#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oii s VAL 847 N 0.00 1.09 0.16 0.52 1.01 -1.26 -4.98 120.40 116.94 2oii s VAL 847 Ca 0.00 -1.25 0.30 0.00 0.00 0.00 0.00 61.98 61.03 2oii s VAL 847 Cb 0.00 -1.65 0.32 0.00 0.00 0.00 0.00 36.38 35.06 2oii s VAL 847 CO 0.00 -0.42 1.94 1.55 0.00 0.00 0.00 175.10 178.18 2oii h PRO 848 N 8.05 0.00 -5.89 2.72 0.13 -2.02 -3.47 132.00 131.51 2oii h PRO 848 Ca -0.14 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.79 2oii h PRO 848 Cb 1.05 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 2oii h PRO 848 CO 0.43 0.10 -0.42 0.94 -0.23 0.00 0.00 178.00 178.82 2oii n GLN 849 N -3.27 -0.60 -5.24 0.86 7.27 -1.26 -4.93 117.38 110.22 2oii n GLN 849 Ca 0.00 0.20 -0.32 0.00 0.07 0.00 0.00 57.00 56.95 2oii n GLN 849 Cb 0.34 -0.76 -0.16 0.00 2.41 0.00 0.00 30.24 32.07 2oii n GLN 849 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2oii s VAL 850 N -2.66 2.14 0.12 1.69 1.01 -1.26 -5.11 120.40 116.33 2oii s VAL 850 Ca 0.03 -1.04 0.05 0.00 0.00 0.00 0.00 61.98 61.02 2oii s VAL 850 Cb -0.01 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 2oii s VAL 850 CO 0.34 0.57 -0.13 0.00 0.00 0.00 0.00 175.10 175.88 2oii s ALA 851 N -0.21 1.42 -0.26 5.51 0.00 -1.26 -3.13 121.76 123.82 2oii s ALA 851 Ca -0.02 -1.28 -0.15 0.00 0.00 0.00 0.00 51.96 50.51 2oii s ALA 851 Cb -0.13 -0.05 0.08 0.00 0.00 0.00 0.00 23.12 23.01 2oii s ALA 851 CO 0.03 0.07 0.65 -0.59 0.00 0.00 0.00 175.76 175.92 2oii s PHE 852 N -2.24 -0.99 -0.29 0.00 -0.71 -1.01 -3.79 117.98 108.94 2oii s PHE 852 Ca 0.08 2.00 -0.19 0.00 -1.04 0.00 0.00 56.93 57.78 2oii s PHE 852 Cb -0.04 0.57 0.18 0.00 -1.21 0.00 0.00 43.02 42.52 2oii s PHE 852 CO 0.02 -0.50 1.22 0.45 -1.34 0.00 0.00 175.22 175.07 2oii s SER 853 N 1.56 -0.20 0.10 1.98 0.15 -0.84 -1.29 113.70 115.16 2oii s SER 853 Ca -0.10 0.34 0.03 0.00 0.70 0.00 0.00 55.95 56.92 2oii s SER 853 Cb -0.06 0.83 -0.04 0.00 -1.71 0.00 0.00 66.02 65.05 2oii s SER 853 CO -0.18 -0.05 -0.08 0.00 1.20 0.00 0.00 173.24 174.12 2oii s ALA 854 N 0.79 1.07 0.00 5.45 0.00 -1.09 -3.43 121.76 124.55 2oii s ALA 854 Ca -0.04 -1.30 0.08 0.00 0.00 0.00 0.00 51.96 50.71 2oii s ALA 854 Cb -0.03 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 2oii s ALA 854 CO -0.12 -0.15 -0.25 0.00 0.00 0.00 0.00 175.76 175.24 2oii s ALA 855 N -3.14 2.08 -0.14 0.00 0.00 -1.07 -3.38 121.76 116.11 2oii s ALA 855 Ca 0.10 -1.12 -0.04 0.00 0.00 0.00 0.00 51.96 50.90 2oii s ALA 855 Cb 0.02 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 2oii s ALA 855 CO -0.02 0.50 0.00 -1.17 0.00 0.00 0.00 175.76 175.07 2oii s LEU 856 N -0.80 3.53 0.00 0.00 1.98 -1.26 -2.83 118.68 119.30 2oii s LEU 856 Ca 0.10 0.03 0.00 0.00 -2.89 0.00 0.00 54.13 51.37 2oii s LEU 856 Cb -0.10 -1.84 0.00 0.00 0.66 0.00 0.00 46.19 44.91 2oii s LEU 856 CO 0.00 0.25 0.48 -1.54 -1.89 0.00 0.00 176.35 173.65 2oii n SER 857 N 2.99 0.00 -3.03 3.68 3.41 -1.26 -4.83 113.62 114.57 2oii n SER 857 Ca -0.18 -1.22 -0.27 0.00 -0.26 0.00 0.00 58.87 56.94 2oii n SER 857 Cb 0.53 -0.04 0.02 0.00 -0.26 0.00 0.00 64.21 64.46 2oii n SER 857 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oii n LEU 858 N 0.00 -4.07 0.00 1.04 -0.00 -1.26 -4.95 117.00 107.76 2oii n LEU 858 Ca 0.00 0.22 0.00 0.00 -0.00 0.00 0.00 56.01 56.23 2oii n LEU 858 Cb 0.54 -0.58 0.00 0.00 -0.00 0.00 0.00 43.42 43.38 2oii n LEU 858 CO 0.00 -4.29 0.01 -0.81 -0.00 0.00 0.00 177.39 172.31 2oii n PRO 859 N 1.68 0.00 0.00 1.47 -0.04 -1.26 -5.05 135.00 131.80 2oii n PRO 859 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2oii n PRO 859 Cb 0.40 -0.48 0.00 0.00 -0.04 0.00 0.00 33.50 33.39 2oii n PRO 859 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2oii n ARG 860 N -0.03 1.52 -1.28 0.54 1.85 -1.26 -5.06 116.66 112.94 2oii n ARG 860 Ca 0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 57.85 56.34 2oii n ARG 860 Cb 0.00 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.33 2oii n ARG 860 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2oii n SER 861 N 0.00 0.88 -4.90 2.89 7.64 -1.26 -4.94 113.62 113.92 2oii n SER 861 Ca 0.00 0.86 -0.22 0.00 1.01 0.00 0.00 58.87 60.52 2oii n SER 861 Cb 0.00 -0.67 -0.03 0.00 -1.01 0.00 0.00 64.21 62.50 2oii n SER 861 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2oii s GLU 862 N 2.55 3.20 0.25 1.43 2.02 -1.26 -4.99 118.70 121.90 2oii s GLU 862 Ca 0.81 -0.89 0.24 0.00 0.02 0.00 0.00 54.97 55.15 2oii s GLU 862 Cb -1.14 -2.74 0.96 0.00 0.10 0.00 0.00 34.13 31.31 2oii s GLU 862 CO 0.61 0.42 1.71 -0.35 0.02 0.00 0.00 175.26 177.67 2oii n PRO 863 N -1.27 0.19 0.00 0.39 -0.04 -1.26 -4.93 135.00 128.09 2oii n PRO 863 Ca -0.08 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 2oii n PRO 863 Cb 0.57 -1.86 0.00 0.00 -0.04 0.00 0.00 33.50 32.18 2oii n PRO 863 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2oii n GLY 864 N 0.12 0.98 3.77 0.55 0.00 -1.26 -5.15 105.19 104.20 2oii n GLY 864 Ca 0.02 0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 2oii n GLY 864 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oii s THR 865 N 1.46 3.33 -0.04 2.61 2.01 -1.26 -5.01 115.64 118.73 2oii s THR 865 Ca 0.00 0.49 -0.13 0.00 0.31 0.00 0.00 61.69 62.35 2oii s THR 865 Cb 0.00 -2.99 -0.05 0.00 0.01 0.00 0.00 72.50 69.47 2oii s THR 865 CO 0.00 -0.51 0.35 0.68 -0.69 0.00 0.00 174.62 174.45 2oii s VAL 866 N -2.74 5.15 0.00 3.82 -7.23 -1.26 -5.07 120.40 113.07 2oii s VAL 866 Ca 0.63 0.71 0.00 0.00 -1.81 0.00 0.00 61.98 61.50 2oii s VAL 866 Cb -0.18 -3.66 0.00 0.00 0.56 0.00 0.00 36.38 33.11 2oii s VAL 866 CO 0.52 0.55 0.00 -0.81 -0.31 0.00 0.00 175.10 175.05 2oii n PRO 867 N 2.13 3.28 -3.67 4.82 -0.04 -1.26 -4.66 135.00 135.60 2oii n PRO 867 Ca -0.14 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.19 2oii n PRO 867 Cb 0.53 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.86 2oii n PRO 867 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2oii s PHE 868 N 1.32 -0.49 -0.92 0.54 -0.71 -1.26 -4.79 117.98 111.67 2oii s PHE 868 Ca 0.00 1.06 0.09 0.00 -1.04 0.00 0.00 56.93 57.05 2oii s PHE 868 Cb 0.00 0.05 0.02 0.00 -1.21 0.00 0.00 43.02 41.87 2oii s PHE 868 CO 0.00 -0.36 0.65 -0.40 -1.34 0.00 0.00 175.22 173.77 2oii n ASP 869 N 5.18 1.31 -4.44 1.98 5.68 -1.25 -4.86 116.55 120.16 2oii n ASP 869 Ca -0.09 -1.15 -0.44 0.00 -0.50 0.00 0.00 54.79 52.60 2oii n ASP 869 Cb 0.50 0.35 -0.02 0.00 -1.14 0.00 0.00 41.12 40.81 2oii n ASP 869 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2oii s ARG 870 N -1.15 3.72 -0.75 0.11 1.81 -1.13 -4.97 118.95 116.59 2oii s ARG 870 Ca 0.08 -2.05 -0.26 0.00 -1.72 0.00 0.00 55.73 51.79 2oii s ARG 870 Cb 0.07 -4.89 0.00 0.00 -0.45 0.00 0.00 34.95 29.69 2oii s ARG 870 CO 0.20 -1.71 1.63 0.08 -0.68 0.00 0.00 175.30 174.83 2oii s VAL 871 N 2.07 3.56 -0.13 3.52 1.01 -1.26 -2.59 120.40 126.59 2oii s VAL 871 Ca 0.33 0.05 -0.18 0.00 0.00 0.00 0.00 61.98 62.19 2oii s VAL 871 Cb -0.05 -4.41 -0.26 0.00 0.00 0.00 0.00 36.38 31.66 2oii s VAL 871 CO -0.07 -1.36 0.50 -0.07 0.00 0.00 0.00 175.10 174.10 2oii h LEU 872 N 15.08 0.28 -6.00 3.92 3.38 -1.93 -3.47 115.31 126.56 2oii h LEU 872 Ca -0.15 -0.81 0.21 0.00 0.09 0.00 0.00 57.88 57.23 2oii h LEU 872 Cb 1.08 -0.09 -0.20 0.00 0.09 0.00 0.00 40.66 41.54 2oii h LEU 872 CO 1.27 1.55 0.01 -0.22 0.09 0.00 0.00 178.44 181.14 2oii s LEU 873 N -7.64 -0.50 0.00 1.67 2.96 -1.22 -5.03 118.68 108.92 2oii s LEU 873 Ca -0.22 0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.83 2oii s LEU 873 Cb 0.04 1.35 0.00 0.00 0.50 0.00 0.00 46.19 48.08 2oii s LEU 873 CO 0.73 -0.09 0.00 -3.20 -1.32 0.00 0.00 176.35 172.46 2oii n ASN 874 N 5.24 0.00 -0.07 3.68 2.85 -1.25 -1.98 115.26 123.74 2oii n ASN 874 Ca 0.04 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.39 2oii n ASN 874 Cb 0.56 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.53 2oii n ASN 874 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 2oii h ASP 875 N 0.00 0.36 1.01 1.20 2.03 -2.00 -3.15 116.42 115.87 2oii h ASP 875 Ca 0.00 -0.32 -0.09 0.00 -0.73 0.00 0.00 57.03 55.90 2oii h ASP 875 Cb 0.00 -0.10 -0.01 0.00 -0.83 0.00 0.00 39.33 38.39 2oii h ASP 875 CO 0.00 0.59 -0.42 1.23 -1.03 0.00 0.00 179.24 179.62 2oii h GLY 876 N 0.13 0.00 0.00 7.15 0.00 -1.97 -3.47 103.07 104.91 2oii h GLY 876 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2oii h GLY 876 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.16 2oii n GLY 877 N 0.51 1.69 5.00 4.60 0.00 -1.19 -4.85 105.19 110.93 2oii n GLY 877 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2oii n GLY 877 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2oii n TYR 878 N 0.00 0.00 -3.82 1.61 4.01 -1.26 -4.70 117.16 113.00 2oii n TYR 878 Ca 0.00 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.38 2oii n TYR 878 Cb 0.00 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 38.90 2oii n TYR 878 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 2oii s TYR 879 N 0.00 3.29 -0.03 -0.72 1.13 -1.26 -3.43 117.35 116.33 2oii s TYR 879 Ca 0.00 -1.70 -0.30 0.00 -1.41 0.00 0.00 57.07 53.66 2oii s TYR 879 Cb 0.00 -2.29 -0.06 0.00 -1.10 0.00 0.00 41.96 38.50 2oii s TYR 879 CO 0.00 -0.78 1.73 0.34 -2.51 0.00 0.00 175.55 174.33 2oii s ASP 880 N 1.39 6.61 0.00 -0.18 -1.08 -1.15 -4.86 116.67 117.40 2oii s ASP 880 Ca -0.02 2.34 0.23 0.00 -0.52 0.00 0.00 52.55 54.58 2oii s ASP 880 Cb -0.20 -2.53 1.39 0.00 -1.46 0.00 0.00 42.92 40.12 2oii s ASP 880 CO 0.01 -0.96 1.79 -0.81 0.52 0.00 0.00 175.17 175.71 2oii n PRO 881 N 7.24 0.81 0.04 4.34 -0.04 -1.26 0.89 135.00 147.02 2oii n PRO 881 Ca 0.18 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.62 2oii n PRO 881 Cb 0.42 -1.45 -0.01 0.00 -0.04 0.00 0.00 33.50 32.42 2oii n PRO 881 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2oii h GLU 882 N 0.00 -0.15 0.00 0.54 5.08 -1.89 -3.38 114.58 114.78 2oii h GLU 882 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2oii h GLU 882 Cb 0.00 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2oii h GLU 882 CO 0.00 -0.10 -1.32 0.25 -1.00 0.00 0.00 179.01 176.84 2oii n THR 883 N -3.34 0.08 -1.19 1.13 -2.24 -1.25 -4.97 114.28 102.50 2oii n THR 883 Ca -0.02 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 2oii n THR 883 Cb 0.06 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 2oii n THR 883 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oii n GLY 884 N 1.37 0.62 3.56 3.38 0.00 0.26 -4.38 105.19 110.00 2oii n GLY 884 Ca 0.01 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.94 2oii n GLY 884 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oii s VAL 885 N -2.00 3.60 -0.56 1.61 1.01 -1.06 -4.35 120.40 118.64 2oii s VAL 885 Ca 0.00 -0.56 -0.21 0.00 0.00 0.00 0.00 61.98 61.21 2oii s VAL 885 Cb 0.00 -4.35 0.06 0.00 0.00 0.00 0.00 36.38 32.09 2oii s VAL 885 CO 0.00 -1.23 0.80 0.12 0.00 0.00 0.00 175.10 174.78 2oii s PHE 886 N 8.69 2.89 -0.57 5.22 2.19 -1.24 -2.95 117.98 132.22 2oii s PHE 886 Ca 0.63 -0.44 -0.18 0.00 0.33 0.00 0.00 56.93 57.28 2oii s PHE 886 Cb -0.04 -3.91 0.11 0.00 -1.31 0.00 0.00 43.02 37.87 2oii s PHE 886 CO -0.02 -1.28 0.62 0.99 1.83 0.00 0.00 175.22 177.36 2oii s THR 887 N 3.31 4.98 -0.47 0.12 2.01 -1.22 -3.40 115.64 120.96 2oii s THR 887 Ca 0.21 -1.16 -0.16 0.00 0.31 0.00 0.00 61.69 60.89 2oii s THR 887 Cb -0.17 -4.41 0.07 0.00 0.01 0.00 0.00 72.50 67.99 2oii s THR 887 CO 0.13 -1.00 0.41 0.00 -0.69 0.00 0.00 174.62 173.47 2oii s ALA 888 N 2.26 3.54 -0.78 7.40 0.00 -1.23 -4.76 121.76 128.19 2oii s ALA 888 Ca 0.08 -2.07 0.25 0.00 0.00 0.00 0.00 51.96 50.23 2oii s ALA 888 Cb -0.26 -3.09 0.54 0.00 0.00 0.00 0.00 23.12 20.31 2oii s ALA 888 CO 0.05 -1.75 1.47 -0.35 0.00 0.00 0.00 175.76 175.18 2oii n PRO 889 N 5.29 0.18 -0.32 0.00 -0.04 -1.26 -1.87 135.00 136.98 2oii n PRO 889 Ca -0.12 0.07 0.06 0.00 -0.04 0.00 0.00 63.50 63.47 2oii n PRO 889 Cb 0.44 -1.63 0.13 0.00 -0.04 0.00 0.00 33.50 32.40 2oii n PRO 889 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2oii n LEU 890 N -1.91 -0.31 -2.81 1.53 4.77 -1.26 -4.86 117.00 112.15 2oii n LEU 890 Ca 0.05 1.55 -0.03 0.00 -0.03 0.00 0.00 56.01 57.55 2oii n LEU 890 Cb 0.40 -0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2oii n LEU 890 CO 0.34 -1.49 -0.45 0.00 -1.33 0.00 0.00 177.39 174.46 2oii n ALA 891 N -3.64 -2.76 0.00 -1.18 0.00 -1.26 -4.75 120.51 106.92 2oii n ALA 891 Ca 0.15 1.24 0.00 0.00 0.00 0.00 0.00 53.44 54.83 2oii n ALA 891 Cb 0.46 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 17.30 2oii n ALA 891 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oii n GLY 892 N 1.75 -0.29 3.50 0.00 0.00 -1.26 -2.98 105.19 105.92 2oii n GLY 892 Ca -0.20 -0.86 -0.34 0.00 0.00 0.00 0.00 46.02 44.61 2oii n GLY 892 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2oii s ARG 893 N -2.00 3.69 0.04 1.61 3.52 -0.89 -4.94 118.95 119.98 2oii s ARG 893 Ca 0.00 -0.50 0.05 0.00 -0.13 0.00 0.00 55.73 55.15 2oii s ARG 893 Cb 0.00 -2.99 -0.02 0.00 -1.56 0.00 0.00 34.95 30.38 2oii s ARG 893 CO 0.00 0.19 -0.14 -0.47 -0.81 0.00 0.00 175.30 174.07 2oii s TYR 894 N 0.52 1.19 -0.33 5.12 5.04 -1.26 -3.11 117.35 124.51 2oii s TYR 894 Ca -0.02 -0.37 -0.15 0.00 -2.44 0.00 0.00 57.07 54.10 2oii s TYR 894 Cb -0.14 -0.70 -0.02 0.00 0.35 0.00 0.00 41.96 41.45 2oii s TYR 894 CO 0.02 0.03 0.33 -1.17 -1.34 0.00 0.00 175.55 173.43 2oii s LEU 895 N -1.21 4.41 0.03 6.97 2.96 -1.18 -4.71 118.68 125.96 2oii s LEU 895 Ca 0.01 -0.23 0.03 0.00 -0.22 0.00 0.00 54.13 53.73 2oii s LEU 895 Cb -0.08 -2.30 -0.04 0.00 0.50 0.00 0.00 46.19 44.27 2oii s LEU 895 CO 0.01 -0.30 -0.04 -0.22 -1.32 0.00 0.00 176.35 174.49 2oii s LEU 896 N 1.96 3.32 -0.19 -0.68 0.20 -1.26 -2.69 118.68 119.34 2oii s LEU 896 Ca 0.11 -0.13 -0.04 0.00 0.69 0.00 0.00 54.13 54.75 2oii s LEU 896 Cb -0.17 -1.96 0.09 0.00 -0.43 0.00 0.00 46.19 43.73 2oii s LEU 896 CO 0.11 0.25 0.28 -0.44 -0.29 0.00 0.00 176.35 176.26 2oii s SER 897 N -1.73 0.70 0.03 3.68 0.01 -1.17 -4.90 113.70 110.32 2oii s SER 897 Ca 0.20 0.20 0.02 0.00 1.31 0.00 0.00 55.95 57.68 2oii s SER 897 Cb -0.11 0.70 -0.04 0.00 0.21 0.00 0.00 66.02 66.78 2oii s SER 897 CO 0.11 -0.29 0.04 0.00 0.41 0.00 0.00 173.24 173.51 2oii s ALA 898 N 2.42 3.42 -0.27 1.44 0.00 -1.26 -3.37 121.76 124.14 2oii s ALA 898 Ca 0.06 -0.97 -0.17 0.00 0.00 0.00 0.00 51.96 50.88 2oii s ALA 898 Cb -0.14 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.55 2oii s ALA 898 CO -0.12 0.69 0.45 0.08 0.00 0.00 0.00 175.76 176.87 2oii s VAL 899 N -1.22 5.11 -0.42 0.00 1.01 -1.19 -5.04 120.40 118.65 2oii s VAL 899 Ca 0.24 0.71 -0.19 0.00 0.00 0.00 0.00 61.98 62.74 2oii s VAL 899 Cb -0.12 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.50 2oii s VAL 899 CO 0.15 0.09 0.52 -0.76 0.00 0.00 0.00 175.10 175.11 2oii s LEU 900 N 2.21 4.67 0.33 3.92 1.43 -1.26 -4.71 118.68 125.27 2oii s LEU 900 Ca 0.18 -0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 52.52 2oii s LEU 900 Cb -0.16 -2.54 -0.11 0.00 0.03 0.00 0.00 46.19 43.42 2oii s LEU 900 CO 0.10 -0.64 1.42 -0.89 0.23 0.00 0.00 176.35 176.56 2oii s THR 901 N 2.42 2.41 0.02 5.49 2.01 -1.26 -4.94 115.64 121.79 2oii s THR 901 Ca 0.17 0.40 -0.15 0.00 0.31 0.00 0.00 61.69 62.41 2oii s THR 901 Cb -0.16 -3.25 -0.09 0.00 0.01 0.00 0.00 72.50 69.01 2oii s THR 901 CO 0.16 0.09 1.16 1.23 -0.69 0.00 0.00 174.62 176.56 2oii h GLY 902 N 3.61 -0.58 -6.40 4.40 0.00 -2.00 -3.47 103.07 98.64 2oii h GLY 902 Ca -0.49 0.21 -0.40 0.00 0.00 0.00 0.00 47.33 46.66 2oii h GLY 902 CO 0.68 -0.21 -0.84 1.42 0.00 0.00 0.00 176.54 177.59 2oii n HIS 903 N -3.58 -2.10 0.51 5.60 -0.00 -1.26 -4.81 115.22 109.57 2oii n HIS 903 Ca -0.07 0.70 0.06 0.00 -0.00 0.00 0.00 57.72 58.41 2oii n HIS 903 Cb 0.22 -3.17 0.28 0.00 -0.00 0.00 0.00 29.99 27.32 2oii n HIS 903 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.34 179.23 2oii n ARG 904 N -3.14 0.11 0.00 -0.41 1.85 -1.26 -3.66 116.66 110.15 2oii n ARG 904 Ca -0.18 0.22 0.00 0.00 -1.00 0.00 0.00 57.85 56.88 2oii n ARG 904 Cb 0.62 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.53 2oii n ARG 904 CO 0.00 0.00 0.00 1.58 -0.01 0.00 0.00 177.63 179.20 2oii n HIS 905 N -1.36 0.00 -1.40 2.89 -0.00 -1.26 -4.95 115.22 109.14 2oii n HIS 905 Ca 0.05 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.23 2oii n HIS 905 Cb 0.11 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.98 2oii n HIS 905 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 2oii n GLU 906 N -0.78 0.00 0.00 1.57 0.28 -1.24 -5.08 120.64 115.39 2oii n GLU 906 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2oii n GLU 906 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2oii n GLU 906 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 2oii n LYS 907 N 0.00 0.00 -4.04 3.44 4.81 -1.22 -4.65 118.16 116.50 2oii n LYS 907 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.13 2oii n LYS 907 Cb 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 34.89 2oii n LYS 907 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2oii s VAL 908 N -2.98 1.84 -0.18 3.15 1.01 -1.26 -3.01 120.40 118.98 2oii s VAL 908 Ca 0.00 -1.07 -0.09 0.00 0.00 0.00 0.00 61.98 60.82 2oii s VAL 908 Cb 0.00 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 2oii s VAL 908 CO 0.00 0.26 0.13 -0.70 0.00 0.00 0.00 175.10 174.79 2oii s GLU 909 N 1.32 3.95 -0.26 2.72 2.56 -0.59 -4.43 118.70 123.99 2oii s GLU 909 Ca -0.00 -0.20 -0.09 0.00 0.00 0.00 0.00 54.97 54.67 2oii s GLU 909 Cb -0.16 -3.34 0.11 0.00 2.00 0.00 0.00 34.13 32.75 2oii s GLU 909 CO -0.09 0.44 0.56 0.00 -0.56 0.00 0.00 175.26 175.61 2oii s ALA 910 N -0.05 -1.69 0.06 6.30 0.00 -1.24 -1.94 121.76 123.20 2oii s ALA 910 Ca 0.10 2.02 -0.30 0.00 0.00 0.00 0.00 51.96 53.78 2oii s ALA 910 Cb -0.11 -1.58 -0.05 0.00 0.00 0.00 0.00 23.12 21.37 2oii s ALA 910 CO -0.00 -0.84 1.10 0.54 0.00 0.00 0.00 175.76 176.57 2oii s VAL 911 N 2.73 4.30 0.74 0.00 0.11 -1.23 -2.64 120.40 124.41 2oii s VAL 911 Ca -0.05 1.70 -0.14 0.00 -2.93 0.00 0.00 61.98 60.57 2oii s VAL 911 Cb -0.12 -4.09 0.04 0.00 -1.53 0.00 0.00 36.38 30.69 2oii s VAL 911 CO -0.17 0.16 1.15 -0.76 -3.33 0.00 0.00 175.10 172.15 2oii s LEU 912 N 0.80 3.23 -0.06 2.54 1.43 0.25 -4.41 118.68 122.47 2oii s LEU 912 Ca 0.55 2.14 0.03 0.00 -1.03 0.00 0.00 54.13 55.81 2oii s LEU 912 Cb -0.26 -4.56 0.01 0.00 0.03 0.00 0.00 46.19 41.40 2oii s LEU 912 CO 0.30 -2.15 -0.14 -0.55 0.23 0.00 0.00 176.35 174.04 2oii s SER 913 N -2.50 1.87 0.77 2.29 0.15 -0.94 -3.48 113.70 111.87 2oii s SER 913 Ca 0.69 -0.31 -0.13 0.00 0.70 0.00 0.00 55.95 56.89 2oii s SER 913 Cb -0.24 -0.75 0.06 0.00 -1.71 0.00 0.00 66.02 63.38 2oii s SER 913 CO 0.47 0.07 1.17 0.00 1.20 0.00 0.00 173.24 176.16 2oii s ARG 914 N 0.45 1.92 0.00 5.44 3.03 -1.26 -0.96 118.95 127.58 2oii s ARG 914 Ca -0.11 1.62 0.00 0.00 2.03 0.00 0.00 55.73 59.27 2oii s ARG 914 Cb -0.14 -1.82 0.00 0.00 -1.03 0.00 0.00 34.95 31.96 2oii s ARG 914 CO 0.03 -1.97 0.00 -1.13 -1.13 0.00 0.00 175.30 171.10 2oii n SER 915 N -3.15 0.00 0.00 -2.89 3.41 -1.26 -4.54 113.62 105.19 2oii n SER 915 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 2oii n SER 915 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2oii n SER 915 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2oii n ASN 916 N 1.00 3.99 -0.98 4.04 3.02 -1.20 -5.14 115.26 119.98 2oii n ASN 916 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.67 2oii n ASN 916 Cb 0.00 0.72 -0.06 0.00 -0.61 0.00 0.00 39.78 39.84 2oii n ASN 916 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oii n GLN 917 N -1.29 -2.20 0.00 3.52 6.02 -0.13 -4.73 117.38 118.57 2oii n GLN 917 Ca 0.00 1.73 0.00 0.00 -0.01 0.00 0.00 57.00 58.72 2oii n GLN 917 Cb 0.07 -2.59 0.00 0.00 1.02 0.00 0.00 30.24 28.74 2oii n GLN 917 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2oii n GLY 918 N -3.66 3.66 2.88 1.08 0.00 -1.26 -4.51 105.19 103.39 2oii n GLY 918 Ca -0.05 0.07 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 2oii n GLY 918 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2oii n VAL 919 N 0.00 -7.74 -3.07 1.61 0.31 -1.26 -2.20 118.33 105.98 2oii n VAL 919 Ca 0.00 1.40 -0.45 0.00 -0.01 0.00 0.00 64.34 65.28 2oii n VAL 919 Cb 0.00 -5.06 -0.03 0.00 -0.91 0.00 0.00 33.84 27.84 2oii n VAL 919 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oii s ALA 920 N -0.97 3.53 -0.03 3.52 0.00 -1.23 -3.98 121.76 122.60 2oii s ALA 920 Ca -0.07 -2.67 -0.17 0.00 0.00 0.00 0.00 51.96 49.05 2oii s ALA 920 Cb 0.00 -3.76 -0.32 0.00 0.00 0.00 0.00 23.12 19.05 2oii s ALA 920 CO 0.45 -2.62 0.82 0.07 0.00 0.00 0.00 175.76 174.49 2oii h ARG 921 N 8.74 0.38 -3.45 0.00 0.11 -1.78 -3.34 114.38 115.05 2oii h ARG 921 Ca -0.02 -0.65 -0.80 0.00 0.10 0.00 0.00 59.98 58.61 2oii h ARG 921 Cb 1.05 0.24 -0.28 0.00 1.11 0.00 0.00 29.97 32.10 2oii h ARG 921 CO 1.03 1.31 0.56 0.28 0.10 0.00 0.00 179.97 183.25 2oii n VAL 922 N -3.88 4.74 -3.31 0.08 0.31 -1.26 -4.45 118.33 110.55 2oii n VAL 922 Ca -0.19 -5.49 -0.38 0.00 -0.01 0.00 0.00 64.34 58.27 2oii n VAL 922 Cb 0.97 -2.48 -0.06 0.00 -0.91 0.00 0.00 33.84 31.36 2oii n VAL 922 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2oii s ASP 923 N 0.67 6.87 -0.26 4.52 2.15 -1.26 -3.54 116.67 125.83 2oii s ASP 923 Ca 0.31 1.04 -0.02 0.00 0.43 0.00 0.00 52.55 54.32 2oii s ASP 923 Cb -0.07 -2.32 0.13 0.00 -0.30 0.00 0.00 42.92 40.36 2oii s ASP 923 CO -0.04 0.15 0.29 -0.55 -0.17 0.00 0.00 175.17 174.86 2oii s SER 924 N -0.31 1.36 -0.69 -0.34 0.15 -0.82 -5.04 113.70 108.02 2oii s SER 924 Ca 0.28 -0.47 -0.05 0.00 0.70 0.00 0.00 55.95 56.40 2oii s SER 924 Cb -0.17 0.58 0.18 0.00 -1.71 0.00 0.00 66.02 64.90 2oii s SER 924 CO 0.15 -0.36 0.53 -0.83 1.20 0.00 0.00 173.24 173.92 2oii s GLY 925 N 2.38 2.58 -0.06 9.45 0.00 -1.26 -1.54 107.32 118.88 2oii s GLY 925 Ca 0.09 -3.33 0.03 0.00 0.00 0.00 0.00 44.72 41.52 2oii s GLY 925 CO -0.25 1.14 0.80 0.61 0.00 0.00 0.00 173.10 175.40 2oii n GLY 926 N 3.49 1.84 0.00 0.20 0.00 -1.16 -5.04 105.19 104.51 2oii n GLY 926 Ca 0.10 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2oii n GLY 926 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2oii n THR 946 N 0.15 0.00 -4.78 2.61 -1.04 -1.26 -3.42 114.28 106.54 2oii n THR 946 Ca 0.07 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.75 2oii n THR 946 Cb 0.48 0.00 -0.15 0.00 -1.82 0.00 0.00 70.33 68.84 2oii n THR 946 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2oii s LEU 947 N 0.00 2.63 0.26 -4.42 1.43 -1.26 -4.98 118.68 112.34 2oii s LEU 947 Ca 0.00 -0.37 -0.13 0.00 -1.03 0.00 0.00 54.13 52.60 2oii s LEU 947 Cb 0.00 -1.59 -0.00 0.00 0.03 0.00 0.00 46.19 44.63 2oii s LEU 947 CO 0.00 0.15 0.50 -0.83 0.23 0.00 0.00 176.35 176.40 2oii s GLY 948 N 0.43 0.56 -0.05 -3.19 0.00 -1.26 -5.02 107.32 98.78 2oii s GLY 948 Ca -0.11 -0.89 0.05 0.00 0.00 0.00 0.00 44.72 43.78 2oii s GLY 948 CO 0.05 -0.62 -0.20 -1.34 0.00 0.00 0.00 173.10 171.00 2oii s VAL 949 N -3.92 2.53 0.04 1.40 -7.23 -1.26 -3.48 120.40 108.48 2oii s VAL 949 Ca 0.22 -0.91 0.03 0.00 -1.81 0.00 0.00 61.98 59.52 2oii s VAL 949 Cb -0.01 -1.96 -0.02 0.00 0.56 0.00 0.00 36.38 34.95 2oii s VAL 949 CO 0.10 0.57 -0.10 0.72 -0.31 0.00 0.00 175.10 176.08 2oii s PHE 950 N -0.41 0.87 0.04 2.82 -0.12 -1.25 -4.97 117.98 114.96 2oii s PHE 950 Ca 0.04 -0.43 -0.01 0.00 -0.05 0.00 0.00 56.93 56.48 2oii s PHE 950 Cb -0.12 -0.51 -0.01 0.00 -0.63 0.00 0.00 43.02 41.75 2oii s PHE 950 CO 0.02 -0.02 -0.03 0.43 -0.05 0.00 0.00 175.22 175.57 2oii n SER 951 N 1.63 0.76 0.00 1.98 7.64 -1.26 -4.47 113.62 119.90 2oii n SER 951 Ca -0.21 0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2oii n SER 951 Cb 0.55 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 2oii n SER 951 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2oii n LEU 952 N -3.38 0.42 0.00 -3.43 7.94 -1.26 -4.71 117.00 112.58 2oii n LEU 952 Ca -0.02 0.56 0.00 0.00 -1.11 0.00 0.00 56.01 55.44 2oii n LEU 952 Cb 0.24 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 44.02 2oii n LEU 952 CO 0.01 -0.17 0.00 2.30 -1.11 0.00 0.00 177.39 178.42 2oii n ILE 953 N -1.00 0.00 0.00 1.96 -6.64 -1.26 -4.50 119.36 107.92 2oii n ILE 953 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 2oii n ILE 953 Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 2oii n ILE 953 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2oii n LEU 954 N 0.00 0.00 -4.55 7.28 -0.00 -1.26 -4.78 117.00 113.69 2oii n LEU 954 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 56.01 55.60 2oii n LEU 954 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.39 2oii n LEU 954 CO 0.00 0.00 1.32 -2.16 -0.00 0.00 0.00 177.39 176.55 2oii s PRO 955 N 0.00 3.33 -0.02 1.47 0.04 -1.26 -4.86 135.00 133.70 2oii s PRO 955 Ca 0.00 -0.59 0.06 0.00 0.04 0.00 0.00 61.00 60.50 2oii s PRO 955 Cb 0.00 -4.71 -0.01 0.00 0.04 0.00 0.00 34.50 29.81 2oii s PRO 955 CO 0.00 -2.22 -0.18 -0.51 0.04 0.00 0.00 177.00 174.12 2oii s LEU 956 N 5.61 2.02 0.46 -3.56 1.02 -1.26 -5.04 118.68 117.93 2oii s LEU 956 Ca 0.41 -0.34 -0.16 0.00 0.02 0.00 0.00 54.13 54.07 2oii s LEU 956 Cb -0.05 -0.96 -0.08 0.00 0.02 0.00 0.00 46.19 45.12 2oii s LEU 956 CO 0.04 0.22 0.91 -1.10 0.02 0.00 0.00 176.35 176.44 2oii s GLN 957 N -0.39 3.96 -0.08 1.70 -0.21 -1.26 -4.93 119.66 118.45 2oii s GLN 957 Ca 0.06 0.84 -0.30 0.00 0.02 0.00 0.00 55.36 55.99 2oii s GLN 957 Cb -0.08 -2.23 -0.05 0.00 1.00 0.00 0.00 33.01 31.65 2oii s GLN 957 CO -0.00 -0.14 1.66 0.00 -2.12 0.00 0.00 175.29 174.69 2oii s ALA 958 N -2.43 3.54 0.00 6.09 0.00 -1.26 -2.34 121.76 125.36 2oii s ALA 958 Ca 0.57 0.86 0.00 0.00 0.00 0.00 0.00 51.96 53.39 2oii s ALA 958 Cb -0.10 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2oii s ALA 958 CO 0.27 -1.52 0.00 0.41 0.00 0.00 0.00 175.76 174.92 2oii n GLY 959 N 4.26 2.82 3.29 0.00 0.00 -0.78 -4.99 105.19 109.79 2oii n GLY 959 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2oii n GLY 959 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2oii n ASP 960 N 0.00 -2.32 -3.92 1.61 -0.08 -0.99 -4.51 116.55 106.34 2oii n ASP 960 Ca 0.00 -0.14 -0.17 0.00 -1.51 0.00 0.00 54.79 52.97 2oii n ASP 960 Cb 0.00 -0.98 -0.15 0.00 2.34 0.00 0.00 41.12 42.33 2oii n ASP 960 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2oii s THR 961 N -2.25 0.41 -0.02 5.18 2.01 -1.26 -3.52 115.64 116.20 2oii s THR 961 Ca 0.57 -0.16 -0.03 0.00 0.31 0.00 0.00 61.69 62.39 2oii s THR 961 Cb -0.13 -0.40 -0.04 0.00 0.01 0.00 0.00 72.50 71.94 2oii s THR 961 CO 0.66 0.15 0.17 0.68 -0.69 0.00 0.00 174.62 175.59 2oii s VAL 962 N 0.30 5.41 0.02 3.82 -7.23 -1.22 -4.08 120.40 117.43 2oii s VAL 962 Ca -0.03 -0.13 0.01 0.00 -1.81 0.00 0.00 61.98 60.02 2oii s VAL 962 Cb -0.07 -3.51 -0.02 0.00 0.56 0.00 0.00 36.38 33.34 2oii s VAL 962 CO -0.00 0.36 -0.05 0.00 -0.31 0.00 0.00 175.10 175.10 2oii s VAL 964 N -1.16 5.44 -0.18 0.00 1.01 -1.26 0.88 120.40 125.12 2oii s VAL 964 Ca -0.10 0.26 -0.15 0.00 0.00 0.00 0.00 61.98 61.98 2oii s VAL 964 Cb -0.08 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 2oii s VAL 964 CO -0.00 0.55 0.37 -0.62 0.00 0.00 0.00 175.10 175.40 2oii s ASP 965 N -0.50 6.45 -0.48 3.32 2.15 -1.08 -4.73 116.67 121.80 2oii s ASP 965 Ca 0.13 0.53 0.08 0.00 0.43 0.00 0.00 52.55 53.73 2oii s ASP 965 Cb -0.12 -2.22 0.32 0.00 -0.30 0.00 0.00 42.92 40.60 2oii s ASP 965 CO 0.03 -0.02 0.79 -0.11 -0.17 0.00 0.00 175.17 175.68 2oii n LEU 966 N 4.16 2.40 -3.20 -1.34 7.94 -1.26 -3.67 117.00 122.04 2oii n LEU 966 Ca -0.09 -5.27 0.00 0.00 -1.11 0.00 0.00 56.01 49.54 2oii n LEU 966 Cb 0.51 0.09 -0.02 0.00 0.53 0.00 0.00 43.42 44.54 2oii n LEU 966 CO 0.40 2.26 0.06 -0.69 -1.11 0.00 0.00 177.39 178.31 2oii s VAL 967 N -3.03 -0.91 -0.38 1.96 1.01 -1.26 -5.05 120.40 112.74 2oii s VAL 967 Ca 0.43 -0.09 0.12 0.00 0.00 0.00 0.00 61.98 62.43 2oii s VAL 967 Cb 0.28 -0.75 0.36 0.00 0.00 0.00 0.00 36.38 36.27 2oii s VAL 967 CO -0.10 -0.07 0.82 0.23 0.00 0.00 0.00 175.10 175.98 2oii n MET 968 N 5.13 1.00 0.00 2.72 2.81 -1.26 -5.04 117.12 122.48 2oii n MET 968 Ca 0.06 -3.15 0.00 0.00 -1.81 0.00 0.00 57.70 52.80 2oii n MET 968 Cb 0.54 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.51 2oii n MET 968 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2oii n GLY 969 N 0.23 3.47 0.06 3.03 0.00 -1.26 -4.15 105.19 106.57 2oii n GLY 969 Ca 0.20 -0.60 -0.04 0.00 0.00 0.00 0.00 46.02 45.58 2oii n GLY 969 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2oii h GLN 970 N 0.00 0.00 -5.33 1.61 1.08 -2.02 -3.42 115.11 107.03 2oii h GLN 970 Ca 0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 2oii h GLN 970 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 2oii h GLN 970 CO 0.00 0.19 0.21 -0.11 -0.95 0.00 0.00 178.83 178.17 2oii n LEU 971 N -4.71 1.62 0.00 1.46 7.94 -1.26 -4.78 117.00 117.27 2oii n LEU 971 Ca -0.04 -1.39 0.00 0.00 -1.11 0.00 0.00 56.01 53.47 2oii n LEU 971 Cb 0.15 -1.59 0.00 0.00 0.53 0.00 0.00 43.42 42.51 2oii n LEU 971 CO 0.08 -2.52 0.00 0.00 -1.11 0.00 0.00 177.39 173.84 2oii n ALA 972 N 17.79 0.00 -2.60 1.96 0.00 -1.26 -5.14 120.51 131.26 2oii n ALA 972 Ca 0.48 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.64 2oii n ALA 972 Cb 0.41 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.77 2oii n ALA 972 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2oii s HIS 973 N -0.05 2.45 -0.19 0.00 2.46 -1.26 -5.13 115.29 113.56 2oii s HIS 973 Ca 0.00 -0.69 -0.09 0.00 0.47 0.00 0.00 55.06 54.75 2oii s HIS 973 Cb 0.00 -1.80 -0.05 0.00 -0.13 0.00 0.00 32.58 30.61 2oii s HIS 973 CO 0.00 0.36 0.10 0.45 -2.47 0.00 0.00 174.74 173.19 2oii s SER 974 N -3.77 5.99 0.04 9.88 0.15 -1.26 -5.08 113.70 119.65 2oii s SER 974 Ca 0.33 0.17 -0.23 0.00 0.70 0.00 0.00 55.95 56.92 2oii s SER 974 Cb 0.08 -2.04 0.05 0.00 -1.71 0.00 0.00 66.02 62.40 2oii s SER 974 CO 0.17 0.18 0.52 -0.70 1.20 0.00 0.00 173.24 174.61 2oii s GLU 975 N 0.37 1.02 -0.38 5.44 -6.30 -1.26 -5.12 118.70 112.47 2oii s GLU 975 Ca 0.06 -0.20 0.01 0.00 -2.50 0.00 0.00 54.97 52.34 2oii s GLU 975 Cb -0.12 0.47 0.15 0.00 0.00 0.00 0.00 34.13 34.63 2oii s GLU 975 CO -0.01 -0.36 0.26 -1.83 0.02 0.00 0.00 175.26 173.33 2oii s GLU 976 N -2.33 0.76 0.01 4.30 -1.05 -1.26 -5.13 118.70 114.00 2oii s GLU 976 Ca -0.06 -1.66 -0.00 0.00 -0.15 0.00 0.00 54.97 53.10 2oii s GLU 976 Cb -0.01 -1.48 0.00 0.00 -0.44 0.00 0.00 34.13 32.20 2oii s GLU 976 CO -0.01 -1.26 0.01 -0.35 0.95 0.00 0.00 175.26 174.60 2oii n PRO 977 N 3.61 -0.58 -4.32 -4.83 -0.04 -1.26 -5.06 135.00 122.53 2oii n PRO 977 Ca 0.17 -0.01 -0.21 0.00 -0.04 0.00 0.00 63.50 63.41 2oii n PRO 977 Cb 0.40 -0.01 -0.11 0.00 -0.04 0.00 0.00 33.50 33.74 2oii n PRO 977 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2oii s LEU 978 N 0.00 2.44 -0.12 1.53 1.02 -1.26 -4.95 118.68 117.34 2oii s LEU 978 Ca 0.00 -0.86 -0.13 0.00 0.02 0.00 0.00 54.13 53.16 2oii s LEU 978 Cb -0.00 -0.77 0.03 0.00 0.02 0.00 0.00 46.19 45.47 2oii s LEU 978 CO 0.00 -0.06 0.37 0.42 0.02 0.00 0.00 176.35 177.10 2oii s THR 979 N -2.12 0.01 -0.18 5.49 -4.23 -1.26 -4.84 115.64 108.51 2oii s THR 979 Ca 0.15 -0.07 -0.06 0.00 -1.18 0.00 0.00 61.69 60.53 2oii s THR 979 Cb -0.05 -0.54 -0.03 0.00 1.34 0.00 0.00 72.50 73.21 2oii s THR 979 CO 0.06 -0.04 0.02 -0.63 -0.54 0.00 0.00 174.62 173.49 2oii s ILE 980 N -0.05 4.35 -0.40 2.99 -1.09 -1.26 -4.27 121.20 121.47 2oii s ILE 980 Ca -0.02 -0.19 0.02 0.00 -2.23 0.00 0.00 60.65 58.23 2oii s ILE 980 Cb -0.03 -2.94 0.11 0.00 -1.58 0.00 0.00 42.46 38.02 2oii s ILE 980 CO 0.01 0.47 0.13 0.12 -1.23 0.00 0.00 174.94 174.44 2oii s PHE 981 N 0.46 3.62 0.22 3.97 2.19 -1.22 -3.14 117.98 124.08 2oii s PHE 981 Ca 0.00 -2.92 0.07 0.00 0.33 0.00 0.00 56.93 54.42 2oii s PHE 981 Cb -0.13 -2.98 -0.04 0.00 -1.31 0.00 0.00 43.02 38.56 2oii s PHE 981 CO 0.02 -0.91 0.11 -1.54 1.83 0.00 0.00 175.22 174.72 2oii s SER 982 N 0.85 5.19 -0.30 6.13 1.04 -1.22 -2.67 113.70 122.73 2oii s SER 982 Ca 0.12 -0.33 -0.12 0.00 0.48 0.00 0.00 55.95 56.10 2oii s SER 982 Cb -0.21 -1.23 0.18 0.00 0.10 0.00 0.00 66.02 64.86 2oii s SER 982 CO -0.06 0.02 0.99 -0.83 0.98 0.00 0.00 173.24 174.34 2oii s GLY 983 N -3.49 -0.37 0.09 7.32 0.00 -0.41 -3.06 107.32 107.38 2oii s GLY 983 Ca 0.31 2.74 0.05 0.00 0.00 0.00 0.00 44.72 47.83 2oii s GLY 983 CO 0.22 3.64 -0.04 0.00 0.00 0.00 0.00 173.10 176.93 2oii s ALA 984 N 2.82 3.17 0.18 3.20 0.00 -1.10 -2.59 121.76 127.44 2oii s ALA 984 Ca 0.01 -1.15 -0.30 0.00 0.00 0.00 0.00 51.96 50.53 2oii s ALA 984 Cb -0.10 -1.09 -0.08 0.00 0.00 0.00 0.00 23.12 21.85 2oii s ALA 984 CO -0.14 0.68 1.13 -1.17 0.00 0.00 0.00 175.76 176.26 2oii s LEU 985 N -2.21 4.47 -0.07 0.00 2.96 -1.18 -3.10 118.68 119.55 2oii s LEU 985 Ca 0.24 2.14 -0.09 0.00 -0.22 0.00 0.00 54.13 56.20 2oii s LEU 985 Cb -0.11 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 2oii s LEU 985 CO 0.16 -0.27 -0.17 -0.11 -1.32 0.00 0.00 176.35 174.63 2oii n LEU 986 N 2.40 1.19 -3.85 -0.68 7.94 -1.24 -4.94 117.00 117.83 2oii n LEU 986 Ca 0.03 0.19 -0.12 0.00 -1.11 0.00 0.00 56.01 55.01 2oii n LEU 986 Cb 0.46 -0.54 -0.11 0.00 0.53 0.00 0.00 43.42 43.76 2oii n LEU 986 CO 0.54 -0.44 -0.17 -0.47 -1.11 0.00 0.00 177.39 175.74 2oii s TYR 987 N -2.15 -0.03 0.31 1.96 5.04 -1.18 -5.07 117.35 116.23 2oii s TYR 987 Ca -0.14 0.04 0.09 0.00 -2.44 0.00 0.00 57.07 54.61 2oii s TYR 987 Cb 0.02 -0.02 -0.04 0.00 0.35 0.00 0.00 41.96 42.27 2oii s TYR 987 CO 0.21 -0.23 0.08 0.20 -1.34 0.00 0.00 175.55 174.48 2oii s GLY 988 N -0.96 1.82 -0.36 8.97 0.00 -1.26 -2.10 107.32 113.43 2oii s GLY 988 Ca -0.10 -1.75 -0.29 0.00 0.00 0.00 0.00 44.72 42.57 2oii s GLY 988 CO 0.01 -1.74 1.35 0.99 0.00 0.00 0.00 173.10 173.71 2oii s ASP 989 N -3.77 6.51 -1.24 1.64 1.01 -1.16 -4.89 116.67 114.76 2oii s ASP 989 Ca 0.35 0.98 -0.09 0.00 0.71 0.00 0.00 52.55 54.50 2oii s ASP 989 Cb -0.04 -2.54 0.19 0.00 1.01 0.00 0.00 42.92 41.54 2oii s ASP 989 CO 0.22 -1.26 1.75 -0.81 0.21 0.00 0.00 175.17 175.27 2oii n PRO 990 N 7.71 3.73 0.00 8.23 -0.04 -1.26 -4.84 135.00 148.54 2oii n PRO 990 Ca 0.15 -3.74 0.00 0.00 -0.04 0.00 0.00 63.50 59.87 2oii n PRO 990 Cb 0.47 -2.86 0.00 0.00 -0.04 0.00 0.00 33.50 31.07 2oii n PRO 990 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2oii n GLU 991 N 3.64 0.00 -1.41 0.54 1.02 -1.26 -4.71 120.64 118.45 2oii n GLU 991 Ca 0.37 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.39 2oii n GLU 991 Cb 0.37 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.73 2oii n GLU 991 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2oii n LEU 992 N 0.00 -0.90 -4.91 -4.62 4.77 -1.26 -4.93 117.00 105.15 2oii n LEU 992 Ca 0.00 0.30 -0.28 0.00 -0.03 0.00 0.00 56.01 56.00 2oii n LEU 992 Cb 0.00 -1.90 -0.02 0.00 -2.33 0.00 0.00 43.42 39.17 2oii n LEU 992 CO 0.00 -0.62 0.29 -1.61 -1.33 0.00 0.00 177.39 174.12 2oii s GLU 993 N -3.13 3.61 -0.37 3.23 2.02 -1.26 -5.07 118.70 117.72 2oii s GLU 993 Ca 0.00 0.05 0.03 0.00 0.02 0.00 0.00 54.97 55.07 2oii s GLU 993 Cb 0.00 -2.55 0.15 0.00 0.10 0.00 0.00 34.13 31.83 2oii s GLU 993 CO 0.00 0.07 0.37 -1.01 0.02 0.00 0.00 175.26 174.71 2oii s HIS 994 N -2.32 -0.22 -1.19 1.61 3.76 -1.26 -5.25 115.29 110.42 2oii s HIS 994 Ca 0.45 -0.89 0.00 0.00 -0.15 0.00 0.00 55.06 54.47 2oii s HIS 994 Cb -0.10 -0.44 0.00 0.00 1.11 0.00 0.00 32.58 33.15 2oii s HIS 994 CO 0.35 -0.96 0.30 0.00 -0.85 0.00 0.00 174.74 173.57