#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kze s MET 839 N 0.00 4.26 0.00 0.00 -2.45 -1.26 -5.07 119.30 114.79 3kze s MET 839 Ca 0.00 0.27 0.00 0.00 -1.25 0.00 0.00 55.69 54.71 3kze s MET 839 Cb 0.00 -3.47 0.00 0.00 1.25 0.00 0.00 34.83 32.61 3kze s MET 839 CO 0.00 0.11 0.00 0.41 1.05 0.00 0.00 175.02 176.59 3kze n GLY 840 N 3.51 0.87 3.80 2.11 0.00 -1.26 -4.91 105.19 109.32 3kze n GLY 840 Ca -0.09 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 3kze n GLY 840 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kze s LYS 841 N 1.66 2.80 0.04 1.61 1.02 -1.26 -4.39 119.74 121.22 3kze s LYS 841 Ca 0.00 1.04 0.02 0.00 0.02 0.00 0.00 55.97 57.05 3kze s LYS 841 Cb 0.00 -1.97 -0.03 0.00 -0.52 0.00 0.00 37.83 35.32 3kze s LYS 841 CO 0.00 -1.22 -0.07 0.14 -0.92 0.00 0.00 175.35 173.28 3kze s VAL 842 N -2.94 0.50 -0.08 3.17 -7.23 0.62 -4.95 120.40 109.48 3kze s VAL 842 Ca 0.60 -1.14 -0.01 0.00 -1.81 0.00 0.00 61.98 59.61 3kze s VAL 842 Cb -0.15 -0.67 -0.03 0.00 0.56 0.00 0.00 36.38 36.09 3kze s VAL 842 CO 0.53 -0.45 -0.02 -0.89 -0.31 0.00 0.00 175.10 173.97 3kze s THR 843 N -1.61 4.12 0.08 5.32 2.01 -1.26 -0.67 115.64 123.62 3kze s THR 843 Ca -0.09 -0.32 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 3kze s THR 843 Cb -0.08 -2.72 0.01 0.00 0.01 0.00 0.00 72.50 69.71 3kze s THR 843 CO -0.00 0.60 0.24 -1.38 -0.69 0.00 0.00 174.62 173.39 3kze s HIS 844 N -0.81 0.03 -0.12 4.92 -3.43 0.34 -4.97 115.29 111.24 3kze s HIS 844 Ca 0.12 -0.35 -0.13 0.00 -0.80 0.00 0.00 55.06 53.91 3kze s HIS 844 Cb -0.11 0.02 -0.05 0.00 -1.43 0.00 0.00 32.58 31.01 3kze s HIS 844 CO 0.02 -0.54 0.28 -1.12 -2.00 0.00 0.00 174.74 171.38 3kze s SER 845 N -2.56 6.49 -0.05 7.38 0.01 -1.26 -0.70 113.70 123.00 3kze s SER 845 Ca 0.01 0.57 0.06 0.00 1.31 0.00 0.00 55.95 57.90 3kze s SER 845 Cb 0.02 -2.17 -0.01 0.00 0.21 0.00 0.00 66.02 64.07 3kze s SER 845 CO -0.08 0.20 -0.25 -0.63 0.41 0.00 0.00 173.24 172.89 3kze s ILE 846 N -0.11 2.03 -0.08 1.44 1.01 0.03 -5.00 121.20 120.52 3kze s ILE 846 Ca 0.17 -1.06 0.02 0.00 0.00 0.00 0.00 60.65 59.78 3kze s ILE 846 Cb -0.13 -1.71 0.01 0.00 0.01 0.00 0.00 42.46 40.64 3kze s ILE 846 CO 0.05 0.57 -0.14 -2.28 0.00 0.00 0.00 174.94 173.14 3kze s HIS 847 N -0.21 1.68 -0.05 3.97 2.46 -1.26 -0.58 115.29 121.29 3kze s HIS 847 Ca -0.02 -0.68 0.05 0.00 0.47 0.00 0.00 55.06 54.87 3kze s HIS 847 Cb -0.13 -1.22 -0.00 0.00 -0.13 0.00 0.00 32.58 31.09 3kze s HIS 847 CO 0.03 -0.35 -0.20 0.42 -2.47 0.00 0.00 174.74 172.18 3kze s ILE 848 N 0.77 1.64 -0.12 0.89 1.01 -0.21 -5.00 121.20 120.18 3kze s ILE 848 Ca -0.12 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.72 3kze s ILE 848 Cb -0.16 -1.40 0.02 0.00 0.01 0.00 0.00 42.46 40.93 3kze s ILE 848 CO 0.02 0.46 -0.14 -1.61 0.00 0.00 0.00 174.94 173.67 3kze s GLU 849 N 0.07 2.21 0.56 2.79 2.02 -1.26 -0.98 118.70 124.11 3kze s GLU 849 Ca -0.06 -0.54 0.32 0.00 0.02 0.00 0.00 54.97 54.70 3kze s GLU 849 Cb -0.13 -1.96 1.66 0.00 0.10 0.00 0.00 34.13 33.80 3kze s GLU 849 CO 0.03 -0.14 2.13 0.87 0.02 0.00 0.00 175.26 178.18 3kze h LYS 850 N 7.71 0.00 -0.03 1.61 1.57 -1.36 -2.14 116.57 123.93 3kze h LYS 850 Ca -0.34 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.45 3kze h LYS 850 Cb 1.16 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.47 3kze h LYS 850 CO 0.50 0.07 0.08 0.66 -0.57 0.00 0.00 179.45 180.19 3kze h SER 851 N 0.00 0.00 -0.98 0.86 4.64 -1.88 0.27 113.55 116.46 3kze h SER 851 Ca -0.00 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 61.47 3kze h SER 851 Cb 0.27 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.26 3kze h SER 851 CO 0.01 0.00 0.59 0.44 -0.87 0.00 0.00 176.83 177.00 3kze h ASP 852 N 0.00 0.80 0.00 4.97 3.32 -1.78 -3.20 116.42 120.52 3kze h ASP 852 Ca 0.01 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3kze h ASP 852 Cb 0.17 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3kze h ASP 852 CO -0.00 0.35 -0.35 0.35 -1.72 0.00 0.00 179.24 177.87 3kze n THR 853 N -4.73 0.10 -3.70 0.35 -2.24 -1.09 -5.01 114.28 97.97 3kze n THR 853 Ca 0.21 -0.12 -0.21 0.00 -2.27 0.00 0.00 64.05 61.65 3kze n THR 853 Cb 0.46 0.58 0.03 0.00 -2.10 0.00 0.00 70.33 69.31 3kze n THR 853 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kze n ALA 854 N -0.07 -2.00 -2.27 6.98 0.00 0.01 -4.96 120.51 118.19 3kze n ALA 854 Ca 0.01 -0.16 -0.30 0.00 0.00 0.00 0.00 53.44 52.99 3kze n ALA 854 Cb 0.64 -2.01 -0.04 0.00 0.00 0.00 0.00 19.45 18.05 3kze n ALA 854 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kze s ALA 855 N -3.66 3.42 -0.15 0.00 0.00 -0.76 -5.00 121.76 115.62 3kze s ALA 855 Ca 0.02 -0.27 0.22 0.00 0.00 0.00 0.00 51.96 51.93 3kze s ALA 855 Cb -0.01 -2.60 -0.17 0.00 0.00 0.00 0.00 23.12 20.34 3kze s ALA 855 CO 0.81 0.12 0.76 -0.25 0.00 0.00 0.00 175.76 177.20 3kze n ASP 856 N -1.05 0.42 -4.20 0.00 10.43 -1.26 -4.82 116.55 116.07 3kze n ASP 856 Ca 0.01 0.14 -0.12 0.00 2.57 0.00 0.00 54.79 57.40 3kze n ASP 856 Cb 0.54 1.23 -0.10 0.00 1.84 0.00 0.00 41.12 44.63 3kze n ASP 856 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 3kze s THR 857 N -3.44 0.59 -0.28 -3.53 -4.23 -1.26 -5.05 115.64 98.45 3kze s THR 857 Ca -0.04 -1.95 0.22 0.00 -1.18 0.00 0.00 61.69 58.74 3kze s THR 857 Cb 0.12 -1.96 0.07 0.00 1.34 0.00 0.00 72.50 72.08 3kze s THR 857 CO 0.85 -0.61 1.17 1.88 -0.54 0.00 0.00 174.62 177.37 3kze h TYR 858 N 2.82 0.00 -1.35 3.99 0.05 -1.93 -3.43 116.97 117.11 3kze h TYR 858 Ca -0.36 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.42 3kze h TYR 858 Cb 1.19 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.93 3kze h TYR 858 CO 0.54 0.01 0.00 0.41 -1.05 0.00 0.00 178.16 178.07 3kze n GLY 859 N 1.17 0.73 3.49 3.88 0.00 -1.26 -1.47 105.19 111.72 3kze n GLY 859 Ca 0.01 -0.55 -0.09 0.00 0.00 0.00 0.00 46.02 45.39 3kze n GLY 859 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3kze s PHE 860 N -2.89 0.15 0.11 1.61 -0.12 -1.26 -0.12 117.98 115.45 3kze s PHE 860 Ca 0.00 -0.50 0.04 0.00 -0.05 0.00 0.00 56.93 56.42 3kze s PHE 860 Cb 0.00 0.22 -0.04 0.00 -0.63 0.00 0.00 43.02 42.57 3kze s PHE 860 CO 0.00 -0.88 -0.10 -1.54 -0.05 0.00 0.00 175.22 172.65 3kze s SER 861 N -2.94 1.61 -0.02 1.98 1.04 -0.32 -4.97 113.70 110.08 3kze s SER 861 Ca 0.15 -0.88 0.05 0.00 0.48 0.00 0.00 55.95 55.75 3kze s SER 861 Cb 0.00 -0.00 -0.01 0.00 0.10 0.00 0.00 66.02 66.11 3kze s SER 861 CO 0.01 -0.28 -0.18 -0.76 0.98 0.00 0.00 173.24 173.01 3kze s LEU 862 N -2.69 2.00 -0.15 2.42 1.02 -1.26 -0.06 118.68 119.96 3kze s LEU 862 Ca 0.09 -0.33 -0.04 0.00 0.02 0.00 0.00 54.13 53.88 3kze s LEU 862 Cb -0.01 -0.93 -0.03 0.00 0.02 0.00 0.00 46.19 45.24 3kze s LEU 862 CO 0.00 0.20 -0.03 -0.94 0.02 0.00 0.00 176.35 175.61 3kze s SER 863 N -0.30 4.91 -0.28 2.29 1.04 0.91 -4.81 113.70 117.46 3kze s SER 863 Ca 0.04 -0.08 -0.02 0.00 0.48 0.00 0.00 55.95 56.36 3kze s SER 863 Cb -0.08 -1.76 0.03 0.00 0.10 0.00 0.00 66.02 64.31 3kze s SER 863 CO 0.00 0.19 -0.02 -0.55 0.98 0.00 0.00 173.24 173.84 3kze s SER 864 N 0.24 4.66 -0.18 7.02 0.15 -1.26 -0.82 113.70 123.50 3kze s SER 864 Ca -0.02 -1.03 -0.07 0.00 0.70 0.00 0.00 55.95 55.53 3kze s SER 864 Cb -0.14 -1.71 -0.04 0.00 -1.71 0.00 0.00 66.02 62.43 3kze s SER 864 CO 0.03 -0.19 0.05 0.68 1.20 0.00 0.00 173.24 175.00 3kze s VAL 865 N 1.31 4.59 -0.79 4.45 -7.23 -0.69 -4.98 120.40 117.07 3kze s VAL 865 Ca -0.02 -0.10 -0.05 0.00 -1.81 0.00 0.00 61.98 59.99 3kze s VAL 865 Cb -0.18 -3.07 0.20 0.00 0.56 0.00 0.00 36.38 33.89 3kze s VAL 865 CO -0.02 0.46 0.67 -1.61 -0.31 0.00 0.00 175.10 174.28 3kze s GLU 866 N 0.47 3.14 -0.15 4.82 8.01 -1.26 -1.37 118.70 132.36 3kze s GLU 866 Ca 0.02 -2.80 -0.06 0.00 0.01 0.00 0.00 54.97 52.14 3kze s GLU 866 Cb -0.13 -4.02 -0.04 0.00 -4.31 0.00 0.00 34.13 25.64 3kze s GLU 866 CO 0.01 -1.23 0.06 -1.21 0.01 0.00 0.00 175.26 172.90 3kze s GLU 867 N -0.50 3.70 0.00 1.61 2.02 0.01 -4.27 118.70 121.27 3kze s GLU 867 Ca 0.21 -0.33 0.00 0.00 0.02 0.00 0.00 54.97 54.87 3kze s GLU 867 Cb -0.13 -3.12 0.00 0.00 0.10 0.00 0.00 34.13 30.98 3kze s GLU 867 CO -0.07 0.43 0.00 -0.40 0.02 0.00 0.00 175.26 175.24 3kze n ASP 868 N 3.03 -3.32 0.00 -0.19 5.68 -1.26 -0.67 116.55 119.82 3kze n ASP 868 Ca -0.17 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.12 3kze n ASP 868 Cb 0.53 -2.58 0.00 0.00 -1.14 0.00 0.00 41.12 37.93 3kze n ASP 868 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kze n GLY 869 N -0.63 2.18 3.82 6.12 0.00 -1.26 -5.05 105.19 110.37 3kze n GLY 869 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3kze n GLY 869 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kze s ILE 870 N -2.43 4.56 -0.04 -0.61 1.09 0.16 -5.00 121.20 118.93 3kze s ILE 870 Ca 0.00 1.23 0.06 0.00 -1.10 0.00 0.00 60.65 60.84 3kze s ILE 870 Cb 0.00 -3.76 -0.02 0.00 -1.06 0.00 0.00 42.46 37.62 3kze s ILE 870 CO 0.00 0.01 -0.22 -0.13 -0.10 0.00 0.00 174.94 174.50 3kze s ARG 871 N -2.45 2.32 0.11 2.79 0.52 -1.26 -0.81 118.95 120.18 3kze s ARG 871 Ca 0.49 -0.85 0.06 0.00 -0.52 0.00 0.00 55.73 54.91 3kze s ARG 871 Cb -0.14 -2.17 -0.04 0.00 0.52 0.00 0.00 34.95 33.13 3kze s ARG 871 CO 0.19 0.54 -0.14 1.03 0.02 0.00 0.00 175.30 176.94 3kze s ARG 872 N -0.55 0.99 -0.08 3.54 0.52 -0.47 -3.96 118.95 118.93 3kze s ARG 872 Ca 0.08 -1.19 0.02 0.00 -0.52 0.00 0.00 55.73 54.12 3kze s ARG 872 Cb -0.11 -0.90 0.01 0.00 0.52 0.00 0.00 34.95 34.47 3kze s ARG 872 CO 0.00 0.18 -0.15 -0.51 0.02 0.00 0.00 175.30 174.84 3kze s LEU 873 N -2.31 1.74 0.09 2.53 1.43 -1.26 -1.70 118.68 119.19 3kze s LEU 873 Ca 0.07 -0.38 0.08 0.00 -1.03 0.00 0.00 54.13 52.87 3kze s LEU 873 Cb -0.06 -1.00 -0.03 0.00 0.03 0.00 0.00 46.19 45.13 3kze s LEU 873 CO 0.03 0.05 -0.21 -0.31 0.23 0.00 0.00 176.35 176.14 3kze s TYR 874 N 0.71 1.81 -0.23 0.29 2.02 -0.00 -0.67 117.35 121.29 3kze s TYR 874 Ca -0.13 -0.40 -0.29 0.00 -0.37 0.00 0.00 57.07 55.88 3kze s TYR 874 Cb -0.16 -1.02 0.00 0.00 -0.40 0.00 0.00 41.96 40.39 3kze s TYR 874 CO 0.03 0.18 1.12 0.08 -1.57 0.00 0.00 175.55 175.38 3kze s VAL 875 N -1.05 4.53 -0.12 0.71 1.01 0.28 -0.06 120.40 125.69 3kze s VAL 875 Ca 0.07 1.83 -0.18 0.00 0.00 0.00 0.00 61.98 63.70 3kze s VAL 875 Cb -0.10 -4.23 -0.26 0.00 0.00 0.00 0.00 36.38 31.79 3kze s VAL 875 CO 0.04 -0.22 0.51 -1.13 0.00 0.00 0.00 175.10 174.30 3kze h ASN 876 N 7.82 0.28 -5.06 3.32 -1.24 -0.79 0.15 115.58 120.05 3kze h ASN 876 Ca -0.21 -0.81 -0.08 0.00 0.71 0.00 0.00 56.30 55.91 3kze h ASN 876 Cb 1.07 -0.09 -0.16 0.00 0.73 0.00 0.00 38.32 39.88 3kze h ASN 876 CO 0.99 1.55 -0.16 -0.94 -1.29 0.00 0.00 177.43 177.57 3kze s SER 877 N -6.93 -0.19 -0.03 1.15 1.04 -1.20 -4.71 113.70 102.83 3kze s SER 877 Ca -0.21 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.02 3kze s SER 877 Cb 0.04 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.60 3kze s SER 877 CO 0.73 -0.70 0.00 -0.69 0.98 0.00 0.00 173.24 173.56 3kze s VAL 878 N -2.95 0.18 -0.04 5.02 1.01 -1.26 -1.17 120.40 121.18 3kze s VAL 878 Ca -0.02 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 3kze s VAL 878 Cb 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 3kze s VAL 878 CO -0.06 0.16 1.30 -0.54 0.00 0.00 0.00 175.10 175.96 3kze s LYS 879 N 1.18 4.31 0.36 2.72 1.02 0.83 -4.93 119.74 125.22 3kze s LYS 879 Ca -0.08 1.81 0.06 0.00 0.02 0.00 0.00 55.97 57.78 3kze s LYS 879 Cb -0.13 -3.59 0.73 0.00 -0.52 0.00 0.00 37.83 34.32 3kze s LYS 879 CO -0.02 -0.53 1.96 0.93 -0.92 0.00 0.00 175.35 176.76 3kze h GLU 880 N 7.73 0.75 -0.38 1.68 3.07 -2.00 -1.73 114.58 123.70 3kze h GLU 880 Ca -0.35 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.46 3kze h GLU 880 Cb 1.16 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.91 3kze h GLU 880 CO 0.90 0.50 0.00 0.25 -1.40 0.00 0.00 179.01 179.25 3kze n THR 881 N -4.48 0.49 -2.45 1.13 -2.24 -1.26 -4.70 114.28 100.77 3kze n THR 881 Ca 0.11 -0.64 -0.23 0.00 -2.27 0.00 0.00 64.05 61.01 3kze n THR 881 Cb 0.22 0.65 0.06 0.00 -2.10 0.00 0.00 70.33 69.16 3kze n THR 881 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3kze s GLY 882 N -1.37 1.77 0.22 3.38 0.00 -0.65 -4.94 107.32 105.72 3kze s GLY 882 Ca 0.37 -1.23 -0.08 0.00 0.00 0.00 0.00 44.72 43.78 3kze s GLY 882 CO 0.29 -0.85 1.85 1.41 0.00 0.00 0.00 173.10 175.79 3kze h LEU 883 N -0.30 1.06 -0.51 0.66 3.38 -1.81 -2.19 115.31 115.60 3kze h LEU 883 Ca -0.42 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.42 3kze h LEU 883 Cb 1.30 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 3kze h LEU 883 CO 0.53 0.85 0.17 0.00 0.09 0.00 0.00 178.44 180.08 3kze h ALA 884 N 1.26 0.66 -0.87 1.53 0.00 -1.54 -2.65 119.26 117.64 3kze h ALA 884 Ca 0.30 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3kze h ALA 884 Cb 0.02 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3kze h ALA 884 CO -0.05 0.30 0.48 1.03 0.00 0.00 0.00 179.25 181.01 3kze h SER 885 N 0.69 1.09 0.31 0.00 0.87 -1.67 -1.72 113.55 113.12 3kze h SER 885 Ca 0.17 -0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 3kze h SER 885 Cb 0.25 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 3kze h SER 885 CO -0.01 0.87 -0.09 0.11 -0.53 0.00 0.00 176.83 177.18 3kze h LYS 886 N 1.22 0.00 -0.37 2.24 1.79 -1.07 -1.58 116.57 118.80 3kze h LYS 886 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 3kze h LYS 886 Cb 0.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 3kze h LYS 886 CO -0.05 0.09 0.00 1.63 -1.08 0.00 0.00 179.45 180.04 3kze n LYS 887 N -3.63 2.41 0.00 3.15 4.76 -0.79 -4.96 118.16 119.10 3kze n LYS 887 Ca -0.02 -2.12 0.00 0.00 -2.87 0.00 0.00 58.31 53.30 3kze n LYS 887 Cb 0.21 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 3kze n LYS 887 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3kze n GLY 888 N 1.46 0.63 3.76 0.72 0.00 -0.59 -4.95 105.19 106.22 3kze n GLY 888 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3kze n GLY 888 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kze s LEU 889 N 0.00 4.39 0.06 0.99 2.96 -0.71 -5.00 118.68 121.36 3kze s LEU 889 Ca 0.00 2.73 0.04 0.00 -0.22 0.00 0.00 54.13 56.68 3kze s LEU 889 Cb 0.00 -3.64 -0.03 0.00 0.50 0.00 0.00 46.19 43.03 3kze s LEU 889 CO 0.00 -0.69 -0.12 -0.54 -1.32 0.00 0.00 176.35 173.68 3kze s LYS 890 N -0.96 0.72 0.27 1.98 1.02 -1.26 -4.49 119.74 117.01 3kze s LYS 890 Ca 0.56 -0.85 -0.30 0.00 0.02 0.00 0.00 55.97 55.40 3kze s LYS 890 Cb -0.42 -0.65 -0.13 0.00 -0.52 0.00 0.00 37.83 36.11 3kze s LYS 890 CO 0.48 0.14 1.37 0.00 -0.92 0.00 0.00 175.35 176.43 3kze n ALA 891 N 1.44 1.15 -0.04 5.17 0.00 -1.26 -1.90 120.51 125.07 3kze n ALA 891 Ca -0.21 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.63 3kze n ALA 891 Cb 0.54 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.73 3kze n ALA 891 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kze n GLY 892 N 1.79 1.27 3.75 0.00 0.00 0.51 -5.00 105.19 107.51 3kze n GLY 892 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 3kze n GLY 892 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kze s ASP 893 N -2.89 4.98 -0.14 1.61 1.01 -0.80 -4.74 116.67 115.71 3kze s ASP 893 Ca 0.00 2.42 -0.07 0.00 0.71 0.00 0.00 52.55 55.61 3kze s ASP 893 Cb 0.00 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 3kze s ASP 893 CO 0.00 -1.73 0.10 -0.70 0.21 0.00 0.00 175.17 173.05 3kze s GLU 894 N -3.42 3.56 -0.37 8.23 2.12 -0.14 -0.55 118.70 128.12 3kze s GLU 894 Ca 0.78 -0.23 -0.19 0.00 0.36 0.00 0.00 54.97 55.69 3kze s GLU 894 Cb -0.31 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 30.93 3kze s GLU 894 CO 0.36 0.61 0.54 0.42 -0.54 0.00 0.00 175.26 176.64 3kze s ILE 895 N -0.55 4.98 -0.03 -3.70 -1.09 0.16 -0.46 121.20 120.51 3kze s ILE 895 Ca 0.12 0.26 0.01 0.00 -2.23 0.00 0.00 60.65 58.80 3kze s ILE 895 Cb -0.12 -4.02 -0.26 0.00 -1.58 0.00 0.00 42.46 36.48 3kze s ILE 895 CO 0.02 -0.31 0.71 -0.07 -1.23 0.00 0.00 174.94 174.07 3kze h LEU 896 N 9.21 0.27 -7.73 2.97 3.38 -0.75 -3.37 115.31 119.30 3kze h LEU 896 Ca -0.27 -0.47 -0.15 0.00 0.09 0.00 0.00 57.88 57.09 3kze h LEU 896 Cb 1.12 -0.09 -0.21 0.00 0.09 0.00 0.00 40.66 41.57 3kze h LEU 896 CO 0.80 1.40 -0.49 -1.61 0.09 0.00 0.00 178.44 178.63 3kze s GLU 897 N -2.60 0.47 -0.09 1.13 2.02 -1.12 -1.45 118.70 117.05 3kze s GLU 897 Ca -0.10 -0.35 0.01 0.00 0.02 0.00 0.00 54.97 54.54 3kze s GLU 897 Cb 0.07 0.20 0.02 0.00 0.10 0.00 0.00 34.13 34.52 3kze s GLU 897 CO 0.83 -0.11 -0.10 0.42 0.02 0.00 0.00 175.26 176.31 3kze s ILE 898 N -1.28 1.10 -1.50 -1.63 1.01 0.10 -0.99 121.20 118.02 3kze s ILE 898 Ca -0.14 -0.40 -0.10 0.00 0.00 0.00 0.00 60.65 60.02 3kze s ILE 898 Cb -0.07 -1.06 0.07 0.00 0.01 0.00 0.00 42.46 41.41 3kze s ILE 898 CO 0.02 0.37 0.80 0.59 0.00 0.00 0.00 174.94 176.71 3kze n ASN 899 N 4.38 -3.03 -0.20 3.58 3.02 0.17 -1.40 115.26 121.77 3kze n ASN 899 Ca -0.18 -0.87 -0.03 0.00 -0.03 0.00 0.00 54.58 53.48 3kze n ASN 899 Cb 0.51 -3.57 -0.01 0.00 -0.61 0.00 0.00 39.78 36.09 3kze n ASN 899 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3kze n ASN 900 N -2.87 -4.55 -4.54 6.41 3.02 -1.26 -5.00 115.26 106.46 3kze n ASN 900 Ca -0.08 0.06 -0.34 0.00 -0.03 0.00 0.00 54.58 54.20 3kze n ASN 900 Cb 0.58 -2.28 -0.12 0.00 -0.61 0.00 0.00 39.78 37.35 3kze n ASN 900 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3kze s ARG 901 N -1.51 3.23 0.47 3.52 0.52 -0.49 -5.08 118.95 119.60 3kze s ARG 901 Ca 0.00 -0.53 -0.23 0.00 -0.52 0.00 0.00 55.73 54.45 3kze s ARG 901 Cb 0.00 -2.76 -0.07 0.00 0.52 0.00 0.00 34.95 32.64 3kze s ARG 901 CO 0.00 0.45 1.25 0.00 0.02 0.00 0.00 175.30 177.02 3kze s ALA 902 N -0.22 3.01 0.31 2.13 0.00 -1.26 -0.72 121.76 125.01 3kze s ALA 902 Ca 0.04 1.12 0.07 0.00 0.00 0.00 0.00 51.96 53.18 3kze s ALA 902 Cb -0.13 -3.46 0.77 0.00 0.00 0.00 0.00 23.12 20.30 3kze s ALA 902 CO 0.02 -0.89 1.78 0.00 0.00 0.00 0.00 175.76 176.67 3kze h ALA 903 N 2.06 1.72 0.00 0.00 0.00 -1.52 0.26 119.26 121.77 3kze h ALA 903 Ca -0.50 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3kze h ALA 903 Cb 1.26 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3kze h ALA 903 CO 0.60 -0.09 0.00 -0.40 0.00 0.00 0.00 179.25 179.36 3kze n ASP 904 N -4.75 0.44 -0.54 0.00 5.68 -1.25 -1.98 116.55 114.14 3kze n ASP 904 Ca 0.23 0.61 0.12 0.00 -0.50 0.00 0.00 54.79 55.25 3kze n ASP 904 Cb 0.59 -0.70 0.16 0.00 -1.14 0.00 0.00 41.12 40.02 3kze n ASP 904 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3kze n ALA 905 N -1.68 3.11 -2.64 2.12 0.00 0.91 -4.78 120.51 117.56 3kze n ALA 905 Ca 0.03 -0.58 -0.33 0.00 0.00 0.00 0.00 53.44 52.56 3kze n ALA 905 Cb 0.21 -0.91 -0.05 0.00 0.00 0.00 0.00 19.45 18.70 3kze n ALA 905 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kze s LEU 906 N -2.33 4.29 0.47 0.00 1.43 -0.84 -4.96 118.68 116.76 3kze s LEU 906 Ca 0.24 0.66 0.03 0.00 -1.03 0.00 0.00 54.13 54.04 3kze s LEU 906 Cb 0.19 -3.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.20 3kze s LEU 906 CO 0.48 0.10 0.02 0.54 0.23 0.00 0.00 176.35 177.71 3kze s ASN 907 N -2.17 4.07 0.21 2.29 2.20 -1.26 -4.99 114.94 115.29 3kze s ASN 907 Ca 0.38 -1.53 -0.09 0.00 -0.94 0.00 0.00 52.86 50.68 3kze s ASN 907 Cb -0.13 0.17 0.27 0.00 -2.00 0.00 0.00 41.25 39.57 3kze s ASN 907 CO 0.22 -0.71 1.78 0.28 -2.94 0.00 0.00 177.10 175.72 3kze h SER 908 N 1.48 0.40 -0.44 3.54 0.02 -1.99 -0.25 113.55 116.32 3kze h SER 908 Ca -0.44 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 60.60 3kze h SER 908 Cb 1.29 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.78 3kze h SER 908 CO 0.76 0.25 0.23 0.28 -1.14 0.00 0.00 176.83 177.20 3kze h SER 909 N 0.55 0.34 -0.34 3.07 0.02 -1.99 -1.13 113.55 114.07 3kze h SER 909 Ca 0.31 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.22 3kze h SER 909 Cb 0.30 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 3kze h SER 909 CO -0.25 0.24 0.00 0.24 -1.14 0.00 0.00 176.83 175.93 3kze h MET 910 N 0.46 0.61 0.09 3.45 2.86 -1.82 -1.36 114.93 119.22 3kze h MET 910 Ca 0.18 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3kze h MET 910 Cb 0.07 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 3kze h MET 910 CO -0.12 0.72 -0.10 -0.07 1.06 0.00 0.00 176.91 178.40 3kze h LEU 911 N 0.42 -0.26 -0.96 1.22 3.38 -0.80 0.38 115.31 118.69 3kze h LEU 911 Ca 0.10 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 3kze h LEU 911 Cb 0.44 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 3kze h LEU 911 CO 0.02 -0.15 0.51 0.11 0.09 0.00 0.00 178.44 179.01 3kze h LYS 912 N -0.22 1.24 0.87 1.13 1.57 -1.12 -0.82 116.57 119.22 3kze h LYS 912 Ca 0.01 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.61 3kze h LYS 912 Cb 0.21 -0.25 0.01 0.00 0.08 0.00 0.00 32.23 32.28 3kze h LYS 912 CO -0.03 0.89 -0.42 0.22 -0.57 0.00 0.00 179.45 179.54 3kze h ASP 913 N 1.25 -0.99 -0.62 0.86 3.58 -0.80 -2.85 116.42 116.85 3kze h ASP 913 Ca 0.32 0.03 0.04 0.00 0.42 0.00 0.00 57.03 57.84 3kze h ASP 913 Cb -0.00 0.26 -0.04 0.00 1.72 0.00 0.00 39.33 41.26 3kze h ASP 913 CO -0.05 -0.67 0.37 -0.26 -2.88 0.00 0.00 179.24 175.74 3kze h PHE 914 N -1.23 0.68 0.00 0.28 0.04 -0.81 -2.36 116.94 113.54 3kze h PHE 914 Ca -0.12 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.67 3kze h PHE 914 Cb 0.90 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 38.83 3kze h PHE 914 CO -0.01 0.36 0.00 -0.07 -0.60 0.00 0.00 178.31 178.00 3kze h LEU 915 N 0.71 0.00 -0.85 1.54 3.38 -1.16 -2.61 115.31 116.32 3kze h LEU 915 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3kze h LEU 915 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3kze h LEU 915 CO -0.13 0.00 -0.53 -1.54 0.09 0.00 0.00 178.44 176.32 3kze n SER 916 N -2.72 1.85 -4.77 -0.43 3.41 -0.91 -4.89 113.62 105.17 3kze n SER 916 Ca 0.00 -1.42 -0.30 0.00 -0.26 0.00 0.00 58.87 56.90 3kze n SER 916 Cb 0.22 0.53 0.10 0.00 -0.26 0.00 0.00 64.21 64.80 3kze n SER 916 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3kze s GLN 917 N -2.55 1.87 0.49 4.33 -0.21 -0.99 -4.94 119.66 117.66 3kze s GLN 917 Ca 0.17 0.81 0.32 0.00 0.02 0.00 0.00 55.36 56.69 3kze s GLN 917 Cb 0.18 -1.88 1.44 0.00 1.00 0.00 0.00 33.01 33.75 3kze s GLN 917 CO 0.61 -1.81 1.97 -1.35 -2.12 0.00 0.00 175.29 172.58 3kze h PRO 918 N -1.24 0.00 -3.92 2.91 0.11 -1.94 -3.44 132.00 124.48 3kze h PRO 918 Ca -0.47 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.54 3kze h PRO 918 Cb 1.26 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.23 3kze h PRO 918 CO 0.56 0.00 -0.48 -1.54 -0.21 0.00 0.00 178.00 176.33 3kze s SER 919 N -5.18 0.23 -0.20 -2.05 1.04 -1.26 -0.94 113.70 105.34 3kze s SER 919 Ca 0.01 -0.73 -0.13 0.00 0.48 0.00 0.00 55.95 55.58 3kze s SER 919 Cb 0.09 0.28 0.06 0.00 0.10 0.00 0.00 66.02 66.56 3kze s SER 919 CO 0.47 -0.66 0.50 -0.22 0.98 0.00 0.00 173.24 174.31 3kze s LEU 920 N -2.76 -0.27 -0.08 2.42 2.96 -0.15 -4.98 118.68 115.82 3kze s LEU 920 Ca 0.04 1.08 0.01 0.00 -0.22 0.00 0.00 54.13 55.05 3kze s LEU 920 Cb 0.05 1.71 -0.02 0.00 0.50 0.00 0.00 46.19 48.42 3kze s LEU 920 CO -0.10 -0.20 -0.12 -0.83 -1.32 0.00 0.00 176.35 173.78 3kze s GLY 921 N 1.18 1.58 0.02 7.98 0.00 -1.26 -1.04 107.32 115.77 3kze s GLY 921 Ca -0.07 -0.92 0.05 0.00 0.00 0.00 0.00 44.72 43.77 3kze s GLY 921 CO -0.11 -0.53 -0.15 1.08 0.00 0.00 0.00 173.10 173.39 3kze s LEU 922 N -0.35 2.10 -0.26 0.66 1.43 0.25 -0.66 118.68 121.85 3kze s LEU 922 Ca 0.04 -0.37 -0.06 0.00 -1.03 0.00 0.00 54.13 52.71 3kze s LEU 922 Cb -0.12 -0.72 -0.00 0.00 0.03 0.00 0.00 46.19 45.37 3kze s LEU 922 CO 0.02 0.12 0.03 -0.22 0.23 0.00 0.00 176.35 176.54 3kze s LEU 923 N -0.75 3.45 -0.06 1.79 2.96 -0.16 -0.79 118.68 125.12 3kze s LEU 923 Ca 0.04 -0.55 0.05 0.00 -0.22 0.00 0.00 54.13 53.46 3kze s LEU 923 Cb -0.07 -1.83 -0.01 0.00 0.50 0.00 0.00 46.19 44.78 3kze s LEU 923 CO 0.00 -0.11 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.01 3kze s VAL 924 N 1.50 2.32 -0.17 1.68 1.01 0.12 -0.03 120.40 126.83 3kze s VAL 924 Ca 0.04 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 3kze s VAL 924 Cb -0.16 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 3kze s VAL 924 CO 0.00 0.57 -0.06 -0.60 0.00 0.00 0.00 175.10 175.01 3kze s ARG 925 N -0.24 3.53 0.13 2.72 3.52 0.39 -0.50 118.95 128.49 3kze s ARG 925 Ca -0.01 -0.59 -0.03 0.00 -0.13 0.00 0.00 55.73 54.97 3kze s ARG 925 Cb -0.13 -2.87 -0.03 0.00 -1.56 0.00 0.00 34.95 30.36 3kze s ARG 925 CO 0.03 0.12 0.12 -0.08 -0.81 0.00 0.00 175.30 174.68 3kze s THR 926 N 0.65 0.10 -0.12 4.11 -1.32 0.15 -0.97 115.64 118.24 3kze s THR 926 Ca -0.04 -1.74 -0.12 0.00 -1.21 0.00 0.00 61.69 58.58 3kze s THR 926 Cb -0.15 -1.93 -0.05 0.00 -1.51 0.00 0.00 72.50 68.86 3kze s THR 926 CO 0.02 -0.46 0.28 -0.31 -2.21 0.00 0.00 174.62 171.95 3kze s TYR 927 N -4.01 3.54 0.60 9.09 2.02 -1.26 -0.28 117.35 127.06 3kze s TYR 927 Ca 0.21 0.66 -0.18 0.00 -0.37 0.00 0.00 57.07 57.38 3kze s TYR 927 Cb 0.06 -2.24 -0.05 0.00 -0.40 0.00 0.00 41.96 39.33 3kze s TYR 927 CO 0.00 0.43 0.96 -2.30 -1.57 0.00 0.00 175.55 173.07 3kze n PRO 928 N 2.88 0.89 -2.40 -1.71 -0.02 -1.26 -4.91 135.00 128.46 3kze n PRO 928 Ca -0.14 0.34 -0.42 0.00 -2.02 0.00 0.00 63.50 61.26 3kze n PRO 928 Cb 0.53 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 3kze n PRO 928 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3kze s GLU 929 N -2.75 4.38 0.00 -0.52 2.02 -1.26 -5.14 118.70 115.43 3kze s GLU 929 Ca 0.76 1.77 0.30 0.00 0.02 0.00 0.00 54.97 57.82 3kze s GLU 929 Cb -0.42 -3.45 1.52 0.00 0.10 0.00 0.00 34.13 31.89 3kze s GLU 929 CO 0.47 -0.37 2.01 1.28 0.02 0.00 0.00 175.26 178.67