#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 0.00 1.61 7.64 -1.26 -4.27 113.62 117.34 1in1 n SER 836 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1in1 n SER 836 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1in1 n SER 836 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1in1 n ALA 837 N -3.00 0.00 -0.30 -0.43 0.00 -1.26 0.03 120.51 115.56 1in1 n ALA 837 Ca 0.00 0.00 0.29 0.00 0.00 0.00 0.00 53.44 53.73 1in1 n ALA 837 Cb 0.00 0.00 0.54 0.00 0.00 0.00 0.00 19.45 19.99 1in1 n ALA 837 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1in1 n ASP 838 N 0.14 0.32 0.07 0.00 8.00 -1.26 0.54 116.55 124.36 1in1 n ASP 838 Ca 0.00 1.54 -0.07 0.00 0.71 0.00 0.00 54.79 56.96 1in1 n ASP 838 Cb 0.00 -0.75 -0.09 0.00 -0.02 0.00 0.00 41.12 40.26 1in1 n ASP 838 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1in1 h GLU 839 N 0.00 0.03 0.10 -1.24 4.39 -0.63 -2.65 114.58 114.59 1in1 h GLU 839 Ca 0.78 -0.05 -0.32 0.00 0.34 0.00 0.00 59.36 60.11 1in1 h GLU 839 Cb 2.08 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 30.73 1in1 h GLU 839 CO -0.71 0.98 -1.72 1.15 -1.16 0.00 0.00 179.01 177.55 1in1 h THR 840 N 0.01 0.79 0.00 1.13 2.02 0.68 -3.31 112.91 114.22 1in1 h THR 840 Ca -0.02 -2.33 0.00 0.00 0.77 0.00 0.00 66.41 64.82 1in1 h THR 840 Cb 1.71 2.51 0.00 0.00 -1.74 0.00 0.00 68.15 70.63 1in1 h THR 840 CO 0.13 0.74 0.00 -0.11 0.37 0.00 0.00 175.52 176.65 1in1 n LEU 841 N -3.77 0.00 0.00 2.58 -0.00 2.12 -3.31 117.00 114.62 1in1 n LEU 841 Ca -0.30 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 55.72 1in1 n LEU 841 Cb 0.95 0.00 0.08 0.00 -0.00 0.00 0.00 43.42 44.45 1in1 n LEU 841 CO 0.38 0.00 0.41 0.00 -0.00 0.00 0.00 177.39 178.18 1in1 s GLN 843 N -2.35 2.82 0.18 0.00 -1.52 -1.21 -4.97 119.66 112.61 1in1 s GLN 843 Ca 0.04 -3.32 0.00 0.00 -1.95 0.00 0.00 55.36 50.12 1in1 s GLN 843 Cb 0.02 -3.66 0.00 0.00 -0.22 0.00 0.00 33.01 29.15 1in1 s GLN 843 CO 0.04 -1.28 0.00 -2.37 -0.25 0.00 0.00 175.29 171.44 1in1 n THR 844 N 2.12 0.00 -1.14 -0.19 5.66 -1.23 0.11 114.28 119.60 1in1 n THR 844 Ca 0.20 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.20 1in1 n THR 844 Cb 0.36 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.14 1in1 n THR 844 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1in1 n LYS 845 N 0.00 0.00 -1.62 1.09 3.00 -1.26 -4.99 118.16 114.37 1in1 n LYS 845 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1in1 n LYS 845 Cb 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 35.03 34.60 1in1 n LYS 845 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1in1 n VAL 846 N 0.00 0.00 -3.12 3.15 0.24 0.29 -4.89 118.33 114.01 1in1 n VAL 846 Ca 0.00 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.21 1in1 n VAL 846 Cb 0.25 -0.77 -0.03 0.00 -1.47 0.00 0.00 33.84 31.82 1in1 n VAL 846 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1in1 s LEU 847 N 0.00 -0.69 0.61 1.34 2.01 -1.26 -4.95 118.68 115.74 1in1 s LEU 847 Ca 0.00 -1.67 0.07 0.00 0.01 0.00 0.00 54.13 52.54 1in1 s LEU 847 Cb 0.00 1.23 0.10 0.00 0.01 0.00 0.00 46.19 47.53 1in1 s LEU 847 CO 0.00 -0.15 0.84 -0.76 1.01 0.00 0.00 176.35 177.29 1in1 s LEU 848 N 1.12 3.07 0.00 1.79 1.43 -1.26 -4.83 118.68 120.00 1in1 s LEU 848 Ca 0.24 -0.73 -0.03 0.00 -1.03 0.00 0.00 54.13 52.57 1in1 s LEU 848 Cb -0.04 -1.71 -0.16 0.00 0.03 0.00 0.00 46.19 44.31 1in1 s LEU 848 CO -0.07 -1.48 2.71 0.47 0.23 0.00 0.00 176.35 178.22 1in1 n ASP 849 N -2.39 4.53 0.00 2.29 9.92 -1.26 -4.57 116.55 125.07 1in1 n ASP 849 Ca 0.16 -2.30 0.00 0.00 -0.53 0.00 0.00 54.79 52.12 1in1 n ASP 849 Cb 0.61 -1.14 0.00 0.00 -0.64 0.00 0.00 41.12 39.95 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 2.25 0.00 0.03 0.53 2.08 -1.26 -3.59 119.36 119.40 1in1 n ILE 850 Ca 0.25 0.22 0.00 0.00 0.56 0.00 0.00 62.75 63.78 1in1 n ILE 850 Cb 0.67 -0.68 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 1in1 n ILE 850 CO 0.00 0.00 0.00 0.49 0.56 0.00 0.00 176.55 177.60 1in1 n PHE 851 N 0.00 0.00 -1.28 1.39 3.72 -1.26 -1.82 117.46 118.21 1in1 n PHE 851 Ca 0.00 -0.00 -0.46 0.00 -0.05 0.00 0.00 57.45 56.94 1in1 n PHE 851 Cb 0.00 -0.02 -0.13 0.00 -0.94 0.00 0.00 39.48 38.39 1in1 n PHE 851 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 1in1 n THR 852 N 0.58 0.00 -0.98 4.37 5.66 -1.24 0.64 114.28 123.32 1in1 n THR 852 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1in1 n THR 852 Cb 0.01 -0.46 0.00 0.00 -1.55 0.00 0.00 70.33 68.33 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 6.42 0.44 3.49 1.09 0.00 -1.26 -4.90 105.19 110.46 1in1 n GLY 853 Ca 0.56 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.15 1in1 n GLY 853 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1in1 s VAL 854 N -2.01 4.58 -0.96 1.61 1.01 2.85 -4.90 120.40 122.59 1in1 s VAL 854 Ca 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 61.98 61.79 1in1 s VAL 854 Cb 0.00 -4.44 0.19 0.00 0.00 0.00 0.00 36.38 32.13 1in1 s VAL 854 CO 0.00 -0.99 1.05 0.00 0.00 0.00 0.00 175.10 175.15 1in1 s ARG 855 N 3.41 3.77 -0.13 2.72 1.70 -1.26 -3.80 118.95 125.35 1in1 s ARG 855 Ca 0.24 -2.35 -0.06 0.00 -0.47 0.00 0.00 55.73 53.09 1in1 s ARG 855 Cb -0.15 -4.72 -0.04 0.00 -0.57 0.00 0.00 34.95 29.47 1in1 s ARG 855 CO 0.16 -1.53 0.09 -0.48 -1.08 0.00 0.00 175.30 172.47 1in1 s LEU 856 N 1.06 4.09 -0.67 -1.89 0.05 -1.17 2.43 118.68 122.58 1in1 s LEU 856 Ca 0.29 0.30 -0.27 0.00 0.05 0.00 0.00 54.13 54.50 1in1 s LEU 856 Cb -0.07 -2.00 0.01 0.00 -2.05 0.00 0.00 46.19 42.08 1in1 s LEU 856 CO -0.08 0.33 1.48 -0.47 -0.55 0.00 0.00 176.35 177.07 1in1 s TYR 857 N -0.58 2.09 -0.41 3.48 5.04 1.24 -4.28 117.35 123.92 1in1 s TYR 857 Ca 0.12 0.30 -0.27 0.00 -2.44 0.00 0.00 57.07 54.77 1in1 s TYR 857 Cb -0.12 -4.42 0.02 0.00 0.35 0.00 0.00 41.96 37.79 1in1 s TYR 857 CO 0.02 -2.13 1.02 -1.17 -1.34 0.00 0.00 175.55 171.95 1in1 s LEU 858 N 6.81 3.88 0.42 6.97 2.96 -1.26 0.16 118.68 138.62 1in1 s LEU 858 Ca 0.48 0.54 -0.24 0.00 -0.22 0.00 0.00 54.13 54.69 1in1 s LEU 858 Cb -0.10 -3.38 -0.08 0.00 0.50 0.00 0.00 46.19 43.12 1in1 s LEU 858 CO 0.19 -1.02 1.11 -2.16 -1.32 0.00 0.00 176.35 173.15 1in1 s PRO 859 N 3.86 4.00 0.49 0.98 0.04 -1.26 -4.89 135.00 138.22 1in1 s PRO 859 Ca 0.42 1.66 0.28 0.00 0.04 0.00 0.00 61.00 63.41 1in1 s PRO 859 Cb -0.10 -2.52 1.02 0.00 0.04 0.00 0.00 34.50 32.94 1in1 s PRO 859 CO 0.24 -0.32 1.86 -1.00 0.04 0.00 0.00 177.00 177.81 1in1 h PRO 860 N 2.36 0.00 0.00 0.56 0.13 -1.99 -2.39 132.00 130.67 1in1 h PRO 860 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1in1 h PRO 860 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1in1 h PRO 860 CO 0.62 0.10 -0.14 0.43 -0.23 0.00 0.00 178.00 178.77 1in1 n SER 861 N -3.21 0.32 -4.77 1.44 7.64 -1.26 -4.86 113.62 108.93 1in1 n SER 861 Ca 0.01 0.35 -0.39 0.00 1.01 0.00 0.00 58.87 59.86 1in1 n SER 861 Cb 0.40 -0.37 -0.00 0.00 -1.01 0.00 0.00 64.21 63.22 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 -3.04 2.74 0.34 0.44 2.01 -0.90 -4.98 115.64 112.25 1in1 s THR 862 Ca 0.12 0.62 -0.27 0.00 0.31 0.00 0.00 61.69 62.47 1in1 s THR 862 Cb 0.17 -3.35 -0.09 0.00 0.01 0.00 0.00 72.50 69.24 1in1 s THR 862 CO 0.59 0.05 1.14 -2.16 -0.69 0.00 0.00 174.62 173.55 1in1 s PRO 863 N -2.43 4.35 -1.23 4.92 0.04 -1.26 -2.75 135.00 136.65 1in1 s PRO 863 Ca 0.60 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.46 1in1 s PRO 863 Cb -0.35 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1in1 s PRO 863 CO 0.44 -0.05 0.00 -0.25 0.04 0.00 0.00 177.00 177.18 1in1 n ASP 864 N 0.61 -4.70 -0.00 6.66 9.92 -1.26 -4.87 116.55 122.90 1in1 n ASP 864 Ca 0.02 0.29 -0.11 0.00 -0.53 0.00 0.00 54.79 54.46 1in1 n ASP 864 Cb 0.46 -3.22 -0.04 0.00 -0.64 0.00 0.00 41.12 37.68 1in1 n ASP 864 CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 1in1 h PHE 865 N 0.00 -0.91 -0.51 1.24 3.57 -1.85 0.17 116.94 118.65 1in1 h PHE 865 Ca -0.24 0.04 0.19 0.00 3.53 0.00 0.00 57.97 61.50 1in1 h PHE 865 Cb 0.86 0.42 -0.09 0.00 2.79 0.00 0.00 35.95 39.93 1in1 h PHE 865 CO 0.39 -0.40 0.20 0.45 -2.23 0.00 0.00 178.31 176.71 1in1 n SER 866 N -5.41 0.11 -0.07 0.41 2.88 -1.26 -0.42 113.62 109.85 1in1 n SER 866 Ca -0.03 0.85 -0.06 0.00 -1.33 0.00 0.00 58.87 58.30 1in1 n SER 866 Cb 0.33 -0.38 -0.02 0.00 -0.75 0.00 0.00 64.21 63.39 1in1 n SER 866 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1in1 n ARG 867 N -4.27 0.46 -0.12 -1.46 3.00 -0.29 -3.76 116.66 110.22 1in1 n ARG 867 Ca 0.17 0.50 0.06 0.00 -0.01 0.00 0.00 57.85 58.57 1in1 n ARG 867 Cb 0.58 -1.67 0.11 0.00 0.00 0.00 0.00 32.46 31.47 1in1 n ARG 867 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1in1 n LEU 868 N -4.60 -0.03 0.00 0.55 4.77 0.44 0.34 117.00 118.48 1in1 n LEU 868 Ca -0.09 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1in1 n LEU 868 Cb 0.30 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1in1 n LEU 868 CO 0.12 -0.61 0.03 0.54 -1.33 0.00 0.00 177.39 176.14 1in1 n ARG 869 N -4.28 0.00 -0.02 3.23 1.74 -0.19 0.99 116.66 118.14 1in1 n ARG 869 Ca 0.09 0.00 0.19 0.00 -0.77 0.00 0.00 57.85 57.36 1in1 n ARG 869 Cb 0.28 -0.36 0.35 0.00 -1.02 0.00 0.00 32.46 31.71 1in1 n ARG 869 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1in1 h ARG 870 N 0.00 0.00 0.00 5.56 2.43 -1.41 0.02 114.38 120.98 1in1 h ARG 870 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1in1 h ARG 870 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1in1 h ARG 870 CO 0.00 0.00 -0.03 -0.92 -1.51 0.00 0.00 179.97 177.51 1in1 h TYR 871 N 0.00 0.00 0.00 2.20 3.20 0.58 -3.22 116.97 119.73 1in1 h TYR 871 Ca 0.32 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.19 1in1 h TYR 871 Cb 2.47 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.74 1in1 h TYR 871 CO 0.00 0.00 0.00 0.34 -1.64 0.00 0.00 178.16 176.86 1in1 n PHE 872 N -2.62 0.00 -0.34 -3.82 -0.00 0.28 -0.33 117.46 110.63 1in1 n PHE 872 Ca -0.00 0.00 0.27 0.00 -0.00 0.00 0.00 57.45 57.72 1in1 n PHE 872 Cb 0.01 0.00 0.45 0.00 -0.00 0.00 0.00 39.48 39.94 1in1 n PHE 872 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.76 178.31 1in1 n VAL 873 N -0.31 -0.11 0.38 -2.13 3.14 -0.90 0.20 118.33 118.60 1in1 n VAL 873 Ca 0.00 1.06 -0.17 0.00 -2.96 0.00 0.00 64.34 62.27 1in1 n VAL 873 Cb 0.00 -1.75 -0.08 0.00 -1.06 0.00 0.00 33.84 30.95 1in1 n VAL 873 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1in1 h ALA 874 N 0.88 -0.97 -0.40 1.55 0.00 -1.27 -2.95 119.26 116.09 1in1 h ALA 874 Ca 0.56 -0.23 0.12 0.00 0.00 0.00 0.00 54.91 55.36 1in1 h ALA 874 Cb 1.94 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 20.03 1in1 h ALA 874 CO -0.20 -0.96 0.04 1.19 0.00 0.00 0.00 179.25 179.31 1in1 n PHE 875 N -5.45 0.29 0.00 0.00 3.01 0.54 -4.48 117.46 111.37 1in1 n PHE 875 Ca -0.13 0.48 0.00 0.00 1.01 0.00 0.00 57.45 58.81 1in1 n PHE 875 Cb 0.40 -0.82 0.00 0.00 -0.01 0.00 0.00 39.48 39.05 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 -4.32 0.00 -0.28 4.37 8.00 -1.12 -4.81 116.55 118.39 1in1 n ASP 876 Ca 0.10 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.60 1in1 n ASP 876 Cb 0.34 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 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 1.69 3.32 0.44 0.00 -1.17 -4.22 105.19 105.25 1in1 n GLY 877 Ca 0.00 -1.72 -0.11 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.26 -0.04 1.61 1.01 -1.25 -4.74 116.67 111.99 1in1 s ASP 878 Ca 0.00 -0.19 0.02 0.00 0.71 0.00 0.00 52.55 53.09 1in1 s ASP 878 Cb 0.00 0.46 0.02 0.00 1.01 0.00 0.00 42.92 44.40 1in1 s ASP 878 CO 0.00 -0.78 -0.07 -0.76 0.21 0.00 0.00 175.17 173.77 1in1 s LEU 879 N -2.49 1.49 -0.02 1.23 1.02 -1.26 -3.11 118.68 115.54 1in1 s LEU 879 Ca -0.00 -0.17 0.04 0.00 0.02 0.00 0.00 54.13 54.02 1in1 s LEU 879 Cb 0.01 -0.53 -0.03 0.00 0.02 0.00 0.00 46.19 45.66 1in1 s LEU 879 CO -0.08 -0.01 -0.12 -0.69 0.02 0.00 0.00 176.35 175.46 1in1 s VAL 880 N 0.72 3.24 0.18 -1.59 1.01 -1.26 -5.00 120.40 117.70 1in1 s VAL 880 Ca -0.11 -0.82 -0.30 0.00 0.00 0.00 0.00 61.98 60.75 1in1 s VAL 880 Cb -0.14 -2.34 -0.09 0.00 0.00 0.00 0.00 36.38 33.82 1in1 s VAL 880 CO 0.01 0.48 1.34 -1.10 0.00 0.00 0.00 175.10 175.83 1in1 s GLN 881 N -1.10 4.36 0.00 2.72 -0.21 -0.62 -4.33 119.66 120.48 1in1 s GLN 881 Ca 0.14 2.08 0.00 0.00 0.02 0.00 0.00 55.36 57.60 1in1 s GLN 881 Cb -0.11 -3.20 0.00 0.00 1.00 0.00 0.00 33.01 30.70 1in1 s GLN 881 CO 0.04 -0.31 0.33 -1.91 -2.12 0.00 0.00 175.29 171.31 1in1 n GLU 882 N 2.95 0.00 0.00 2.91 2.13 -1.26 0.83 120.64 128.20 1in1 n GLU 882 Ca 0.08 0.33 0.00 0.00 0.66 0.00 0.00 57.16 58.22 1in1 n GLU 882 Cb 0.42 -0.49 0.00 0.00 0.27 0.00 0.00 31.44 31.64 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 -2.26 0.00 -3.42 4.31 -1.74 -1.26 -3.83 117.46 109.26 1in1 n PHE 883 Ca 0.00 0.00 -0.23 0.00 -0.56 0.00 0.00 57.45 56.66 1in1 n PHE 883 Cb 0.00 -0.01 -0.10 0.00 1.52 0.00 0.00 39.48 40.89 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 -1.36 2.12 0.00 5.98 1.01 4.61 -4.92 116.67 124.11 1in1 s ASP 884 Ca 0.00 -1.87 0.00 0.00 0.71 0.00 0.00 52.55 51.39 1in1 s ASP 884 Cb 0.00 0.06 0.00 0.00 1.01 0.00 0.00 42.92 43.99 1in1 s ASP 884 CO 0.00 -0.29 0.00 1.15 0.21 0.00 0.00 175.17 176.24 1in1 n MET 885 N 4.18 0.00 0.00 8.23 0.00 -1.23 -1.58 117.12 126.71 1in1 n MET 885 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.81 1in1 n MET 885 Cb 0.41 -0.35 0.00 0.00 0.00 0.00 0.00 33.22 33.28 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 -1.00 0.00 0.61 3.17 -2.24 -1.26 1.38 114.28 114.94 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 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 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 -1.73 0.61 -3.67 3.42 7.64 -1.26 -4.91 113.62 113.73 1in1 n SER 887 Ca 0.00 -0.37 -0.10 0.00 1.01 0.00 0.00 58.87 59.41 1in1 n SER 887 Cb 0.00 0.99 0.07 0.00 -1.01 0.00 0.00 64.21 64.27 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 -1.80 1.89 0.00 -0.43 0.00 13.31 -4.98 120.51 128.49 1in1 n ALA 888 Ca 0.02 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.91 1in1 n ALA 888 Cb 0.43 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.44 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 -3.70 0.00 -4.35 0.00 5.66 -0.84 -4.68 114.28 106.36 1in1 n THR 889 Ca 0.03 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 60.85 1in1 n THR 889 Cb 0.19 -0.36 -0.10 0.00 -1.55 0.00 0.00 70.33 68.52 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 -1.60 1.68 -0.15 1.09 3.76 49.01 -2.16 115.29 166.91 1in1 s HIS 890 Ca 0.00 -0.72 -0.08 0.00 -0.15 0.00 0.00 55.06 54.11 1in1 s HIS 890 Cb 0.00 -0.89 0.06 0.00 1.11 0.00 0.00 32.58 32.85 1in1 s HIS 890 CO 0.00 0.20 0.36 0.14 -0.85 0.00 0.00 174.74 174.59 1in1 s VAL 891 N -3.14 -0.09 -0.23 -0.90 -7.23 0.67 0.38 120.40 109.87 1in1 s VAL 891 Ca 0.25 0.12 -0.28 0.00 -1.81 0.00 0.00 61.98 60.26 1in1 s VAL 891 Cb 0.03 -0.55 0.01 0.00 0.56 0.00 0.00 36.38 36.42 1in1 s VAL 891 CO 0.08 0.05 0.99 -0.22 -0.31 0.00 0.00 175.10 175.69 1in1 s LEU 892 N 1.49 4.10 0.11 1.32 0.20 0.43 -1.54 118.68 124.78 1in1 s LEU 892 Ca -0.09 1.31 0.00 0.00 0.69 0.00 0.00 54.13 56.04 1in1 s LEU 892 Cb -0.09 -3.47 0.00 0.00 -0.43 0.00 0.00 46.19 42.20 1in1 s LEU 892 CO -0.12 -0.64 0.00 0.61 -0.29 0.00 0.00 176.35 175.92 1in1 n GLY 893 N 3.41 -4.73 0.26 7.98 0.00 0.91 -4.58 105.19 108.44 1in1 n GLY 893 Ca 0.11 -0.05 0.03 0.00 0.00 0.00 0.00 46.02 46.11 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 1.90 -1.50 0.00 1.61 7.64 -1.26 -4.98 113.62 117.03 1in1 n SER 894 Ca 0.00 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.08 1in1 n SER 894 Cb 0.00 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 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 -2.71 0.00 0.00 1.43 1.85 -1.26 -4.42 116.66 111.55 1in1 n ARG 895 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.84 1in1 n ARG 895 Cb 0.12 -0.44 0.00 0.00 -1.05 0.00 0.00 32.46 31.09 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 -0.65 0.00 -0.32 2.89 2.03 -1.26 0.71 116.55 119.95 1in1 n ASP 896 Ca 0.00 0.00 0.26 0.00 0.52 0.00 0.00 54.79 55.57 1in1 n ASP 896 Cb 0.00 0.00 0.41 0.00 -0.72 0.00 0.00 41.12 40.81 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 -0.50 -0.01 -3.19 -0.67 -0.00 -1.26 -3.04 118.16 109.49 1in1 n LYS 897 Ca 0.00 0.68 0.01 0.00 -0.00 0.00 0.00 58.31 59.00 1in1 n LYS 897 Cb 0.00 -1.41 -0.01 0.00 -0.00 0.00 0.00 35.03 33.61 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 -4.24 -1.34 0.11 -5.58 2.47 3.42 -4.20 114.94 105.58 1in1 s ASN 898 Ca -0.04 -0.17 0.21 0.00 0.42 0.00 0.00 52.86 53.28 1in1 s ASN 898 Cb 0.17 1.89 0.85 0.00 -1.45 0.00 0.00 41.25 42.70 1in1 s ASN 898 CO 0.48 -0.27 1.65 -0.81 -3.72 0.00 0.00 177.10 174.43 1in1 n PRO 899 N 5.12 0.10 0.00 0.43 -0.04 -1.05 -1.96 135.00 137.59 1in1 n PRO 899 Ca 0.06 0.27 0.14 0.00 -0.04 0.00 0.00 63.50 63.94 1in1 n PRO 899 Cb 0.54 -1.66 0.54 0.00 -0.04 0.00 0.00 33.50 32.87 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 -1.63 2.78 -1.66 0.55 0.00 -1.26 -4.86 120.51 114.43 1in1 n ALA 900 Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1in1 n ALA 900 Cb 0.24 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.47 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 -0.41 0.00 -3.18 0.00 0.00 -0.83 -4.72 120.51 111.38 1in1 n ALA 901 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.36 1in1 n ALA 901 Cb 0.32 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.60 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 2.27 1.69 -1.34 0.00 -1.52 -0.92 -4.77 119.66 115.07 1in1 s GLN 902 Ca 0.00 -0.49 -0.07 0.00 -1.95 0.00 0.00 55.36 52.84 1in1 s GLN 902 Cb 0.00 -1.43 0.12 0.00 -0.22 0.00 0.00 33.01 31.48 1in1 s GLN 902 CO 0.00 0.13 2.27 1.04 -0.25 0.00 0.00 175.29 178.48 1in1 n GLN 903 N 3.47 4.16 -2.07 2.91 3.00 -1.20 0.24 117.38 127.89 1in1 n GLN 903 Ca -0.20 -3.35 -0.27 0.00 -0.01 0.00 0.00 57.00 53.16 1in1 n GLN 903 Cb 0.53 -2.76 0.08 0.00 0.00 0.00 0.00 30.24 28.08 1in1 n GLN 903 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 1in1 s VAL 904 N -0.26 2.17 0.00 5.09 -7.23 -0.59 -3.53 120.40 116.06 1in1 s VAL 904 Ca 0.50 -0.14 0.00 0.00 -1.81 0.00 0.00 61.98 60.53 1in1 s VAL 904 Cb 0.15 -3.01 0.00 0.00 0.56 0.00 0.00 36.38 34.09 1in1 s VAL 904 CO -0.06 -0.01 0.00 -1.54 -0.31 0.00 0.00 175.10 173.18 1in1 n SER 905 N -3.09 1.24 0.15 4.85 3.41 -1.26 -0.07 113.62 118.85 1in1 n SER 905 Ca 0.08 -0.74 0.00 0.00 -0.26 0.00 0.00 58.87 57.95 1in1 n SER 905 Cb 0.61 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.76 1in1 n SER 905 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1in1 h PRO 906 N 0.00 0.00 -0.04 4.33 0.13 -1.98 -2.90 132.00 131.54 1in1 h PRO 906 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.02 1in1 h PRO 906 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1in1 h PRO 906 CO 0.00 0.56 -0.47 0.93 -0.23 0.00 0.00 178.00 178.79 1in1 h GLU 907 N 0.00 0.09 0.51 0.86 3.07 -1.98 -3.04 114.58 114.09 1in1 h GLU 907 Ca -0.01 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.78 1in1 h GLU 907 Cb 1.05 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.97 1in1 h GLU 907 CO 0.07 0.54 -0.25 2.35 -1.40 0.00 0.00 179.01 180.32 1in1 h TRP 908 N 0.07 -0.64 -0.81 4.33 7.01 -1.85 -1.18 115.95 122.88 1in1 h TRP 908 Ca 0.00 -0.02 0.16 0.00 2.11 0.00 0.00 58.89 61.14 1in1 h TRP 908 Cb 0.86 0.21 -0.15 0.00 -2.10 0.00 0.00 29.16 27.97 1in1 h TRP 908 CO 0.01 -0.32 -0.24 0.82 -2.79 0.00 0.00 178.44 175.92 1in1 h ILE 909 N -1.02 0.16 0.00 2.65 2.04 -1.55 1.37 117.51 121.15 1in1 h ILE 909 Ca -0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1in1 h ILE 909 Cb 0.61 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1in1 h ILE 909 CO 0.12 0.00 0.00 0.79 0.00 0.00 0.00 178.15 179.06 1in1 n TRP 910 N -5.52 0.00 -0.46 1.37 5.03 -1.15 0.22 117.44 116.93 1in1 n TRP 910 Ca 0.11 0.00 0.41 0.00 3.03 0.00 0.00 57.50 61.05 1in1 n TRP 910 Cb 0.41 -0.46 0.77 0.00 -1.03 0.00 0.00 31.31 31.00 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 -2.00 3.36 -2.89 6.99 0.00 -0.69 0.55 119.26 124.58 1in1 h ALA 911 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1in1 h ALA 911 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1in1 h ALA 911 CO 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 179.25 177.46 1in1 h ILE 913 N 0.00 0.07 0.00 0.00 2.10 0.18 4.11 117.51 123.97 1in1 h ILE 913 Ca 0.00 -0.02 -0.09 0.00 1.08 0.00 0.00 64.86 65.82 1in1 h ILE 913 Cb 0.00 0.00 -0.01 0.00 -1.09 0.00 0.00 36.82 35.72 1in1 h ILE 913 CO 0.00 0.01 -0.44 -0.09 -1.08 0.00 0.00 178.15 176.55 1in1 h ARG 914 N 0.07 0.00 -0.02 2.19 1.12 -0.01 -2.38 114.38 115.36 1in1 h ARG 914 Ca 0.83 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.70 1in1 h ARG 914 Cb 2.40 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 32.36 1in1 h ARG 914 CO -0.59 0.44 -0.09 1.63 -3.11 0.00 0.00 179.97 178.25 1in1 n LYS 915 N -3.71 1.53 -0.59 0.20 4.76 1.32 -4.90 118.16 116.78 1in1 n LYS 915 Ca -0.01 -1.00 0.00 0.00 -2.87 0.00 0.00 58.31 54.43 1in1 n LYS 915 Cb 0.52 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 32.23 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 0.14 -0.99 -3.67 1.97 3.00 0.10 -4.83 116.66 112.38 1in1 n ARG 916 Ca 0.16 0.20 -0.12 0.00 -0.01 0.00 0.00 57.85 58.07 1in1 n ARG 916 Cb 0.40 -4.12 -0.12 0.00 0.00 0.00 0.00 32.46 28.62 1in1 n ARG 916 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 1in1 s ARG 917 N -1.18 0.20 -0.20 5.56 1.04 -1.22 -4.08 118.95 119.07 1in1 s ARG 917 Ca 0.00 0.78 -0.42 0.00 -1.04 0.00 0.00 55.73 55.06 1in1 s ARG 917 Cb 0.00 0.03 -0.20 0.00 -2.04 0.00 0.00 34.95 32.75 1in1 s ARG 917 CO 0.00 -0.26 1.25 1.28 -0.04 0.00 0.00 175.30 177.54 1in1 n LEU 918 N 5.16 0.47 0.00 -1.89 7.99 -0.76 -4.69 117.00 123.29 1in1 n LEU 918 Ca -0.10 1.15 0.00 0.00 -0.01 0.00 0.00 56.01 57.05 1in1 n LEU 918 Cb 0.50 -0.88 0.00 0.00 -0.11 0.00 0.00 43.42 42.93 1in1 n LEU 918 CO 0.04 -1.45 0.00 1.33 -1.51 0.00 0.00 177.39 175.80 1in1 n VAL 919 N 2.45 0.00 -1.91 4.08 0.24 -1.26 -5.01 118.33 116.92 1in1 n VAL 919 Ca 0.24 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 62.11 1in1 n VAL 919 Cb 0.02 -0.98 -0.03 0.00 -1.47 0.00 0.00 33.84 31.39 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 3.00 0.06 2.33 0.00 -1.26 -4.94 121.76 118.95 1in1 s ALA 920 Ca 0.00 0.53 -0.31 0.00 0.00 0.00 0.00 51.96 52.18 1in1 s ALA 920 Cb 0.00 -3.97 -0.06 0.00 0.00 0.00 0.00 23.12 19.09 1in1 s ALA 920 CO 0.00 -2.39 1.28 -1.25 0.00 0.00 0.00 175.76 173.40 1in1 s PRO 921 N 5.45 4.37 0.00 0.00 0.04 -1.26 -4.88 135.00 138.72 1in1 s PRO 921 Ca 0.83 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.75 1in1 s PRO 921 Cb -0.27 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 30.89 1in1 s PRO 921 CO 0.33 -0.37 0.00 0.00 0.04 0.00 0.00 177.00 177.00