 0.11 0.00 0.66 0.00 0.00 57.16 58.03 1nkn n GLU 844 Cb 0.00 -1.84 0.57 0.00 0.27 0.00 0.00 31.44 30.44 1nkn n GLU 844 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1nkn n GLU 845 N -1.05 0.14 -0.07 5.31 2.13 -1.26 -2.04 120.64 123.79 1nkn n GLU 845 Ca 0.00 0.63 0.17 0.00 0.66 0.00 0.00 57.16 58.62 1nkn n GLU 845 Cb 0.34 -1.94 0.60 0.00 0.27 0.00 0.00 31.44 30.70 1nkn n GLU 845 CO 0.00 0.00 0.00 1.98 -0.41 0.00 0.00 177.13 178.70 1nkn h MET 846 N 0.00 0.20 -0.35 5.31 4.05 -1.98 0.53 114.93 122.69 1nkn h MET 846 Ca 0.00 -0.01 -0.07 0.00 -0.28 0.00 0.00 59.70 59.34 1nkn h MET 846 Cb 0.01 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 30.75 1nkn h MET 846 CO 0.00 0.13 -0.09 -0.22 0.23 0.00 0.00 176.91 176.97 1nkn h LYS 847 N 0.21 0.59 -0.26 0.39 3.64 -1.73 -2.38 116.57 117.02 1nkn h LYS 847 Ca 0.30 -0.16 -0.08 0.00 -1.27 0.00 0.00 60.65 59.43 1nkn h LYS 847 Cb 0.90 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.64 1nkn h LYS 847 CO -0.06 0.67 -0.20 1.49 -2.27 0.00 0.00 179.45 179.08 1nkn h GLU 848 N 0.54 0.46 0.00 1.90 4.22 -0.14 -1.65 114.58 119.92 1nkn h GLU 848 Ca 0.10 -0.16 -0.07 0.00 0.08 0.00 0.00 59.36 59.31 1nkn h GLU 848 Cb 0.48 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1nkn h GLU 848 CO 0.03 0.65 -0.35 1.96 -2.18 0.00 0.00 179.01 179.11 1nkn h GLN 849 N 0.42 0.00 0.17 1.92 4.20 -0.88 -2.45 115.11 118.49 1nkn h GLN 849 Ca 0.07 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.47 1nkn h GLN 849 Cb 0.59 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.39 1nkn h GLN 849 CO 0.04 0.35 -1.40 -0.07 -0.67 0.00 0.00 178.83 177.08 1nkn h LEU 850 N 0.00 0.57 -1.44 1.46 3.38 -1.20 -2.00 115.31 116.07 1nkn h LEU 850 Ca -0.00 -0.65 -0.04 0.00 0.09 0.00 0.00 57.88 57.28 1nkn h LEU 850 Cb 0.73 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1nkn h LEU 850 CO 0.05 1.51 -0.04 0.11 0.09 0.00 0.00 178.44 180.16 1nkn h LYS 851 N 0.10 0.31 -0.05 1.13 1.57 -1.13 -0.06 116.57 118.44 1nkn h LYS 851 Ca -0.21 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.33 1nkn h LYS 851 Cb 2.05 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 34.33 1nkn h LYS 851 CO 0.22 0.37 -0.72 1.96 -0.57 0.00 0.00 179.45 180.72 1nkn h GLN 852 N 0.30 0.56 -0.80 3.15 4.20 -1.48 -2.96 115.11 118.08 1nkn h GLN 852 Ca 0.07 -0.55 0.15 0.00 0.06 0.00 0.00 58.65 58.38 1nkn h GLN 852 Cb 0.28 0.14 -0.10 0.00 0.30 0.00 0.00 27.48 28.10 1nkn h GLN 852 CO 0.01 1.17 0.36 1.98 -0.67 0.00 0.00 178.83 181.69 1nkn h MET 853 N 0.16 0.51 -0.59 1.46 4.05 -0.52 0.31 114.93 120.31 1nkn h MET 853 Ca -0.08 -0.03 -0.10 0.00 -0.28 0.00 0.00 59.70 59.22 1nkn h MET 853 Cb 1.39 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 32.05 1nkn h MET 853 CO 0.14 0.34 -0.01 -0.44 0.23 0.00 0.00 176.91 177.17 1nkn h ASP 854 N 0.52 1.02 -0.64 1.39 5.19 -1.02 0.53 116.42 123.41 1nkn h ASP 854 Ca 0.44 -0.29 -0.05 0.00 -0.62 0.00 0.00 57.03 56.51 1nkn h ASP 854 Cb 0.65 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 39.86 1nkn h ASP 854 CO -0.39 1.08 0.19 0.50 -3.12 0.00 0.00 179.24 177.50 1nkn h LYS 855 N 0.95 1.00 -0.35 3.56 1.63 -1.04 -1.34 116.57 120.97 1nkn h LYS 855 Ca 0.17 -0.22 -0.06 0.00 -0.85 0.00 0.00 60.65 59.69 1nkn h LYS 855 Cb 0.56 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.03 1nkn h LYS 855 CO 0.03 0.88 -0.04 1.98 -3.45 0.00 0.00 179.45 178.85 1nkn h MET 856 N 0.92 0.57 -0.07 1.90 4.05 -0.69 -1.88 114.93 119.72 1nkn h MET 856 Ca 0.20 -0.14 -0.14 0.00 -0.28 0.00 0.00 59.70 59.35 1nkn h MET 856 Cb 0.30 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.02 1nkn h MET 856 CO -0.01 0.62 -0.58 0.87 0.23 0.00 0.00 176.91 178.05 1nkn h LYS 857 N 0.54 0.23 -0.15 0.39 1.57 -0.37 -1.92 116.57 116.86 1nkn h LYS 857 Ca 0.11 -0.15 -0.19 0.00 -1.87 0.00 0.00 60.65 58.55 1nkn h LYS 857 Cb 0.40 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 1nkn h LYS 857 CO 0.02 0.74 -0.66 0.93 -0.57 0.00 0.00 179.45 179.91 1nkn h GLU 858 N 0.18 0.59 -0.49 3.15 5.08 -0.87 -2.32 114.58 119.90 1nkn h GLU 858 Ca -0.00 -0.43 -0.09 0.00 -1.00 0.00 0.00 59.36 57.84 1nkn h GLU 858 Cb 1.07 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 1nkn h GLU 858 CO 0.09 1.05 -0.04 -0.44 -1.00 0.00 0.00 179.01 178.67 1nkn h ASP 859 N 0.43 0.82 -0.17 1.42 3.32 -1.16 -1.61 116.42 119.47 1nkn h ASP 859 Ca -0.02 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.80 1nkn h ASP 859 Cb 1.25 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 1nkn h ASP 859 CO 0.13 0.91 0.07 0.25 -1.72 0.00 0.00 179.24 178.87 1nkn h LEU 860 N 0.78 0.23 -0.43 1.55 5.85 -1.26 -0.76 115.31 121.26 1nkn h LEU 860 Ca 0.14 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.73 1nkn h LEU 860 Cb 0.53 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 1nkn h LEU 860 CO 0.03 0.33 0.21 0.00 -0.34 0.00 0.00 178.44 178.67 1nkn h ALA 861 N 0.91 0.54 -0.05 1.25 0.00 -1.16 0.71 119.26 121.46 1nkn h ALA 861 Ca 0.06 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1nkn h ALA 861 Cb 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1nkn h ALA 861 CO -0.00 -0.15 -0.01 -0.22 0.00 0.00 0.00 179.25 178.86 1nkn h LYS 862 N 0.42 0.00 0.39 0.00 3.64 -1.15 -1.64 116.57 118.24 1nkn h LYS 862 Ca 0.19 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 1nkn h LYS 862 Cb 0.11 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1nkn h LYS 862 CO -0.14 0.00 -0.19 1.15 -2.27 0.00 0.00 179.45 178.00 1nkn h THR 863 N 0.00 0.62 -0.82 1.00 2.02 -0.82 -2.04 112.91 112.87 1nkn h THR 863 Ca 0.02 -0.08 0.15 0.00 0.77 0.00 0.00 66.41 67.27 1nkn h THR 863 Cb 0.03 0.66 -0.10 0.00 -1.74 0.00 0.00 68.15 67.01 1nkn h THR 863 CO -0.05 0.02 0.39 -0.33 0.37 0.00 0.00 175.52 175.92 1nkn h GLU 864 N -0.58 0.53 -0.98 6.66 4.39 -0.82 0.77 114.58 124.56 1nkn h GLU 864 Ca -0.05 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1nkn h GLU 864 Cb 0.43 -0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 28.92 1nkn h GLU 864 CO 0.09 0.35 0.63 -0.09 -1.16 0.00 0.00 179.01 178.83 1nkn h ARG 865 N 0.55 1.30 -0.06 2.33 2.43 -1.07 -1.75 114.38 118.12 1nkn h ARG 865 Ca 0.46 -0.09 -0.09 0.00 -0.81 0.00 0.00 59.98 59.44 1nkn h ARG 865 Cb 0.68 -0.29 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1nkn h ARG 865 CO -0.39 0.88 -0.32 0.82 -1.51 0.00 0.00 179.97 179.45 1nkn h ILE 866 N 1.33 1.44 -0.68 1.20 2.04 -0.21 -3.06 117.51 119.57 1nkn h ILE 866 Ca 0.36 -1.77 0.00 0.00 1.00 0.00 0.00 64.86 64.45 1nkn h ILE 866 Cb -0.12 2.40 -0.03 0.00 -0.74 0.00 0.00 36.82 38.32 1nkn h ILE 866 CO -0.07 0.50 0.44 0.07 0.00 0.00 0.00 178.15 179.09 1nkn h LYS 867 N -0.20 0.90 -0.40 2.37 2.10 -0.81 -0.19 116.57 120.33 1nkn h LYS 867 Ca -0.02 -0.06 -0.04 0.00 -2.00 0.00 0.00 60.65 58.53 1nkn h LYS 867 Cb 0.99 -0.20 -0.02 0.00 -0.90 0.00 0.00 32.23 32.10 1nkn h LYS 867 CO 0.07 0.60 0.09 -0.22 -2.00 0.00 0.00 179.45 177.99 1nkn h LYS 868 N 0.92 0.60 -0.30 0.07 3.64 -1.37 0.62 116.57 120.75 1nkn h LYS 868 Ca 0.25 -0.10 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 1nkn h LYS 868 Cb -0.09 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1nkn h LYS 868 CO -0.05 0.56 -0.14 1.49 -2.27 0.00 0.00 179.45 179.03 1nkn h GLU 869 N 0.58 0.63 -0.50 1.90 4.81 -1.04 -1.69 114.58 119.27 1nkn h GLU 869 Ca 0.13 -0.27 -0.10 0.00 -0.13 0.00 0.00 59.36 58.99 1nkn h GLU 869 Cb 0.24 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1nkn h GLU 869 CO -0.00 0.86 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.98 1nkn h LEU 870 N 0.38 0.90 -0.16 1.64 3.38 -0.13 -2.40 115.31 118.92 1nkn h LEU 870 Ca 0.07 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1nkn h LEU 870 Cb 0.67 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1nkn h LEU 870 CO 0.04 1.01 0.10 -0.33 0.09 0.00 0.00 178.44 179.35 1nkn h GLU 871 N 0.82 0.19 -0.24 1.13 5.08 0.37 0.49 114.58 122.43 1nkn h GLU 871 Ca 0.14 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1nkn h GLU 871 Cb 0.61 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1nkn h GLU 871 CO 0.04 0.13 0.10 0.93 -1.00 0.00 0.00 179.01 179.21 1nkn h GLU 872 N 0.20 0.22 0.00 2.33 5.08 -1.14 -2.21 114.58 119.06 1nkn h GLU 872 Ca 0.06 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 1nkn h GLU 872 Cb -0.01 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1nkn h GLU 872 CO -0.02 0.15 -0.43 -0.56 -1.00 0.00 0.00 179.01 177.14 1nkn h GLN 873 N 0.23 0.00 0.00 2.33 3.07 -1.21 -2.12 115.11 117.41 1nkn h GLN 873 Ca 0.10 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.76 1nkn h GLN 873 Cb 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.59 1nkn h GLN 873 CO -0.08 0.43 -0.39 -0.91 0.09 0.00 0.00 178.83 177.97 1nkn h ASN 874 N 0.00 0.00 -0.30 0.06 2.35 -0.56 -0.67 115.58 116.45 1nkn h ASN 874 Ca -0.00 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.60 1nkn h ASN 874 Cb 0.78 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.14 1nkn h ASN 874 CO 0.06 0.39 -0.36 0.58 -1.65 0.00 0.00 177.43 176.44 1nkn h VAL 875 N 0.00 1.29 -0.25 2.81 2.07 -0.79 -0.60 116.25 120.79 1nkn h VAL 875 Ca -0.00 -1.54 -0.09 0.00 0.82 0.00 0.00 66.70 65.88 1nkn h VAL 875 Cb 0.78 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1nkn h VAL 875 CO 0.05 0.50 -0.24 0.74 0.02 0.00 0.00 177.57 178.64 1nkn h THR 876 N 0.53 1.26 -0.38 2.57 2.02 -1.10 -1.69 112.91 116.13 1nkn h THR 876 Ca 0.04 -1.25 -0.10 0.00 0.77 0.00 0.00 66.41 65.86 1nkn h THR 876 Cb 0.95 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.69 1nkn h THR 876 CO 0.09 0.40 -0.16 -0.07 0.37 0.00 0.00 175.52 176.14 1nkn h LEU 877 N 0.43 0.80 -0.72 2.58 3.38 -0.98 -2.35 115.31 118.45 1nkn h LEU 877 Ca 0.06 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.66 1nkn h LEU 877 Cb 0.66 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 1nkn h LEU 877 CO 0.05 1.02 0.46 -0.07 0.09 0.00 0.00 178.44 179.99 1nkn h LEU 878 N 0.58 0.76 -0.06 1.67 -0.00 -0.77 0.05 115.31 117.53 1nkn h LEU 878 Ca 0.09 -0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.98 1nkn h LEU 878 Cb 0.71 -0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 41.18 1nkn h LEU 878 CO 0.05 0.53 -0.04 -0.33 -0.00 0.00 0.00 178.44 178.65 1nkn h GLU 879 N 0.90 -0.04 -0.72 1.13 5.08 -1.20 -1.87 114.58 117.87 1nkn h GLU 879 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1nkn h GLU 879 Cb -0.00 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 1nkn h GLU 879 CO -0.10 -0.03 0.46 1.96 -1.00 0.00 0.00 179.01 180.30 1nkn h GLN 880 N -0.04 0.95 -0.95 2.33 4.20 -0.85 0.83 115.11 121.58 1nkn h GLN 880 Ca 0.04 -0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.70 1nkn h GLN 880 Cb 0.10 -0.21 -0.05 0.00 0.30 0.00 0.00 27.48 27.62 1nkn h GLN 880 CO -0.09 0.65 0.63 -0.22 -0.67 0.00 0.00 178.83 179.13 1nkn h LYS 881 N 0.97 1.23 -0.19 1.46 3.64 -0.72 -0.18 116.57 122.79 1nkn h LYS 881 Ca 0.26 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.52 1nkn h LYS 881 Cb -0.09 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 31.45 1nkn h LYS 881 CO -0.05 0.82 -0.08 -0.91 -2.27 0.00 0.00 179.45 176.95 1nkn h ASN 882 N 1.27 0.41 -0.54 4.20 4.21 -0.86 -0.59 115.58 123.67 1nkn h ASN 882 Ca 0.35 -0.40 0.07 0.00 1.21 0.00 0.00 56.30 57.53 1nkn h ASN 882 Cb -0.12 -0.11 -0.03 0.00 -1.12 0.00 0.00 38.32 36.93 1nkn h ASN 882 CO -0.08 0.71 0.36 0.44 -1.29 0.00 0.00 177.43 177.57 1nkn h ASP 883 N 0.10 0.40 0.01 5.81 5.19 -0.26 -0.32 116.42 127.35 1nkn h ASP 883 Ca 0.05 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.46 1nkn h ASP 883 Cb 0.55 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.98 1nkn h ASP 883 CO 0.03 0.26 -0.00 -0.07 -3.12 0.00 0.00 179.24 176.33 1nkn h LEU 884 N 0.45 -0.01 -1.57 1.55 3.38 -0.85 -2.82 115.31 115.45 1nkn h LEU 884 Ca 0.24 -0.75 0.18 0.00 0.09 0.00 0.00 57.88 57.65 1nkn h LEU 884 Cb 0.36 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.06 1nkn h LEU 884 CO -0.07 0.76 0.56 0.15 0.09 0.00 0.00 178.44 179.93 1nkn h PHE 885 N -0.78 0.48 -0.04 1.13 3.57 -0.60 0.68 116.94 121.37 1nkn h PHE 885 Ca -0.00 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.38 1nkn h PHE 885 Cb 0.76 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1nkn h PHE 885 CO 0.19 0.15 -0.57 0.78 -2.23 0.00 0.00 178.31 176.64 1nkn h GLY 886 N 0.38 0.15 1.54 2.40 0.00 -1.06 -2.30 103.07 104.18 1nkn h GLY 886 Ca 0.42 -0.18 -0.24 0.00 0.00 0.00 0.00 47.33 47.34 1nkn h GLY 886 CO -0.14 0.16 -1.02 1.76 0.00 0.00 0.00 176.54 177.29 1nkn h SER 887 N 0.11 0.53 0.33 0.19 0.02 0.41 -2.95 113.55 112.19 1nkn h SER 887 Ca -0.00 -0.46 -0.03 0.00 -0.84 0.00 0.00 61.79 60.46 1nkn h SER 887 Cb 1.03 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.40 1nkn h SER 887 CO 0.08 1.28 -0.16 -0.03 -1.14 0.00 0.00 176.83 176.86 1nkn h MET 888 N 0.20 0.00 -0.02 3.45 -1.53 -0.24 -2.56 114.93 114.22 1nkn h MET 888 Ca -0.10 0.00 -0.26 0.00 -3.44 0.00 0.00 59.70 55.90 1nkn h MET 888 Cb 1.68 0.00 0.02 0.00 -0.55 0.00 0.00 31.60 32.75 1nkn h MET 888 CO 0.18 0.16 -1.00 0.87 0.14 0.00 0.00 176.91 177.26 1nkn h LYS 889 N 0.00 0.71 -0.01 0.39 1.79 -1.30 -2.81 116.57 115.35 1nkn h LYS 889 Ca -0.00 -0.74 -0.00 0.00 -2.18 0.00 0.00 60.65 57.73 1nkn h LYS 889 Cb 0.37 0.20 -0.00 0.00 -1.58 0.00 0.00 32.23 31.22 1nkn h LYS 889 CO 0.02 1.32 0.00 1.96 -1.08 0.00 0.00 179.45 181.67 1nkn h GLN 890 N 0.40 0.01 -0.49 3.15 4.20 -1.30 -1.05 115.11 120.02 1nkn h GLN 890 Ca -0.12 -0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.68 1nkn h GLN 890 Cb 1.65 -0.00 -0.08 0.00 0.30 0.00 0.00 27.48 29.35 1nkn h GLN 890 CO 0.20 0.11 0.05 -0.07 -0.67 0.00 0.00 178.83 178.45 1nkn h LEU 891 N -0.09 -0.11 -0.75 1.46 3.38 -1.56 0.29 115.31 117.94 1nkn h LEU 891 Ca 0.00 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.11 1nkn h LEU 891 Cb 0.10 0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 1nkn h LEU 891 CO -0.00 -0.02 0.47 -0.33 0.09 0.00 0.00 178.44 178.65 1nkn h GLU 892 N 0.17 0.90 -0.04 1.13 5.08 -1.31 0.55 114.58 121.06 1nkn h GLU 892 Ca 0.25 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1nkn h GLU 892 Cb 0.36 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 1nkn h GLU 892 CO -0.37 0.59 0.03 -0.44 -1.00 0.00 0.00 179.01 177.82 1nkn h ASP 893 N 0.92 0.05 0.00 1.42 3.32 0.20 -0.51 116.42 121.82 1nkn h ASP 893 Ca 0.30 -0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.36 1nkn h ASP 893 Cb 0.01 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 1nkn h ASP 893 CO -0.11 0.05 -0.20 0.50 -1.72 0.00 0.00 179.24 177.76 1nkn h LYS 894 N 0.04 -0.32 -0.91 3.56 1.63 0.49 -0.32 116.57 120.74 1nkn h LYS 894 Ca 0.01 0.02 0.18 0.00 -0.85 0.00 0.00 60.65 60.01 1nkn h LYS 894 Cb 0.01 0.07 -0.07 0.00 -0.60 0.00 0.00 32.23 31.64 1nkn h LYS 894 CO -0.00 -0.21 0.59 0.28 -3.45 0.00 0.00 179.45 176.66 1nkn h VAL 895 N -0.33 0.75 -0.25 2.00 2.07 0.36 0.12 116.25 120.97 1nkn h VAL 895 Ca 0.06 -0.20 -0.12 0.00 0.82 0.00 0.00 66.70 67.26 1nkn h VAL 895 Cb 0.40 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1nkn h VAL 895 CO -0.19 0.11 -0.31 -0.08 0.02 0.00 0.00 177.57 177.12 1nkn h GLU 896 N 0.58 0.65 0.29 1.57 4.81 0.21 -1.24 114.58 121.45 1nkn h GLU 896 Ca 0.48 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1nkn h GLU 896 Cb 0.94 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.35 1nkn h GLU 896 CO -0.22 0.98 -0.14 1.49 -0.73 0.00 0.00 179.01 180.39 1nkn h GLU 897 N 0.36 -0.37 -0.68 1.92 4.81 0.21 -0.46 114.58 120.37 1nkn h GLU 897 Ca 0.03 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.39 1nkn h GLU 897 Cb 0.89 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 30.27 1nkn h GLU 897 CO 0.07 -0.16 0.30 -0.07 -0.73 0.00 0.00 179.01 178.42 1nkn h LEU 898 N -0.51 0.33 -1.10 1.64 4.07 -0.85 0.10 115.31 118.98 1nkn h LEU 898 Ca -0.04 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.00 1nkn h LEU 898 Cb 0.38 0.04 -0.04 0.00 1.08 0.00 0.00 40.66 42.12 1nkn h LEU 898 CO 0.06 0.18 0.53 0.25 -1.08 0.00 0.00 178.44 178.38 1nkn h LEU 899 N 0.49 1.00 0.35 1.67 5.85 -1.05 0.18 115.31 123.81 1nkn h LEU 899 Ca 0.35 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 59.01 1nkn h LEU 899 Cb 0.44 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1nkn h LEU 899 CO -0.32 0.75 -0.17 -1.28 -0.34 0.00 0.00 178.44 177.09 1nkn h SER 900 N 1.16 -0.40 -0.59 1.25 0.87 0.85 -0.28 113.55 116.42 1nkn h SER 900 Ca 0.31 -0.12 0.11 0.00 -1.23 0.00 0.00 61.79 60.86 1nkn h SER 900 Cb -0.08 0.10 -0.09 0.00 -0.44 0.00 0.00 62.40 61.90 1nkn h SER 900 CO -0.06 -0.10 0.11 0.11 -0.53 0.00 0.00 176.83 176.37 1nkn h LYS 901 N -0.72 0.24 -0.84 2.24 1.57 -0.77 -0.04 116.57 118.23 1nkn h LYS 901 Ca -0.05 -0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.85 1nkn h LYS 901 Cb 0.50 -0.05 -0.09 0.00 0.08 0.00 0.00 32.23 32.66 1nkn h LYS 901 CO 0.08 0.16 0.44 -0.97 -0.57 0.00 0.00 179.45 178.59 1nkn h ASN 902 N 0.24 0.55 -0.45 0.86 -0.73 -0.34 0.21 115.58 115.93 1nkn h ASN 902 Ca 0.31 0.08 -0.11 0.00 1.87 0.00 0.00 56.30 58.45 1nkn h ASN 902 Cb 0.45 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 39.02 1nkn h ASN 902 CO -0.40 0.25 -0.15 0.22 -0.37 0.00 0.00 177.43 176.98 1nkn h TYR 903 N 0.65 1.02 -0.09 0.67 5.03 0.79 -1.73 116.97 123.32 1nkn h TYR 903 Ca 0.45 -0.23 -0.10 0.00 2.58 0.00 0.00 58.73 61.43 1nkn h TYR 903 Cb 0.60 -0.24 -0.01 0.00 1.55 0.00 0.00 36.73 38.62 1nkn h TYR 903 CO -0.09 1.01 -0.41 0.45 -1.32 0.00 0.00 178.16 177.81 1nkn h HIS 904 N 0.74 0.23 -0.01 -3.82 3.86 -0.48 -2.96 115.15 112.71 1nkn h HIS 904 Ca 0.11 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1nkn h HIS 904 Cb 0.70 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 29.12 1nkn h HIS 904 CO 0.05 0.58 -0.01 -0.07 0.86 0.00 0.00 177.93 179.35 1nkn h LEU 905 N 0.17 0.02 -1.89 2.43 3.38 -0.84 -2.79 115.31 115.79 1nkn h LEU 905 Ca 0.02 -0.45 0.25 0.00 0.09 0.00 0.00 57.88 57.79 1nkn h LEU 905 Cb 0.80 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.50 1nkn h LEU 905 CO 0.06 0.46 0.64 -0.33 0.09 0.00 0.00 178.44 179.36 1nkn h GLU 906 N -0.42 0.08 -0.11 1.13 4.39 -1.25 0.83 114.58 119.23 1nkn h GLU 906 Ca 0.00 -0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.54 1nkn h GLU 906 Cb 0.46 -0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1nkn h GLU 906 CO 0.00 0.06 -0.55 -0.91 -1.16 0.00 0.00 179.01 176.44 1nkn h ASN 907 N 0.09 0.68 -0.12 1.42 2.35 -1.37 -2.15 115.58 116.48 1nkn h ASN 907 Ca 0.44 -0.64 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1nkn h ASN 907 Cb 1.62 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.78 1nkn h ASN 907 CO -0.05 1.21 0.06 -0.33 -1.65 0.00 0.00 177.43 176.68 1nkn h GLU 908 N 0.19 0.21 0.01 0.81 4.39 -0.60 0.20 114.58 119.78 1nkn h GLU 908 Ca -0.04 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.64 1nkn h GLU 908 Cb 1.20 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 1nkn h GLU 908 CO 0.11 0.17 -0.00 0.28 -1.16 0.00 0.00 179.01 178.41 1nkn h VAL 909 N 0.21 1.48 -0.46 3.13 2.07 -1.28 -1.87 116.25 119.53 1nkn h VAL 909 Ca 0.05 -1.48 0.08 0.00 0.82 0.00 0.00 66.70 66.17 1nkn h VAL 909 Cb 0.04 2.48 -0.07 0.00 -1.52 0.00 0.00 31.29 32.23 1nkn h VAL 909 CO -0.01 0.38 0.05 0.00 0.02 0.00 0.00 177.57 178.02 1nkn h ALA 910 N 0.33 0.48 0.09 1.67 0.00 -0.89 0.32 119.26 121.26 1nkn h ALA 910 Ca -0.00 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1nkn h ALA 910 Cb 0.63 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1nkn h ALA 910 CO 0.00 -0.35 -0.15 -0.09 0.00 0.00 0.00 179.25 178.66 1nkn h ARG 911 N 0.17 -0.25 -0.20 0.00 2.43 -0.62 -2.54 114.38 113.37 1nkn h ARG 911 Ca 0.23 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.47 1nkn h ARG 911 Cb 0.32 0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 29.86 1nkn h ARG 911 CO -0.33 -0.17 -0.28 -0.07 -1.51 0.00 0.00 179.97 177.61 1nkn h LEU 912 N -0.26 -0.87 -1.82 3.80 3.38 -1.14 -1.19 115.31 117.21 1nkn h LEU 912 Ca -0.01 0.14 0.26 0.00 0.09 0.00 0.00 57.88 58.36 1nkn h LEU 912 Cb 0.24 0.39 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 1nkn h LEU 912 CO -0.05 -0.31 0.77 0.11 0.09 0.00 0.00 178.44 179.05 1nkn h LYS 913 N -0.31 0.00 -0.08 1.13 1.57 -0.88 0.37 116.57 118.38 1nkn h LYS 913 Ca 0.12 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.70 1nkn h LYS 913 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1nkn h LYS 913 CO -0.38 0.00 -0.79 -0.22 -0.57 0.00 0.00 179.45 177.49 1nkn h LYS 914 N 0.00 0.50 0.00 3.15 3.64 -0.77 0.30 116.57 123.39 1nkn h LYS 914 Ca 0.42 -0.44 -0.14 0.00 -1.27 0.00 0.00 60.65 59.22 1nkn h LYS 914 Cb 1.96 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 33.86 1nkn h LYS 914 CO -0.00 1.07 -0.68 -0.07 -2.27 0.00 0.00 179.45 177.50 1nkn h LEU 915 N 0.33 0.00 -1.03 5.20 3.38 -0.22 -3.21 115.31 119.76 1nkn h LEU 915 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1nkn h LEU 915 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1nkn h LEU 915 CO 0.14 0.68 -0.06 0.52 0.09 0.00 0.00 178.44 179.81 1nkn n VAL 916 N -3.57 0.00 -2.83 1.22 0.31 -0.63 -4.97 118.33 107.86 1nkn n VAL 916 Ca -0.00 -0.27 -0.10 0.00 -0.01 0.00 0.00 64.34 63.96 1nkn n VAL 916 Cb 0.70 0.65 0.05 0.00 -0.91 0.00 0.00 33.84 34.33 1nkn n VAL 916 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nkn n GLY 917 N 1.23 -0.74 0.00 2.92 0.00 -0.91 -5.05 105.19 102.64 1nkn n GLY 917 Ca 0.17 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.57 1nkn n GLY 917 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50