#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1in1 n SER 836 N 0.00 0.00 -0.22 1.61 3.41 -1.26 -4.95 113.62 112.21 1in1 n SER 836 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1in1 n SER 836 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1in1 n SER 836 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1in1 n ALA 837 N -3.00 -0.34 -0.47 7.33 0.00 -1.26 0.34 120.51 123.12 1in1 n ALA 837 Ca 0.00 0.45 0.41 0.00 0.00 0.00 0.00 53.44 54.30 1in1 n ALA 837 Cb 0.00 0.08 0.76 0.00 0.00 0.00 0.00 19.45 20.29 1in1 n ALA 837 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1in1 h ASP 838 N 0.00 0.04 0.41 0.00 5.19 -1.94 2.06 116.42 122.17 1in1 h ASP 838 Ca 0.08 0.01 -0.31 0.00 -0.62 0.00 0.00 57.03 56.20 1in1 h ASP 838 Cb 0.22 0.01 -0.05 0.00 0.18 0.00 0.00 39.33 39.68 1in1 h ASP 838 CO -0.49 -0.01 -1.81 -0.62 -3.12 0.00 0.00 179.24 173.19 1in1 n GLU 839 N -4.15 0.65 0.00 3.56 -0.58 1.06 -3.69 120.64 117.49 1in1 n GLU 839 Ca 0.33 0.26 0.00 0.00 -0.42 0.00 0.00 57.16 57.33 1in1 n GLU 839 Cb 1.53 -1.76 0.00 0.00 -0.57 0.00 0.00 31.44 30.64 1in1 n GLU 839 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1in1 n THR 840 N -3.04 0.00 0.00 2.62 -1.04 0.64 -4.19 114.28 109.26 1in1 n THR 840 Ca -0.20 0.42 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 1in1 n THR 840 Cb 1.06 -1.36 0.00 0.00 -1.82 0.00 0.00 70.33 68.21 1in1 n THR 840 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1in1 n LEU 841 N -2.13 0.00 0.00 -4.42 -0.00 0.59 -1.96 117.00 109.08 1in1 n LEU 841 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 56.01 56.03 1in1 n LEU 841 Cb 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 43.42 43.50 1in1 n LEU 841 CO 0.00 0.00 0.51 0.00 -0.00 0.00 0.00 177.39 177.90 1in1 n GLN 843 N -1.39 3.02 -2.91 0.00 1.13 -0.83 -4.98 117.38 111.42 1in1 n GLN 843 Ca 0.01 -3.79 -0.01 0.00 -1.94 0.00 0.00 57.00 51.27 1in1 n GLN 843 Cb 0.03 -2.27 -0.01 0.00 0.11 0.00 0.00 30.24 28.10 1in1 n GLN 843 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1in1 n THR 844 N -0.64 -3.19 0.00 5.09 -1.04 -0.85 0.14 114.28 113.79 1in1 n THR 844 Ca 0.51 0.54 0.00 0.00 -2.04 0.00 0.00 64.05 63.06 1in1 n THR 844 Cb 0.54 -3.19 0.00 0.00 -1.82 0.00 0.00 70.33 65.86 1in1 n THR 844 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1in1 n LYS 845 N 2.35 0.00 0.00 -2.82 4.01 -1.25 -4.35 118.16 116.10 1in1 n LYS 845 Ca -0.07 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.73 1in1 n LYS 845 Cb 0.12 -0.66 0.00 0.00 -0.51 0.00 0.00 35.03 33.97 1in1 n LYS 845 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 1in1 n VAL 846 N 0.66 0.00 0.00 -0.18 0.24 0.12 -4.63 118.33 114.54 1in1 n VAL 846 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1in1 n VAL 846 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1in1 n VAL 846 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1in1 n LEU 847 N 0.00 0.00 0.00 1.34 7.99 -1.26 -5.02 117.00 120.05 1in1 n LEU 847 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.00 1in1 n LEU 847 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1in1 n LEU 847 CO 0.00 0.00 0.00 0.18 -1.51 0.00 0.00 177.39 176.06 1in1 n LEU 848 N 0.00 0.00 -1.99 2.23 4.77 -1.26 -4.41 117.00 116.34 1in1 n LEU 848 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1in1 n LEU 848 Cb 0.00 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.96 1in1 n LEU 848 CO 0.00 0.00 1.43 0.47 -1.33 0.00 0.00 177.39 177.96 1in1 n ASP 849 N -0.54 4.73 0.00 -1.43 9.92 -1.20 -4.52 116.55 123.51 1in1 n ASP 849 Ca 0.00 -2.37 0.00 0.00 -0.53 0.00 0.00 54.79 51.89 1in1 n ASP 849 Cb 0.00 -1.24 0.00 0.00 -0.64 0.00 0.00 41.12 39.24 1in1 n ASP 849 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1in1 n ILE 850 N 2.42 0.00 -0.16 0.53 -0.00 -1.07 0.39 119.36 121.47 1in1 n ILE 850 Ca 0.34 0.73 -0.10 0.00 -0.00 0.00 0.00 62.75 63.72 1in1 n ILE 850 Cb 0.78 -1.44 0.05 0.00 -0.00 0.00 0.00 39.64 39.03 1in1 n ILE 850 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 1in1 n PHE 851 N -1.08 1.10 -0.69 1.39 3.01 -1.25 0.15 117.46 120.09 1in1 n PHE 851 Ca 0.00 -1.25 -0.29 0.00 1.01 0.00 0.00 57.45 56.92 1in1 n PHE 851 Cb 0.00 -0.62 -0.07 0.00 -0.01 0.00 0.00 39.48 38.78 1in1 n PHE 851 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40 1in1 n THR 852 N 0.20 0.00 0.00 4.37 5.66 -1.25 0.23 114.28 123.49 1in1 n THR 852 Ca 0.21 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.21 1in1 n THR 852 Cb 0.78 -0.26 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 1in1 n THR 852 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1in1 n GLY 853 N 3.83 0.69 2.24 1.09 0.00 -1.26 -4.77 105.19 107.00 1in1 n GLY 853 Ca 0.30 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.91 1in1 n GLY 853 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1in1 n VAL 854 N 0.00 0.00 -3.53 1.61 0.31 0.62 -4.22 118.33 113.12 1in1 n VAL 854 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.92 1in1 n VAL 854 Cb 0.00 -0.32 -0.07 0.00 -0.91 0.00 0.00 33.84 32.54 1in1 n VAL 854 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1in1 s ARG 855 N 2.93 2.90 -0.10 5.55 1.70 -1.26 -3.91 118.95 126.75 1in1 s ARG 855 Ca 0.72 -2.28 -0.03 0.00 -0.47 0.00 0.00 55.73 53.67 1in1 s ARG 855 Cb -0.96 -4.03 -0.03 0.00 -0.57 0.00 0.00 34.95 29.35 1in1 s ARG 855 CO 0.47 -1.22 0.03 -0.48 -1.08 0.00 0.00 175.30 173.02 1in1 s LEU 856 N 0.44 3.74 -0.83 -1.89 0.05 -1.19 2.66 118.68 121.66 1in1 s LEU 856 Ca 0.14 0.19 -0.26 0.00 0.05 0.00 0.00 54.13 54.25 1in1 s LEU 856 Cb -0.19 -1.88 0.03 0.00 -2.05 0.00 0.00 46.19 42.11 1in1 s LEU 856 CO -0.04 0.36 1.36 -0.47 -0.55 0.00 0.00 176.35 177.01 1in1 s TYR 857 N -0.76 2.34 -0.40 3.48 5.04 0.86 -4.40 117.35 123.51 1in1 s TYR 857 Ca 0.12 -0.28 -0.27 0.00 -2.44 0.00 0.00 57.07 54.21 1in1 s TYR 857 Cb -0.12 -4.63 0.02 0.00 0.35 0.00 0.00 41.96 37.58 1in1 s TYR 857 CO 0.02 -2.04 0.98 -1.17 -1.34 0.00 0.00 175.55 172.01 1in1 s LEU 858 N 5.64 3.93 0.67 6.97 2.96 -1.26 0.23 118.68 137.82 1in1 s LEU 858 Ca 0.40 0.50 -0.13 0.00 -0.22 0.00 0.00 54.13 54.67 1in1 s LEU 858 Cb -0.05 -3.32 0.00 0.00 0.50 0.00 0.00 46.19 43.31 1in1 s LEU 858 CO 0.07 -0.97 1.08 -2.16 -1.32 0.00 0.00 176.35 173.04 1in1 s PRO 859 N 3.73 2.88 0.24 0.98 0.04 -1.26 -4.94 135.00 136.67 1in1 s PRO 859 Ca 0.40 1.18 0.06 0.00 0.04 0.00 0.00 61.00 62.68 1in1 s PRO 859 Cb -0.11 -1.97 0.26 0.00 0.04 0.00 0.00 34.50 32.72 1in1 s PRO 859 CO 0.22 -1.16 1.56 -1.00 0.04 0.00 0.00 177.00 176.66 1in1 h PRO 860 N -0.26 0.17 0.00 0.56 0.13 -1.99 -2.61 132.00 128.00 1in1 h PRO 860 Ca -0.45 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.55 1in1 h PRO 860 Cb 1.23 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1in1 h PRO 860 CO 0.55 0.74 0.00 0.43 -0.23 0.00 0.00 178.00 179.50 1in1 n SER 861 N -3.84 0.00 -4.76 1.44 7.64 -1.26 -4.77 113.62 108.07 1in1 n SER 861 Ca -0.02 0.18 -0.38 0.00 1.01 0.00 0.00 58.87 59.66 1in1 n SER 861 Cb 0.63 -0.34 0.01 0.00 -1.01 0.00 0.00 64.21 63.50 1in1 n SER 861 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1in1 s THR 862 N -2.68 2.67 0.22 0.44 2.01 -0.98 -4.97 115.64 112.35 1in1 s THR 862 Ca 0.12 0.50 -0.30 0.00 0.31 0.00 0.00 61.69 62.33 1in1 s THR 862 Cb 0.10 -3.26 -0.09 0.00 0.01 0.00 0.00 72.50 69.27 1in1 s THR 862 CO 0.24 -0.01 1.19 -2.16 -0.69 0.00 0.00 174.62 173.19 1in1 s PRO 863 N -2.78 4.51 0.00 4.92 0.04 -1.26 -2.45 135.00 137.97 1in1 s PRO 863 Ca 0.67 1.90 0.00 0.00 0.04 0.00 0.00 61.00 63.61 1in1 s PRO 863 Cb -0.34 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 30.99 1in1 s PRO 863 CO 0.40 -0.04 0.00 -0.25 0.04 0.00 0.00 177.00 177.15 1in1 n ASP 864 N 2.08 -4.07 -0.29 6.66 9.92 -1.26 -4.79 116.55 124.81 1in1 n ASP 864 Ca 0.03 0.00 0.03 0.00 -0.53 0.00 0.00 54.79 54.32 1in1 n ASP 864 Cb 0.44 -2.57 0.08 0.00 -0.64 0.00 0.00 41.12 38.43 1in1 n ASP 864 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1in1 n PHE 865 N -2.19 0.19 -0.43 1.24 7.35 -1.02 0.20 117.46 122.80 1in1 n PHE 865 Ca 0.00 0.97 0.34 0.00 -0.76 0.00 0.00 57.45 57.99 1in1 n PHE 865 Cb 0.29 -0.90 0.53 0.00 0.35 0.00 0.00 39.48 39.75 1in1 n PHE 865 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1in1 n SER 866 N -5.24 0.05 -0.04 -2.13 7.64 -1.26 -0.73 113.62 111.91 1in1 n SER 866 Ca 0.11 0.78 -0.04 0.00 1.01 0.00 0.00 58.87 60.72 1in1 n SER 866 Cb 0.37 -0.39 -0.01 0.00 -1.01 0.00 0.00 64.21 63.17 1in1 n SER 866 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1in1 n ARG 867 N -3.57 0.25 -0.16 1.43 1.74 0.54 -4.12 116.66 112.76 1in1 n ARG 867 Ca 0.30 0.10 0.05 0.00 -0.77 0.00 0.00 57.85 57.52 1in1 n ARG 867 Cb 1.28 -0.89 0.10 0.00 -1.02 0.00 0.00 32.46 31.93 1in1 n ARG 867 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1in1 n LEU 868 N -3.54 -0.11 0.00 0.55 4.77 -0.61 0.36 117.00 118.41 1in1 n LEU 868 Ca -0.07 0.77 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 1in1 n LEU 868 Cb 0.24 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1in1 n LEU 868 CO 0.10 -0.76 0.15 -1.14 -1.33 0.00 0.00 177.39 174.41 1in1 n ARG 869 N -4.62 0.00 -0.45 3.23 0.63 0.09 1.00 116.66 116.54 1in1 n ARG 869 Ca 0.09 0.00 0.38 0.00 -0.92 0.00 0.00 57.85 57.40 1in1 n ARG 869 Cb 0.28 -0.77 0.70 0.00 0.45 0.00 0.00 32.46 33.12 1in1 n ARG 869 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1in1 h ARG 870 N 0.00 0.09 0.00 -0.14 9.65 -1.35 -2.05 114.38 120.57 1in1 h ARG 870 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1in1 h ARG 870 Cb 0.00 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.56 1in1 h ARG 870 CO 0.00 0.06 0.00 0.98 2.80 0.00 0.00 179.97 183.81 1in1 n TYR 871 N -4.35 0.00 0.00 2.20 4.19 1.13 -1.95 117.16 118.38 1in1 n TYR 871 Ca 0.33 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.54 1in1 n TYR 871 Cb 1.41 -0.29 0.00 0.00 0.49 0.00 0.00 39.34 40.96 1in1 n TYR 871 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1in1 n PHE 872 N -1.36 0.00 -0.50 2.98 -0.00 0.28 0.28 117.46 119.14 1in1 n PHE 872 Ca 0.00 0.00 0.42 0.00 -0.00 0.00 0.00 57.45 57.87 1in1 n PHE 872 Cb 0.00 -0.13 0.76 0.00 -0.00 0.00 0.00 39.48 40.11 1in1 n PHE 872 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.76 176.52 1in1 h VAL 873 N 0.00 0.22 0.27 -2.13 3.04 -1.58 -0.40 116.25 115.67 1in1 h VAL 873 Ca 0.00 -0.01 -0.01 0.00 -1.01 0.00 0.00 66.70 65.67 1in1 h VAL 873 Cb 0.00 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 29.47 1in1 h VAL 873 CO 0.00 0.00 -0.13 0.00 -1.01 0.00 0.00 177.57 176.44 1in1 h ALA 874 N 1.27 -0.94 -0.09 3.17 0.00 0.47 -3.11 119.26 120.04 1in1 h ALA 874 Ca 0.75 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.60 1in1 h ALA 874 Cb 2.90 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 20.81 1in1 h ALA 874 CO -0.07 -0.91 -0.02 1.19 0.00 0.00 0.00 179.25 179.44 1in1 n PHE 875 N -3.11 0.02 0.00 0.00 3.01 0.37 -4.38 117.46 113.37 1in1 n PHE 875 Ca -0.04 0.11 0.00 0.00 1.01 0.00 0.00 57.45 58.52 1in1 n PHE 875 Cb 0.14 -0.55 0.00 0.00 -0.01 0.00 0.00 39.48 39.07 1in1 n PHE 875 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1in1 n ASP 876 N -4.14 0.00 0.00 4.37 8.00 -1.18 -4.84 116.55 118.77 1in1 n ASP 876 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.51 1in1 n ASP 876 Cb 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 1in1 n ASP 876 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1in1 n GLY 877 N 0.00 1.65 3.43 0.44 0.00 -1.19 -4.06 105.19 105.47 1in1 n GLY 877 Ca 0.00 -1.56 -0.14 0.00 0.00 0.00 0.00 46.02 44.32 1in1 n GLY 877 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1in1 s ASP 878 N -1.00 -0.54 -0.04 1.61 1.01 -1.25 -4.78 116.67 111.68 1in1 s ASP 878 Ca 0.00 0.20 -0.00 0.00 0.71 0.00 0.00 52.55 53.46 1in1 s ASP 878 Cb 0.00 0.55 0.03 0.00 1.01 0.00 0.00 42.92 44.51 1in1 s ASP 878 CO 0.00 -0.82 0.01 -0.76 0.21 0.00 0.00 175.17 173.81 1in1 s LEU 879 N -2.19 0.97 -0.06 1.23 1.43 -1.26 -3.35 118.68 115.45 1in1 s LEU 879 Ca -0.03 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.06 1in1 s LEU 879 Cb -0.01 -0.24 -0.03 0.00 0.03 0.00 0.00 46.19 45.94 1in1 s LEU 879 CO -0.05 -0.13 -0.08 0.68 0.23 0.00 0.00 176.35 177.01 1in1 s VAL 880 N 1.28 3.64 0.15 -1.59 -7.23 -1.26 -5.01 120.40 110.38 1in1 s VAL 880 Ca -0.06 -0.54 -0.30 0.00 -1.81 0.00 0.00 61.98 59.27 1in1 s VAL 880 Cb -0.13 -2.49 -0.08 0.00 0.56 0.00 0.00 36.38 34.24 1in1 s VAL 880 CO -0.02 0.57 1.25 -1.10 -0.31 0.00 0.00 175.10 175.49 1in1 s GLN 881 N -0.88 4.43 0.04 4.82 -0.21 -0.35 -4.47 119.66 123.04 1in1 s GLN 881 Ca 0.13 1.92 -0.07 0.00 0.02 0.00 0.00 55.36 57.36 1in1 s GLN 881 Cb -0.11 -3.26 -0.02 0.00 1.00 0.00 0.00 33.01 30.63 1in1 s GLN 881 CO 0.02 -0.22 0.49 -1.91 -2.12 0.00 0.00 175.29 171.55 1in1 n GLU 882 N 3.09 -0.10 0.00 2.91 2.13 -1.26 0.79 120.64 128.20 1in1 n GLU 882 Ca 0.07 0.48 0.00 0.00 0.66 0.00 0.00 57.16 58.37 1in1 n GLU 882 Cb 0.44 -0.71 0.00 0.00 0.27 0.00 0.00 31.44 31.44 1in1 n GLU 882 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1in1 n PHE 883 N -3.75 0.00 -3.20 4.31 -1.74 -1.26 -4.17 117.46 107.65 1in1 n PHE 883 Ca 0.00 -0.02 -0.00 0.00 -0.56 0.00 0.00 57.45 56.87 1in1 n PHE 883 Cb 0.06 -0.06 -0.02 0.00 1.52 0.00 0.00 39.48 40.98 1in1 n PHE 883 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1in1 s ASP 884 N -0.34 -1.02 0.29 5.98 1.01 4.22 -5.02 116.67 121.79 1in1 s ASP 884 Ca 0.00 -0.02 0.00 0.00 0.71 0.00 0.00 52.55 53.24 1in1 s ASP 884 Cb 0.00 1.75 0.00 0.00 1.01 0.00 0.00 42.92 45.68 1in1 s ASP 884 CO 0.00 -0.31 0.00 1.15 0.21 0.00 0.00 175.17 176.22 1in1 n MET 885 N 5.36 0.00 0.00 8.23 0.00 -1.24 -1.21 117.12 128.26 1in1 n MET 885 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.74 1in1 n MET 885 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.75 1in1 n MET 885 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1in1 n THR 886 N -3.10 0.00 0.79 3.17 -2.24 -1.23 0.54 114.28 112.20 1in1 n THR 886 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 1in1 n THR 886 Cb 0.00 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.17 1in1 n THR 886 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1in1 n SER 887 N 0.00 0.74 -4.04 3.42 7.64 -1.26 -4.79 113.62 115.33 1in1 n SER 887 Ca 0.00 -0.65 -0.37 0.00 1.01 0.00 0.00 58.87 58.87 1in1 n SER 887 Cb 0.00 1.02 0.06 0.00 -1.01 0.00 0.00 64.21 64.28 1in1 n SER 887 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1in1 n ALA 888 N -1.66 -5.25 -0.00 -0.43 0.00 2.14 -4.97 120.51 110.34 1in1 n ALA 888 Ca 0.03 -1.35 -0.00 0.00 0.00 0.00 0.00 53.44 52.12 1in1 n ALA 888 Cb 0.38 -0.90 -0.00 0.00 0.00 0.00 0.00 19.45 18.93 1in1 n ALA 888 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1in1 n THR 889 N -3.67 0.01 -4.37 0.00 5.66 -1.00 -4.38 114.28 106.53 1in1 n THR 889 Ca -0.01 -0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.79 1in1 n THR 889 Cb 0.71 -0.66 -0.10 0.00 -1.55 0.00 0.00 70.33 68.73 1in1 n THR 889 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 1in1 s HIS 890 N -2.00 1.80 -0.17 1.09 3.76 61.10 -1.04 115.29 179.83 1in1 s HIS 890 Ca -0.00 -0.56 -0.07 0.00 -0.15 0.00 0.00 55.06 54.28 1in1 s HIS 890 Cb 0.00 -0.85 0.07 0.00 1.11 0.00 0.00 32.58 32.91 1in1 s HIS 890 CO 0.00 0.39 0.36 0.14 -0.85 0.00 0.00 174.74 174.78 1in1 s VAL 891 N -2.93 -0.38 -0.21 -0.90 -7.23 0.72 0.30 120.40 109.76 1in1 s VAL 891 Ca 0.24 0.18 -0.29 0.00 -1.81 0.00 0.00 61.98 60.30 1in1 s VAL 891 Cb -0.01 -0.57 -0.00 0.00 0.56 0.00 0.00 36.38 36.36 1in1 s VAL 891 CO 0.08 0.07 1.17 -0.22 -0.31 0.00 0.00 175.10 175.90 1in1 s LEU 892 N 2.15 4.11 0.00 1.32 0.20 0.14 -1.68 118.68 124.92 1in1 s LEU 892 Ca -0.04 1.50 -0.01 0.00 0.69 0.00 0.00 54.13 56.28 1in1 s LEU 892 Cb -0.11 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.11 1in1 s LEU 892 CO -0.11 -0.76 0.02 0.61 -0.29 0.00 0.00 176.35 175.81 1in1 n GLY 893 N 3.58 -4.53 0.00 7.98 0.00 0.87 -4.67 105.19 108.42 1in1 n GLY 893 Ca 0.13 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1in1 n GLY 893 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1in1 n SER 894 N 1.89 0.00 0.00 1.61 7.64 -1.26 -4.99 113.62 118.51 1in1 n SER 894 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1in1 n SER 894 Cb 0.04 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1in1 n SER 894 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1in1 n ARG 895 N -1.37 0.00 0.00 1.43 1.85 -1.26 -4.40 116.66 112.91 1in1 n ARG 895 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1in1 n ARG 895 Cb 0.00 -0.39 0.00 0.00 -1.05 0.00 0.00 32.46 31.02 1in1 n ARG 895 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1in1 n ASP 896 N -0.73 0.00 -0.25 2.89 2.03 -1.26 0.69 116.55 119.91 1in1 n ASP 896 Ca 0.00 0.00 0.22 0.00 0.52 0.00 0.00 54.79 55.53 1in1 n ASP 896 Cb 0.00 0.00 0.36 0.00 -0.72 0.00 0.00 41.12 40.76 1in1 n ASP 896 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1in1 n LYS 897 N -0.40 -0.02 -3.23 -0.67 -0.00 -1.26 -2.98 118.16 109.59 1in1 n LYS 897 Ca 0.00 0.67 -0.03 0.00 -0.00 0.00 0.00 58.31 58.95 1in1 n LYS 897 Cb 0.00 -1.32 -0.03 0.00 -0.00 0.00 0.00 35.03 33.68 1in1 n LYS 897 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 1in1 s ASN 898 N -4.42 -0.70 0.13 -5.58 3.84 3.23 -3.56 114.94 107.88 1in1 s ASN 898 Ca -0.04 -0.40 0.21 0.00 0.21 0.00 0.00 52.86 52.85 1in1 s ASN 898 Cb 0.17 1.58 0.86 0.00 -0.55 0.00 0.00 41.25 43.30 1in1 s ASN 898 CO 0.44 -0.28 1.65 -0.81 -2.79 0.00 0.00 177.10 175.31 1in1 n PRO 899 N 5.05 0.11 -0.03 0.43 -0.04 -1.04 -1.94 135.00 137.53 1in1 n PRO 899 Ca 0.06 0.28 0.13 0.00 -0.04 0.00 0.00 63.50 63.93 1in1 n PRO 899 Cb 0.52 -1.68 0.43 0.00 -0.04 0.00 0.00 33.50 32.73 1in1 n PRO 899 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1in1 n ALA 900 N -1.64 2.54 -1.75 0.55 0.00 -1.26 -4.87 120.51 114.08 1in1 n ALA 900 Ca 0.04 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1in1 n ALA 900 Cb 0.24 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1in1 n ALA 900 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1in1 n ALA 901 N 0.36 0.00 -3.29 0.00 0.00 -0.82 -4.65 120.51 112.11 1in1 n ALA 901 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.35 1in1 n ALA 901 Cb 0.37 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.66 1in1 n ALA 901 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1in1 s GLN 902 N 2.69 1.98 -1.41 0.00 -1.52 -0.21 -4.75 119.66 116.44 1in1 s GLN 902 Ca 0.00 -0.55 -0.08 0.00 -1.95 0.00 0.00 55.36 52.78 1in1 s GLN 902 Cb 0.00 -1.61 0.06 0.00 -0.22 0.00 0.00 33.01 31.24 1in1 s GLN 902 CO 0.00 0.11 2.45 1.04 -0.25 0.00 0.00 175.29 178.64 1in1 n GLN 903 N 3.60 4.04 -1.93 2.91 6.02 -1.23 0.26 117.38 131.05 1in1 n GLN 903 Ca -0.21 -3.04 -0.29 0.00 -0.01 0.00 0.00 57.00 53.45 1in1 n GLN 903 Cb 0.52 -2.78 0.13 0.00 1.02 0.00 0.00 30.24 29.12 1in1 n GLN 903 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1in1 s VAL 904 N 0.41 2.01 0.09 5.09 -7.23 -0.68 -3.70 120.40 116.38 1in1 s VAL 904 Ca 0.56 -0.01 0.00 0.00 -1.81 0.00 0.00 61.98 60.72 1in1 s VAL 904 Cb 0.16 -3.00 -0.00 0.00 0.56 0.00 0.00 36.38 34.11 1in1 s VAL 904 CO -0.07 0.00 0.01 -1.20 -0.31 0.00 0.00 175.10 173.53 1in1 n SER 905 N -3.48 1.73 0.16 4.85 7.64 -1.26 -0.09 113.62 123.17 1in1 n SER 905 Ca 0.11 -1.40 0.02 0.00 1.01 0.00 0.00 58.87 58.60 1in1 n SER 905 Cb 0.60 0.12 0.24 0.00 -1.01 0.00 0.00 64.21 64.16 1in1 n SER 905 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1in1 h PRO 906 N 0.00 0.00 0.00 1.43 0.13 -1.99 -2.81 132.00 128.76 1in1 h PRO 906 Ca -0.07 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.98 1in1 h PRO 906 Cb 0.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.35 1in1 h PRO 906 CO 0.11 0.52 -0.36 0.93 -0.23 0.00 0.00 178.00 178.97 1in1 h GLU 907 N 0.00 0.00 0.25 0.86 3.07 -1.97 -3.21 114.58 113.58 1in1 h GLU 907 Ca -0.01 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.84 1in1 h GLU 907 Cb 1.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.93 1in1 h GLU 907 CO 0.07 0.36 -0.12 2.35 -1.40 0.00 0.00 179.01 180.27 1in1 h TRP 908 N 0.00 -0.32 -0.42 4.33 7.01 -1.84 -2.39 115.95 122.33 1in1 h TRP 908 Ca -0.00 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.06 1in1 h TRP 908 Cb 0.95 0.10 -0.09 0.00 -2.10 0.00 0.00 29.16 28.03 1in1 h TRP 908 CO 0.00 -0.07 -0.39 0.82 -2.79 0.00 0.00 178.44 176.00 1in1 h ILE 909 N -0.52 0.15 0.00 2.65 2.04 -1.61 0.94 117.51 121.15 1in1 h ILE 909 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1in1 h ILE 909 Cb 0.38 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1in1 h ILE 909 CO 0.06 0.00 0.00 0.79 0.00 0.00 0.00 178.15 179.00 1in1 n TRP 910 N -5.42 0.00 -0.31 1.37 5.03 -1.19 0.46 117.44 117.39 1in1 n TRP 910 Ca 0.00 0.00 0.15 0.00 3.03 0.00 0.00 57.50 60.68 1in1 n TRP 910 Cb 0.35 -0.46 0.32 0.00 -1.03 0.00 0.00 31.31 30.49 1in1 n TRP 910 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 1in1 h ALA 911 N -1.50 1.45 -0.05 6.99 0.00 -1.09 1.05 119.26 126.10 1in1 h ALA 911 Ca 0.00 0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 1in1 h ALA 911 Cb 0.00 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1in1 h ALA 911 CO 0.00 -0.41 -0.57 0.00 0.00 0.00 0.00 179.25 178.27 1in1 h ILE 913 N 0.12 0.09 -0.51 0.00 2.04 1.86 -2.42 117.51 118.68 1in1 h ILE 913 Ca -0.00 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 1in1 h ILE 913 Cb 1.04 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1in1 h ILE 913 CO 0.08 0.00 -0.06 -0.09 0.00 0.00 0.00 178.15 178.08 1in1 h ARG 914 N -1.07 0.94 0.00 2.37 1.12 -1.33 -2.04 114.38 114.36 1in1 h ARG 914 Ca -0.09 -0.33 0.00 0.00 -1.11 0.00 0.00 59.98 58.45 1in1 h ARG 914 Cb 0.88 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 30.77 1in1 h ARG 914 CO 0.06 0.99 0.00 1.63 -3.11 0.00 0.00 179.97 179.54 1in1 n LYS 915 N -4.24 0.00 -0.67 0.20 4.76 -0.25 -4.69 118.16 113.27 1in1 n LYS 915 Ca 0.01 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.42 1in1 n LYS 915 Cb 0.36 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 32.05 1in1 n LYS 915 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1in1 n ARG 916 N -0.95 -1.72 -1.26 1.97 3.00 -0.77 -4.72 116.66 112.21 1in1 n ARG 916 Ca 0.00 0.28 0.00 0.00 -0.01 0.00 0.00 57.85 58.12 1in1 n ARG 916 Cb 0.00 -3.85 0.00 0.00 0.00 0.00 0.00 32.46 28.61 1in1 n ARG 916 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 1in1 n ARG 917 N -0.28 0.00 -3.43 5.56 -4.01 1.28 -2.61 116.66 113.17 1in1 n ARG 917 Ca -0.03 0.00 -0.38 0.00 -1.04 0.00 0.00 57.85 56.41 1in1 n ARG 917 Cb 0.21 0.00 -0.07 0.00 -3.04 0.00 0.00 32.46 29.56 1in1 n ARG 917 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 1in1 s LEU 918 N 0.00 4.18 0.00 2.89 2.01 0.40 -3.91 118.68 124.24 1in1 s LEU 918 Ca 0.00 0.50 0.00 0.00 0.01 0.00 0.00 54.13 54.64 1in1 s LEU 918 Cb 0.00 -2.47 0.00 0.00 0.01 0.00 0.00 46.19 43.73 1in1 s LEU 918 CO 0.00 -0.03 0.00 1.33 1.01 0.00 0.00 176.35 178.66 1in1 n VAL 919 N 4.15 0.00 -2.15 -1.59 0.24 -1.26 -5.02 118.33 112.70 1in1 n VAL 919 Ca -0.09 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.78 1in1 n VAL 919 Cb 0.51 -0.94 -0.02 0.00 -1.47 0.00 0.00 33.84 31.92 1in1 n VAL 919 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1in1 s ALA 920 N -2.00 3.16 0.13 2.33 0.00 -1.26 -4.97 121.76 119.16 1in1 s ALA 920 Ca 0.00 0.30 -0.30 0.00 0.00 0.00 0.00 51.96 51.96 1in1 s ALA 920 Cb 0.00 -3.89 -0.07 0.00 0.00 0.00 0.00 23.12 19.16 1in1 s ALA 920 CO 0.00 -2.14 1.24 -1.25 0.00 0.00 0.00 175.76 173.61 1in1 s PRO 921 N 4.87 4.44 0.00 0.00 0.04 -1.26 -4.89 135.00 138.20 1in1 s PRO 921 Ca 0.70 1.88 0.00 0.00 0.04 0.00 0.00 61.00 63.63 1in1 s PRO 921 Cb -0.22 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.05 1in1 s PRO 921 CO 0.30 -0.21 0.00 0.00 0.04 0.00 0.00 177.00 177.13