#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nkn h LYS 847 N 0.00 0.61 -0.76 2.12 2.10 -2.06 -3.16 116.57 115.42 1nkn h LYS 847 Ca 0.00 -0.38 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 1nkn h LYS 847 Cb 0.00 0.04 -0.04 0.00 -0.90 0.00 0.00 32.23 31.33 1nkn h LYS 847 CO 0.00 0.99 0.48 1.49 -2.00 0.00 0.00 179.45 180.41 1nkn h GLU 848 N 0.29 1.00 -0.02 0.07 4.81 -2.04 -2.63 114.58 116.06 1nkn h GLU 848 Ca 0.01 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1nkn h GLU 848 Cb 0.95 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 1nkn h GLU 848 CO 0.08 0.68 -0.01 -0.56 -0.73 0.00 0.00 179.01 178.47 1nkn h GLN 849 N 1.03 -0.02 -0.86 1.92 -0.00 -1.96 2.10 115.11 117.32 1nkn h GLN 849 Ca 0.27 0.00 0.20 0.00 -0.00 0.00 0.00 58.65 59.13 1nkn h GLN 849 Cb -0.09 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 27.34 1nkn h GLN 849 CO -0.06 -0.01 0.58 1.25 -0.00 0.00 0.00 178.83 180.59 1nkn h LEU 850 N -0.02 0.31 0.01 0.06 6.46 -1.44 1.43 115.31 122.11 1nkn h LEU 850 Ca 0.01 0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 57.80 1nkn h LEU 850 Cb 0.04 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 39.94 1nkn h LEU 850 CO -0.03 0.13 -0.00 0.50 -0.62 0.00 0.00 178.44 178.42 1nkn h LYS 851 N 0.31 -0.01 -0.74 1.25 3.64 -0.69 -1.24 116.57 119.09 1nkn h LYS 851 Ca 0.44 0.00 0.16 0.00 -1.27 0.00 0.00 60.65 59.97 1nkn h LYS 851 Cb 1.22 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.00 1nkn h LYS 851 CO -0.13 0.82 0.50 0.37 -2.27 0.00 0.00 179.45 178.74 1nkn h GLN 852 N -0.91 0.34 0.04 1.90 4.15 0.52 0.23 115.11 121.38 1nkn h GLN 852 Ca -0.00 -0.02 -0.23 0.00 0.77 0.00 0.00 58.65 59.16 1nkn h GLN 852 Cb 0.84 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.45 1nkn h GLN 852 CO 0.00 0.22 -1.01 1.98 -1.93 0.00 0.00 178.83 178.09 1nkn h MET 853 N 0.35 0.34 -0.17 1.69 4.05 0.18 -2.42 114.93 118.96 1nkn h MET 853 Ca 0.36 -0.41 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1nkn h MET 853 Cb 0.91 0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.83 1nkn h MET 853 CO -0.10 1.11 0.11 0.22 0.23 0.00 0.00 176.91 178.48 1nkn h ASP 854 N 0.17 0.20 -0.20 1.39 1.82 0.66 0.48 116.42 120.94 1nkn h ASP 854 Ca -0.09 -0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.52 1nkn h ASP 854 Cb 1.67 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 41.62 1nkn h ASP 854 CO 0.17 0.16 0.08 0.50 -1.61 0.00 0.00 179.24 178.53 1nkn h LYS 855 N 0.22 0.30 -0.75 0.28 3.64 -1.22 -2.69 116.57 116.35 1nkn h LYS 855 Ca 0.06 -0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.52 1nkn h LYS 855 Cb -0.01 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.71 1nkn h LYS 855 CO -0.01 0.36 0.50 1.98 -2.27 0.00 0.00 179.45 180.01 1nkn h MET 856 N 0.17 0.47 -0.31 1.90 4.05 -1.07 -0.31 114.93 119.83 1nkn h MET 856 Ca 0.07 -0.03 -0.10 0.00 -0.28 0.00 0.00 59.70 59.35 1nkn h MET 856 Cb 0.18 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.86 1nkn h MET 856 CO -0.01 0.31 -0.24 0.87 0.23 0.00 0.00 176.91 178.07 1nkn h LYS 857 N 0.48 0.60 0.00 0.39 1.57 -0.57 -0.28 116.57 118.77 1nkn h LYS 857 Ca 0.36 -0.24 -0.16 0.00 -1.87 0.00 0.00 60.65 58.75 1nkn h LYS 857 Cb 0.73 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 1nkn h LYS 857 CO -0.12 0.80 -0.76 0.93 -0.57 0.00 0.00 179.45 179.72 1nkn h GLU 858 N 0.53 0.00 -0.11 3.15 4.39 -0.96 -1.42 114.58 120.16 1nkn h GLU 858 Ca 0.07 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.65 1nkn h GLU 858 Cb 0.70 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1nkn h GLU 858 CO 0.05 0.76 -0.43 -0.44 -1.16 0.00 0.00 179.01 177.80 1nkn h ASP 859 N 0.00 0.57 -0.21 1.42 3.32 -1.06 -1.34 116.42 119.12 1nkn h ASP 859 Ca -0.01 -0.62 -0.01 0.00 0.02 0.00 0.00 57.03 56.41 1nkn h ASP 859 Cb 1.38 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1nkn h ASP 859 CO 0.10 1.09 0.11 0.25 -1.72 0.00 0.00 179.24 179.07 1nkn h LEU 860 N 0.07 0.26 -1.06 1.55 5.85 -1.05 0.11 115.31 121.04 1nkn h LEU 860 Ca -0.02 -0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.68 1nkn h LEU 860 Cb 1.06 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.95 1nkn h LEU 860 CO 0.09 0.29 0.63 0.00 -0.34 0.00 0.00 178.44 179.11 1nkn h ALA 861 N 0.98 1.49 0.13 1.25 0.00 -1.26 0.30 119.26 122.15 1nkn h ALA 861 Ca 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1nkn h ALA 861 Cb 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1nkn h ALA 861 CO -0.01 0.34 -0.06 -0.22 0.00 0.00 0.00 179.25 179.30 1nkn h LYS 862 N 1.07 -0.16 -0.84 0.00 3.64 -0.71 -1.81 116.57 117.75 1nkn h LYS 862 Ca 0.44 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.90 1nkn h LYS 862 Cb 0.29 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.09 1nkn h LYS 862 CO -0.19 0.26 0.55 1.15 -2.27 0.00 0.00 179.45 178.94 1nkn h THR 863 N -0.66 1.02 -0.16 1.00 2.02 -0.43 -0.70 112.91 115.01 1nkn h THR 863 Ca -0.02 -0.31 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 1nkn h THR 863 Cb 0.50 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.96 1nkn h THR 863 CO 0.03 0.16 -0.06 -0.33 0.37 0.00 0.00 175.52 175.69 1nkn h GLU 864 N 0.89 0.32 -0.73 6.66 5.08 -0.39 -0.04 114.58 126.38 1nkn h GLU 864 Ca 0.37 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1nkn h GLU 864 Cb 0.28 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 1nkn h GLU 864 CO -0.14 0.63 0.48 -0.09 -1.00 0.00 0.00 179.01 178.89 1nkn h ARG 865 N 0.00 0.96 -0.05 2.33 2.43 -0.73 -0.69 114.38 118.64 1nkn h ARG 865 Ca 0.04 -0.06 -0.17 0.00 -0.81 0.00 0.00 59.98 58.97 1nkn h ARG 865 Cb 0.52 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1nkn h ARG 865 CO 0.02 0.64 -0.72 0.82 -1.51 0.00 0.00 179.97 179.22 1nkn h ILE 866 N 0.99 1.42 -0.72 1.20 2.04 -1.01 -1.92 117.51 119.51 1nkn h ILE 866 Ca 0.27 -2.22 -0.04 0.00 1.00 0.00 0.00 64.86 63.86 1nkn h ILE 866 Cb -0.10 2.18 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 1nkn h ILE 866 CO -0.06 0.66 0.29 0.50 0.00 0.00 0.00 178.15 179.54 1nkn h LYS 867 N 0.18 1.07 -0.27 2.37 3.64 -0.23 -1.74 116.57 121.59 1nkn h LYS 867 Ca -0.02 -0.19 -0.09 0.00 -1.27 0.00 0.00 60.65 59.07 1nkn h LYS 867 Cb 1.28 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 1nkn h LYS 867 CO 0.11 0.88 -0.21 -0.22 -2.27 0.00 0.00 179.45 177.75 1nkn h LYS 868 N 1.03 0.50 -0.53 1.90 3.11 -0.92 -1.37 116.57 120.29 1nkn h LYS 868 Ca 0.24 -0.17 -0.06 0.00 -2.81 0.00 0.00 60.65 57.85 1nkn h LYS 868 Cb 0.21 -0.04 -0.02 0.00 -1.00 0.00 0.00 32.23 31.38 1nkn h LYS 868 CO -0.02 0.68 0.10 0.93 -2.81 0.00 0.00 179.45 178.33 1nkn h GLU 869 N 0.45 0.86 -0.59 1.90 5.08 -0.95 -1.96 114.58 119.38 1nkn h GLU 869 Ca 0.07 -0.22 -0.08 0.00 -1.00 0.00 0.00 59.36 58.13 1nkn h GLU 869 Cb 0.61 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1nkn h GLU 869 CO 0.04 0.83 0.06 -0.07 -1.00 0.00 0.00 179.01 178.87 1nkn h LEU 870 N 0.75 0.94 -0.16 1.33 3.38 -1.04 0.16 115.31 120.67 1nkn h LEU 870 Ca 0.16 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1nkn h LEU 870 Cb 0.37 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1nkn h LEU 870 CO 0.01 0.96 0.08 -0.33 0.09 0.00 0.00 178.44 179.25 1nkn h GLU 871 N 0.91 0.22 -0.28 1.13 5.08 -1.01 0.52 114.58 121.16 1nkn h GLU 871 Ca 0.18 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1nkn h GLU 871 Cb 0.45 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1nkn h GLU 871 CO 0.02 0.25 0.15 0.93 -1.00 0.00 0.00 179.01 179.36 1nkn h GLU 872 N 0.14 0.31 -0.73 2.33 4.39 -1.09 -0.26 114.58 119.67 1nkn h GLU 872 Ca 0.05 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.78 1nkn h GLU 872 Cb 0.10 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.63 1nkn h GLU 872 CO -0.01 0.20 0.45 0.37 -1.16 0.00 0.00 179.01 178.86 1nkn h GLN 873 N 0.32 0.82 -0.55 2.33 4.15 -0.17 -0.72 115.11 121.29 1nkn h GLN 873 Ca 0.11 -0.05 0.06 0.00 0.77 0.00 0.00 58.65 59.54 1nkn h GLN 873 Cb 0.01 -0.19 -0.05 0.00 0.21 0.00 0.00 27.48 27.47 1nkn h GLN 873 CO -0.06 0.54 0.26 -0.97 -1.93 0.00 0.00 178.83 176.67 1nkn h ASN 874 N 0.85 0.36 -0.73 -0.69 -0.73 0.79 -0.89 115.58 114.54 1nkn h ASN 874 Ca 0.31 0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.49 1nkn h ASN 874 Cb 0.09 -0.03 -0.03 0.00 0.27 0.00 0.00 38.32 38.62 1nkn h ASN 874 CO -0.14 0.24 0.37 0.58 -0.37 0.00 0.00 177.43 178.11 1nkn h VAL 875 N 0.50 1.23 -0.72 2.57 2.07 0.13 -2.37 116.25 119.67 1nkn h VAL 875 Ca 0.25 -0.63 -0.06 0.00 0.82 0.00 0.00 66.70 67.08 1nkn h VAL 875 Cb 0.19 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 1nkn h VAL 875 CO -0.19 0.27 0.20 0.74 0.02 0.00 0.00 177.57 178.61 1nkn h THR 876 N 1.02 1.26 -0.55 2.57 2.02 -0.50 -2.34 112.91 116.40 1nkn h THR 876 Ca 0.25 -0.93 -0.06 0.00 0.77 0.00 0.00 66.41 66.44 1nkn h THR 876 Cb 0.09 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 1nkn h THR 876 CO -0.04 0.36 0.09 -0.07 0.37 0.00 0.00 175.52 176.24 1nkn h LEU 877 N 1.08 0.87 -0.85 2.58 3.38 -0.90 0.25 115.31 121.71 1nkn h LEU 877 Ca 0.23 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1nkn h LEU 877 Cb 0.33 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 1nkn h LEU 877 CO -0.00 0.90 0.44 -0.07 0.09 0.00 0.00 178.44 179.81 1nkn h LEU 878 N 0.79 1.09 -0.99 1.67 3.38 -1.27 0.81 115.31 120.80 1nkn h LEU 878 Ca 0.17 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1nkn h LEU 878 Cb 0.40 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1nkn h LEU 878 CO 0.01 0.89 -0.39 1.05 0.09 0.00 0.00 178.44 180.10 1nkn h GLU 879 N 1.20 0.00 0.01 1.13 4.11 -1.12 -2.46 114.58 117.45 1nkn h GLU 879 Ca 0.30 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.47 1nkn h GLU 879 Cb 0.07 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.33 1nkn h GLU 879 CO -0.04 0.39 -1.03 1.96 0.07 0.00 0.00 179.01 180.35 1nkn h GLN 880 N 0.00 0.62 -0.91 1.06 4.20 0.24 -1.91 115.11 118.41 1nkn h GLN 880 Ca -0.00 -0.67 0.01 0.00 0.06 0.00 0.00 58.65 58.04 1nkn h GLN 880 Cb 0.87 0.19 -0.04 0.00 0.30 0.00 0.00 27.48 28.80 1nkn h GLN 880 CO 0.05 1.27 0.60 0.87 -0.67 0.00 0.00 178.83 180.95 1nkn h LYS 881 N 0.34 1.19 -0.65 1.46 1.57 -0.78 -0.98 116.57 118.72 1nkn h LYS 881 Ca -0.12 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 1nkn h LYS 881 Cb 1.68 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 33.69 1nkn h LYS 881 CO 0.20 0.79 0.34 -0.97 -0.57 0.00 0.00 179.45 179.23 1nkn h ASN 882 N 1.23 0.82 -0.68 0.86 -0.73 -1.40 -0.94 115.58 114.74 1nkn h ASN 882 Ca 0.33 -0.11 -0.01 0.00 1.87 0.00 0.00 56.30 58.38 1nkn h ASN 882 Cb -0.14 -0.21 -0.03 0.00 0.27 0.00 0.00 38.32 38.21 1nkn h ASN 882 CO -0.07 0.70 0.37 0.44 -0.37 0.00 0.00 177.43 178.49 1nkn h ASP 883 N 0.88 0.86 -0.40 1.15 3.45 -0.54 -1.41 116.42 120.41 1nkn h ASP 883 Ca 0.23 -0.10 -0.08 0.00 0.43 0.00 0.00 57.03 57.51 1nkn h ASP 883 Cb 0.07 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.60 1nkn h ASP 883 CO -0.03 0.71 -0.02 -0.07 -1.57 0.00 0.00 179.24 178.26 1nkn h LEU 884 N 0.94 0.77 -0.74 1.55 3.38 -0.76 -0.21 115.31 120.24 1nkn h LEU 884 Ca 0.24 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1nkn h LEU 884 Cb 0.05 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1nkn h LEU 884 CO -0.04 0.85 0.24 -0.26 0.09 0.00 0.00 178.44 179.32 1nkn h PHE 885 N 0.74 1.19 -0.63 1.13 0.04 -0.75 0.27 116.94 118.92 1nkn h PHE 885 Ca 0.14 -0.12 -0.06 0.00 2.80 0.00 0.00 57.97 60.73 1nkn h PHE 885 Cb 0.48 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 38.26 1nkn h PHE 885 CO 0.03 0.93 0.15 0.78 -0.60 0.00 0.00 178.31 179.60 1nkn h GLY 886 N 1.10 1.07 1.41 -1.45 0.00 -0.81 -2.17 103.07 102.22 1nkn h GLY 886 Ca 0.24 -0.65 -0.20 0.00 0.00 0.00 0.00 47.33 46.73 1nkn h GLY 886 CO -0.01 0.61 -0.72 1.76 0.00 0.00 0.00 176.54 178.18 1nkn h SER 887 N 0.95 0.68 -0.33 0.19 0.02 -0.63 -2.99 113.55 111.45 1nkn h SER 887 Ca 0.20 -0.44 -0.08 0.00 -0.84 0.00 0.00 61.79 60.63 1nkn h SER 887 Cb 0.34 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 1nkn h SER 887 CO 0.00 1.20 -0.07 0.24 -1.14 0.00 0.00 176.83 177.06 1nkn h MET 888 N 0.41 0.73 -0.37 3.45 2.07 -0.78 -1.75 114.93 118.68 1nkn h MET 888 Ca -0.03 -0.22 -0.05 0.00 -2.07 0.00 0.00 59.70 57.32 1nkn h MET 888 Cb 1.31 -0.07 -0.02 0.00 -1.87 0.00 0.00 31.60 30.95 1nkn h MET 888 CO 0.14 0.79 0.00 -0.22 1.07 0.00 0.00 176.91 178.69 1nkn h LYS 889 N 0.67 0.59 -0.25 1.72 1.63 -1.37 0.11 116.57 119.67 1nkn h LYS 889 Ca 0.12 -0.13 -0.17 0.00 -0.85 0.00 0.00 60.65 59.62 1nkn h LYS 889 Cb 0.52 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.06 1nkn h LYS 889 CO 0.03 0.61 -0.52 1.96 -3.45 0.00 0.00 179.45 178.08 1nkn h GLN 890 N 0.56 0.72 -0.09 1.90 4.20 -1.30 -2.70 115.11 118.40 1nkn h GLN 890 Ca 0.12 -0.44 -0.17 0.00 0.06 0.00 0.00 58.65 58.22 1nkn h GLN 890 Cb 0.36 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1nkn h GLN 890 CO 0.01 1.06 -0.66 -0.07 -0.67 0.00 0.00 178.83 178.50 1nkn h LEU 891 N 0.56 0.42 -0.67 1.46 3.38 -0.85 -2.00 115.31 117.62 1nkn h LEU 891 Ca 0.02 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.64 1nkn h LEU 891 Cb 1.09 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1nkn h LEU 891 CO 0.11 0.96 0.02 -0.33 0.09 0.00 0.00 178.44 179.29 1nkn h GLU 892 N 0.26 1.05 -0.31 1.13 5.08 -0.73 0.18 114.58 121.23 1nkn h GLU 892 Ca -0.02 -0.32 -0.14 0.00 -1.00 0.00 0.00 59.36 57.88 1nkn h GLU 892 Cb 1.21 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1nkn h GLU 892 CO 0.11 1.02 -0.39 -0.44 -1.00 0.00 0.00 179.01 178.31 1nkn h ASP 893 N 0.96 0.78 -0.41 1.42 3.32 -1.44 -1.27 116.42 119.80 1nkn h ASP 893 Ca 0.18 -0.35 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 1nkn h ASP 893 Cb 0.53 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1nkn h ASP 893 CO 0.03 1.08 0.20 0.50 -1.72 0.00 0.00 179.24 179.33 1nkn h LYS 894 N 0.61 0.58 -0.83 3.56 1.63 -0.91 -0.40 116.57 120.81 1nkn h LYS 894 Ca 0.05 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1nkn h LYS 894 Cb 0.93 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.41 1nkn h LYS 894 CO 0.08 0.49 0.53 0.28 -3.45 0.00 0.00 179.45 177.39 1nkn h VAL 895 N 0.52 1.22 0.68 2.00 2.07 -0.37 -0.40 116.25 121.97 1nkn h VAL 895 Ca 0.14 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 1nkn h VAL 895 Cb 0.10 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.89 1nkn h VAL 895 CO -0.02 0.22 -0.35 -0.33 0.02 0.00 0.00 177.57 177.11 1nkn h GLU 896 N 1.14 -0.92 -0.54 1.57 4.39 -0.56 -0.82 114.58 118.84 1nkn h GLU 896 Ca 0.30 0.06 0.11 0.00 0.34 0.00 0.00 59.36 60.17 1nkn h GLU 896 Cb -0.09 0.21 -0.09 0.00 -0.10 0.00 0.00 28.75 28.68 1nkn h GLU 896 CO -0.06 -0.61 0.02 1.49 -1.16 0.00 0.00 179.01 178.69 1nkn h GLU 897 N -0.95 0.14 -0.12 2.33 4.81 -0.72 -1.06 114.58 119.01 1nkn h GLU 897 Ca -0.09 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.06 1nkn h GLU 897 Cb 0.74 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 1nkn h GLU 897 CO 0.13 0.09 -0.27 -0.07 -0.73 0.00 0.00 179.01 178.17 1nkn h LEU 898 N 0.14 0.22 -0.49 1.64 3.38 -0.97 -2.00 115.31 117.23 1nkn h LEU 898 Ca 0.28 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 1nkn h LEU 898 Cb 0.43 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1nkn h LEU 898 CO -0.44 0.49 0.07 0.25 0.09 0.00 0.00 178.44 178.90 1nkn h LEU 899 N 0.20 0.79 -0.42 1.67 5.85 0.12 0.35 115.31 123.87 1nkn h LEU 899 Ca 0.03 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.45 1nkn h LEU 899 Cb 0.58 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 1nkn h LEU 899 CO 0.04 0.85 0.14 0.28 -0.34 0.00 0.00 178.44 179.41 1nkn h SER 900 N 0.69 0.60 -0.75 1.25 0.02 -1.08 0.20 113.55 114.48 1nkn h SER 900 Ca 0.15 -0.20 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1nkn h SER 900 Cb 0.41 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 1nkn h SER 900 CO 0.01 0.64 0.38 0.11 -1.14 0.00 0.00 176.83 176.83 1nkn h LYS 901 N 0.53 1.09 -0.37 3.45 1.57 -1.01 0.07 116.57 121.89 1nkn h LYS 901 Ca 0.14 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 1nkn h LYS 901 Cb 0.25 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1nkn h LYS 901 CO -0.01 0.83 0.05 -0.97 -0.57 0.00 0.00 179.45 178.79 1nkn h ASN 902 N 1.08 0.59 -0.37 0.86 -1.24 0.21 -0.49 115.58 116.21 1nkn h ASN 902 Ca 0.27 -0.26 -0.12 0.00 0.71 0.00 0.00 56.30 56.89 1nkn h ASN 902 Cb 0.09 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 1nkn h ASN 902 CO -0.04 0.71 -0.23 1.88 -1.29 0.00 0.00 177.43 178.47 1nkn h TYR 903 N 0.46 1.00 -0.44 0.67 0.05 -0.61 -1.41 116.97 116.68 1nkn h TYR 903 Ca 0.11 -0.24 -0.04 0.00 0.05 0.00 0.00 58.73 58.62 1nkn h TYR 903 Cb 0.37 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.86 1nkn h TYR 903 CO 0.03 1.01 0.14 1.25 -1.05 0.00 0.00 178.16 179.53 1nkn h HIS 904 N 0.76 0.71 -0.71 4.88 -0.00 -0.88 -2.53 115.15 117.37 1nkn h HIS 904 Ca 0.10 -0.07 -0.04 0.00 -0.00 0.00 0.00 60.37 60.36 1nkn h HIS 904 Cb 0.77 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.94 1nkn h HIS 904 CO 0.04 0.64 0.29 -0.07 -0.00 0.00 0.00 177.93 178.83 1nkn h LEU 905 N 0.57 0.97 -1.17 0.26 3.38 -0.92 -2.09 115.31 116.31 1nkn h LEU 905 Ca 0.14 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1nkn h LEU 905 Cb 0.26 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1nkn h LEU 905 CO -0.00 0.86 0.17 -0.33 0.09 0.00 0.00 178.44 179.23 1nkn h GLU 906 N 1.03 0.75 -0.05 1.13 4.39 -1.05 -1.45 114.58 119.33 1nkn h GLU 906 Ca 0.24 -0.12 -0.13 0.00 0.34 0.00 0.00 59.36 59.68 1nkn h GLU 906 Cb 0.20 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 1nkn h GLU 906 CO -0.02 0.64 -0.58 -0.91 -1.16 0.00 0.00 179.01 176.99 1nkn h ASN 907 N 0.73 0.18 0.12 1.42 -0.26 -1.01 -1.72 115.58 115.04 1nkn h ASN 907 Ca 0.17 -0.10 -0.01 0.00 -0.56 0.00 0.00 56.30 55.81 1nkn h ASN 907 Cb 0.20 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.41 1nkn h ASN 907 CO -0.01 0.71 -0.06 -0.33 -1.06 0.00 0.00 177.43 176.69 1nkn h GLU 908 N 0.12 -0.15 -0.59 0.81 5.08 -0.92 -2.13 114.58 116.79 1nkn h GLU 908 Ca -0.00 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.44 1nkn h GLU 908 Cb 1.05 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.27 1nkn h GLU 908 CO 0.08 0.29 0.26 0.28 -1.00 0.00 0.00 179.01 178.92 1nkn h VAL 909 N -0.67 0.85 -0.45 3.13 2.07 -1.26 0.51 116.25 120.43 1nkn h VAL 909 Ca -0.02 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1nkn h VAL 909 Cb 0.51 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1nkn h VAL 909 CO 0.03 0.09 0.30 0.00 0.02 0.00 0.00 177.57 178.00 1nkn h ALA 910 N 1.37 0.57 -0.35 1.67 0.00 -1.33 0.33 119.26 121.52 1nkn h ALA 910 Ca 0.28 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1nkn h ALA 910 Cb 0.28 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1nkn h ALA 910 CO -0.24 0.02 0.17 0.00 0.00 0.00 0.00 179.25 179.21 1nkn h ARG 911 N 0.61 0.50 0.00 0.00 3.08 -0.65 -2.47 114.38 115.45 1nkn h ARG 911 Ca 0.16 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 1nkn h ARG 911 Cb -0.07 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 1nkn h ARG 911 CO -0.04 0.44 -0.30 -0.07 -1.07 0.00 0.00 179.97 178.94 1nkn h LEU 912 N 0.43 0.00 -0.20 3.04 3.38 -0.63 -2.23 115.31 119.10 1nkn h LEU 912 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1nkn h LEU 912 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1nkn h LEU 912 CO -0.02 0.30 0.07 0.11 0.09 0.00 0.00 178.44 179.00 1nkn h LYS 913 N 0.00 0.30 0.47 1.13 1.79 0.09 -2.61 116.57 117.74 1nkn h LYS 913 Ca -0.00 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.39 1nkn h LYS 913 Cb 0.65 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 1nkn h LYS 913 CO 0.04 0.38 -0.22 0.87 -1.08 0.00 0.00 179.45 179.44 1nkn h LYS 914 N 0.16 -0.60 -1.36 3.15 1.79 -1.21 -0.02 116.57 118.49 1nkn h LYS 914 Ca 0.07 0.04 0.41 0.00 -2.18 0.00 0.00 60.65 58.99 1nkn h LYS 914 Cb 0.19 0.14 -0.09 0.00 -1.58 0.00 0.00 32.23 30.89 1nkn h LYS 914 CO -0.00 -0.34 0.93 1.25 -1.08 0.00 0.00 179.45 180.20 1nkn h LEU 915 N -0.74 0.18 -1.78 2.94 5.85 -1.36 0.17 115.31 120.57 1nkn h LEU 915 Ca -0.06 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1nkn h LEU 915 Cb 0.54 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1nkn h LEU 915 CO 0.10 -0.05 0.00 0.52 -0.34 0.00 0.00 178.44 178.67 1nkn n VAL 916 N -4.42 0.08 -2.59 1.05 0.31 -0.99 -5.01 118.33 106.77 1nkn n VAL 916 Ca 0.34 -0.54 -0.08 0.00 -0.01 0.00 0.00 64.34 64.05 1nkn n VAL 916 Cb 1.39 1.30 0.04 0.00 -0.91 0.00 0.00 33.84 35.67 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 1.01 0.01 3.62 2.92 0.00 0.60 -5.06 105.19 108.29 1nkn n GLY 917 Ca 0.11 -0.10 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 1nkn n GLY 917 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nkn s GLU 918 N -4.37 2.25 0.00 1.61 2.02 -0.10 -5.03 118.70 115.08 1nkn s GLU 918 Ca 0.06 -1.18 0.00 0.00 0.02 0.00 0.00 54.97 53.88 1nkn s GLU 918 Cb -0.01 -2.27 0.00 0.00 0.10 0.00 0.00 34.13 31.95 1nkn s GLU 918 CO 0.35 0.45 0.00 0.54 0.02 0.00 0.00 175.26 176.62