#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wmg n ALA 855 N 0.00 0.80 -3.41 -0.72 0.00 -1.26 -4.38 120.51 111.55 1wmg n ALA 855 Ca 0.00 0.10 -0.14 0.00 0.00 0.00 0.00 53.44 53.40 1wmg n ALA 855 Cb 0.00 -0.94 -0.08 0.00 0.00 0.00 0.00 19.45 18.43 1wmg n ALA 855 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1wmg s PHE 856 N -3.20 -0.51 0.01 0.00 2.19 -1.26 -4.35 117.98 110.86 1wmg s PHE 856 Ca -0.01 1.10 0.00 0.00 0.33 0.00 0.00 56.93 58.35 1wmg s PHE 856 Cb 0.03 0.22 -0.01 0.00 -1.31 0.00 0.00 43.02 41.96 1wmg s PHE 856 CO 0.10 -0.38 -0.01 0.15 1.83 0.00 0.00 175.22 176.91 1wmg s LYS 857 N -0.40 0.12 -0.02 10.12 1.02 -1.26 -4.80 119.74 124.53 1wmg s LYS 857 Ca -0.05 -0.19 -0.30 0.00 0.02 0.00 0.00 55.97 55.45 1wmg s LYS 857 Cb -0.03 -0.00 -0.03 0.00 -0.52 0.00 0.00 37.83 37.25 1wmg s LYS 857 CO 0.04 -0.00 0.99 0.42 -0.92 0.00 0.00 175.35 175.87 1wmg s ILE 858 N -0.42 4.83 0.25 2.17 1.01 -1.26 -4.98 121.20 122.80 1wmg s ILE 858 Ca -0.04 2.04 -0.31 0.00 0.00 0.00 0.00 60.65 62.33 1wmg s ILE 858 Cb -0.03 -4.31 -0.13 0.00 0.01 0.00 0.00 42.46 38.01 1wmg s ILE 858 CO -0.00 0.13 1.54 -0.81 0.00 0.00 0.00 174.94 175.79 1wmg n PRO 859 N 4.10 2.39 -0.31 2.79 -0.04 -1.26 -4.75 135.00 137.92 1wmg n PRO 859 Ca 0.07 0.85 0.11 0.00 -0.04 0.00 0.00 63.50 64.48 1wmg n PRO 859 Cb 0.50 -2.59 0.23 0.00 -0.04 0.00 0.00 33.50 31.61 1wmg n PRO 859 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1wmg h LEU 860 N 4.93 -0.43 -1.37 1.53 4.07 -1.99 -0.94 115.31 121.10 1wmg h LEU 860 Ca -0.46 0.25 -0.02 0.00 0.08 0.00 0.00 57.88 57.74 1wmg h LEU 860 Cb 1.25 0.43 -0.02 0.00 1.08 0.00 0.00 40.66 43.40 1wmg h LEU 860 CO 0.81 -0.28 0.22 0.77 -1.08 0.00 0.00 178.44 178.88 1wmg h SER 861 N 0.06 0.58 -0.09 -0.43 4.64 -1.98 -0.73 113.55 115.59 1wmg h SER 861 Ca 0.52 -0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.67 1wmg h SER 861 Cb 1.01 -0.15 0.01 0.00 -0.31 0.00 0.00 62.40 62.96 1wmg h SER 861 CO -0.83 0.50 -0.42 0.40 -0.87 0.00 0.00 176.83 175.61 1wmg h ILE 862 N 0.65 1.39 -0.42 0.95 2.04 -1.55 -2.55 117.51 118.02 1wmg h ILE 862 Ca 0.16 -1.77 0.04 0.00 1.00 0.00 0.00 64.86 64.29 1wmg h ILE 862 Cb 0.08 2.23 -0.04 0.00 -0.74 0.00 0.00 36.82 38.34 1wmg h ILE 862 CO -0.02 0.52 0.18 -0.09 0.00 0.00 0.00 178.15 178.74 1wmg h ARG 863 N 0.02 0.35 -0.89 2.37 2.43 -1.11 0.04 114.38 117.60 1wmg h ARG 863 Ca -0.03 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1wmg h ARG 863 Cb 1.07 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 30.49 1wmg h ARG 863 CO 0.09 0.23 0.58 1.96 -1.51 0.00 0.00 179.97 181.32 1wmg h GLN 864 N 0.36 1.10 -0.23 0.20 4.20 -1.14 -0.44 115.11 119.18 1wmg h GLN 864 Ca 0.19 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 1wmg h GLN 864 Cb 0.13 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 1wmg h GLN 864 CO -0.16 0.73 -0.36 0.87 -0.67 0.00 0.00 178.83 179.24 1wmg h LYS 865 N 1.14 0.65 -0.69 1.46 1.57 -0.98 -0.78 116.57 118.93 1wmg h LYS 865 Ca 0.35 -0.39 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1wmg h LYS 865 Cb -0.03 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 1wmg h LYS 865 CO -0.11 1.01 0.36 0.82 -0.57 0.00 0.00 179.45 180.96 1wmg h ILE 866 N 0.35 1.22 -0.08 1.86 2.04 -0.75 -1.55 117.51 120.60 1wmg h ILE 866 Ca 0.02 -0.57 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 1wmg h ILE 866 Cb 0.95 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1wmg h ILE 866 CO 0.08 0.24 -0.00 0.00 0.00 0.00 0.00 178.15 178.47 1wmg h SER 868 N -0.15 0.62 -0.16 0.00 0.02 -1.06 -0.51 113.55 112.32 1wmg h SER 868 Ca 0.02 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 1wmg h SER 868 Cb 0.36 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 1wmg h SER 868 CO 0.00 0.38 -0.05 -1.28 -1.14 0.00 0.00 176.83 174.74 1wmg h SER 869 N 0.75 0.32 0.67 3.07 0.87 -1.12 -3.36 113.55 114.75 1wmg h SER 869 Ca 0.36 -0.39 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1wmg h SER 869 Cb 0.28 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1wmg h SER 869 CO -0.22 0.63 -0.94 0.18 -0.53 0.00 0.00 176.83 175.95 1wmg n LEU 870 N -4.66 0.66 -0.09 2.23 7.99 0.09 -4.28 117.00 118.93 1wmg n LEU 870 Ca -0.05 0.14 -0.02 0.00 -0.01 0.00 0.00 56.01 56.06 1wmg n LEU 870 Cb 0.28 -0.11 0.22 0.00 -0.11 0.00 0.00 43.42 43.69 1wmg n LEU 870 CO 0.37 -0.04 0.95 0.44 -1.51 0.00 0.00 177.39 177.61 1wmg h ASP 871 N 0.00 0.69 -2.39 -1.43 3.45 -1.23 -2.02 116.42 113.48 1wmg h ASP 871 Ca 0.00 -0.13 -0.55 0.00 0.43 0.00 0.00 57.03 56.78 1wmg h ASP 871 Cb 0.81 -0.18 0.04 0.00 -0.56 0.00 0.00 39.33 39.44 1wmg h ASP 871 CO 0.00 0.71 1.02 0.00 -1.57 0.00 0.00 179.24 179.41 1wmg n ALA 872 N -2.47 1.88 -1.69 3.45 0.00 -1.26 -4.87 120.51 115.55 1wmg n ALA 872 Ca 0.03 0.35 -0.42 0.00 0.00 0.00 0.00 53.44 53.40 1wmg n ALA 872 Cb 0.24 -2.51 -0.03 0.00 0.00 0.00 0.00 19.45 17.14 1wmg n ALA 872 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1wmg n PRO 873 N 5.06 2.80 -3.87 0.00 -0.04 -1.26 -4.77 135.00 132.92 1wmg n PRO 873 Ca 0.18 1.02 -0.35 0.00 -0.04 0.00 0.00 63.50 64.31 1wmg n PRO 873 Cb 0.34 -2.91 -0.13 0.00 -0.04 0.00 0.00 33.50 30.75 1wmg n PRO 873 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1wmg s ASN 874 N 2.66 4.99 0.45 3.54 3.84 -1.26 -5.00 114.94 124.16 1wmg s ASN 874 Ca 0.82 -1.43 0.38 0.00 0.21 0.00 0.00 52.86 52.83 1wmg s ASN 874 Cb -0.48 -1.74 1.45 0.00 -0.55 0.00 0.00 41.25 39.93 1wmg s ASN 874 CO 0.37 -0.32 1.39 -0.24 -2.79 0.00 0.00 177.10 175.51 1wmg n SER 875 N 4.62 0.08 -1.37 -4.21 2.88 -1.26 0.11 113.62 114.47 1wmg n SER 875 Ca -0.10 1.04 0.11 0.00 -1.33 0.00 0.00 58.87 58.58 1wmg n SER 875 Cb 0.43 -0.52 0.32 0.00 -0.75 0.00 0.00 64.21 63.70 1wmg n SER 875 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1wmg n ARG 876 N -4.05 2.86 -0.30 -1.46 1.74 -1.26 -4.95 116.66 109.24 1wmg n ARG 876 Ca 0.38 -2.60 0.00 0.00 -0.77 0.00 0.00 57.85 54.86 1wmg n ARG 876 Cb 1.63 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 31.45 1wmg n ARG 876 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wmg n GLY 877 N 1.52 1.32 2.33 -0.13 0.00 0.12 -4.95 105.19 105.40 1wmg n GLY 877 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 1wmg n GLY 877 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1wmg n ASN 878 N 0.00 6.71 0.00 1.61 4.13 -1.26 -3.87 115.26 122.58 1wmg n ASN 878 Ca 0.00 -2.91 0.00 0.00 1.68 0.00 0.00 54.58 53.35 1wmg n ASN 878 Cb 0.00 -1.35 0.00 0.00 -1.54 0.00 0.00 39.78 36.89 1wmg n ASN 878 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 1wmg n ASP 879 N 1.83 0.98 0.06 6.41 3.85 -1.26 -4.88 116.55 123.53 1wmg n ASP 879 Ca 0.54 0.00 0.21 0.00 -0.71 0.00 0.00 54.79 54.83 1wmg n ASP 879 Cb 0.56 0.00 0.73 0.00 -1.35 0.00 0.00 41.12 41.06 1wmg n ASP 879 CO 0.00 0.00 0.00 4.11 -1.01 0.00 0.00 177.20 180.30 1wmg h TRP 880 N 0.00 0.00 -0.88 2.11 5.08 -1.66 -1.10 115.95 119.49 1wmg h TRP 880 Ca 0.00 0.00 0.05 0.00 1.08 0.00 0.00 58.89 60.02 1wmg h TRP 880 Cb 0.00 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.10 1wmg h TRP 880 CO 0.00 0.00 0.56 0.00 -1.28 0.00 0.00 178.44 177.72 1wmg h ARG 881 N 0.00 1.02 -0.51 0.12 3.08 -1.88 -0.28 114.38 115.93 1wmg h ARG 881 Ca 0.22 -0.06 -0.12 0.00 0.07 0.00 0.00 59.98 60.08 1wmg h ARG 881 Cb 1.18 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 1wmg h ARG 881 CO -0.00 0.68 -0.17 1.25 -1.07 0.00 0.00 179.97 180.65 1wmg h LEU 882 N 1.05 1.03 -0.18 3.04 6.46 -1.30 -1.98 115.31 123.43 1wmg h LEU 882 Ca 0.37 -0.37 -0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1wmg h LEU 882 Cb 0.09 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.73 1wmg h LEU 882 CO -0.15 1.17 0.10 0.25 -0.62 0.00 0.00 178.44 179.19 1wmg h LEU 883 N 0.89 0.23 -0.92 2.25 5.85 -1.47 -0.49 115.31 121.64 1wmg h LEU 883 Ca 0.12 -0.09 0.14 0.00 0.84 0.00 0.00 57.88 58.90 1wmg h LEU 883 Cb 0.75 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.63 1wmg h LEU 883 CO 0.06 0.25 0.53 0.00 -0.34 0.00 0.00 178.44 178.93 1wmg h ALA 884 N 0.99 1.41 -0.17 1.25 0.00 -0.87 -0.33 119.26 121.54 1wmg h ALA 884 Ca 0.06 0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 1wmg h ALA 884 Cb 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1wmg h ALA 884 CO -0.01 0.02 -0.54 0.37 0.00 0.00 0.00 179.25 179.09 1wmg h GLN 885 N 0.77 0.48 0.00 0.00 4.15 -0.94 -2.74 115.11 116.84 1wmg h GLN 885 Ca 0.49 -0.30 -0.07 0.00 0.77 0.00 0.00 58.65 59.54 1wmg h GLN 885 Cb 0.63 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 1wmg h GLN 885 CO -0.33 0.90 -0.33 0.87 -1.93 0.00 0.00 178.83 178.02 1wmg h LYS 886 N 0.37 0.00 -0.71 1.69 1.79 0.47 -2.74 116.57 117.45 1wmg h LYS 886 Ca 0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1wmg h LYS 886 Cb 1.06 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 1wmg h LYS 886 CO 0.10 0.33 0.00 1.28 -1.08 0.00 0.00 179.45 180.07 1wmg n LEU 887 N -3.70 4.27 -2.67 2.94 4.77 -0.30 -4.98 117.00 117.33 1wmg n LEU 887 Ca -0.01 -2.14 -0.01 0.00 -0.03 0.00 0.00 56.01 53.82 1wmg n LEU 887 Cb 0.43 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1wmg n LEU 887 CO 0.36 0.92 -0.41 -1.20 -1.33 0.00 0.00 177.39 175.73 1wmg n SER 888 N 1.46 -7.73 0.00 -1.43 7.64 -1.03 -5.05 113.62 107.48 1wmg n SER 888 Ca 0.25 1.26 0.00 0.00 1.01 0.00 0.00 58.87 61.39 1wmg n SER 888 Cb 0.73 -5.14 0.00 0.00 -1.01 0.00 0.00 64.21 58.79 1wmg n SER 888 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1wmg n ASP 890 N 0.54 0.00 0.13 6.43 -0.08 -1.16 -5.01 116.55 117.40 1wmg n ASP 890 Ca 0.01 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.42 1wmg n ASP 890 Cb 0.06 0.00 0.49 0.00 2.34 0.00 0.00 41.12 44.01 1wmg n ASP 890 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1wmg n ARG 891 N -0.06 0.21 -0.14 -0.67 1.74 -1.26 -3.33 116.66 113.15 1wmg n ARG 891 Ca 0.00 0.41 0.07 0.00 -0.77 0.00 0.00 57.85 57.56 1wmg n ARG 891 Cb 0.00 -1.88 0.15 0.00 -1.02 0.00 0.00 32.46 29.71 1wmg n ARG 891 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1wmg n TYR 892 N -2.27 0.38 -0.33 -1.55 4.02 -1.26 -4.73 117.16 111.43 1wmg n TYR 892 Ca 0.02 -0.32 0.11 0.00 -0.01 0.00 0.00 57.90 57.70 1wmg n TYR 892 Cb 0.25 -0.01 0.23 0.00 -0.02 0.00 0.00 39.34 39.79 1wmg n TYR 892 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1wmg h LEU 893 N 2.65 -0.54 -1.38 7.72 3.38 -1.98 0.36 115.31 125.52 1wmg h LEU 893 Ca 0.00 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1wmg h LEU 893 Cb 0.72 0.48 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1wmg h LEU 893 CO 0.00 -0.31 0.00 0.78 0.09 0.00 0.00 178.44 179.00 1wmg h ASN 894 N 0.03 0.00 0.11 -0.43 2.35 -1.88 -0.73 115.58 115.03 1wmg h ASN 894 Ca 0.53 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.95 1wmg h ASN 894 Cb 1.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.37 1wmg h ASN 894 CO -0.88 0.00 -1.75 0.22 -1.65 0.00 0.00 177.43 173.37 1wmg h TYR 895 N 0.00 0.44 -0.31 1.19 3.20 -0.64 -3.36 116.97 117.48 1wmg h TYR 895 Ca 0.00 -0.32 -0.07 0.00 3.14 0.00 0.00 58.73 61.48 1wmg h TYR 895 Cb 0.14 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 1wmg h TYR 895 CO 0.00 1.69 -0.11 0.74 -1.64 0.00 0.00 178.16 178.84 1wmg h PHE 896 N -0.15 0.57 -0.98 -3.82 0.04 -1.14 -3.17 116.94 108.29 1wmg h PHE 896 Ca -0.38 -0.09 0.23 0.00 2.80 0.00 0.00 57.97 60.53 1wmg h PHE 896 Cb 1.89 -0.15 -0.08 0.00 2.20 0.00 0.00 35.95 39.80 1wmg h PHE 896 CO 0.09 0.63 0.63 0.00 -0.60 0.00 0.00 178.31 179.07 1wmg h ALA 897 N 1.39 2.14 -0.10 2.45 0.00 -1.30 -1.47 119.26 122.37 1wmg h ALA 897 Ca 0.09 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1wmg h ALA 897 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1wmg h ALA 897 CO 0.03 -0.49 0.00 0.25 0.00 0.00 0.00 179.25 179.04 1wmg n THR 898 N -4.59 0.12 -3.40 0.00 -2.24 -1.20 -4.90 114.28 98.07 1wmg n THR 898 Ca 0.22 -0.28 -0.33 0.00 -2.27 0.00 0.00 64.05 61.40 1wmg n THR 898 Cb 0.76 0.32 -0.05 0.00 -2.10 0.00 0.00 70.33 69.25 1wmg n THR 898 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1wmg s LYS 899 N -1.88 3.86 0.39 -0.78 -0.14 -0.55 -4.96 119.74 115.68 1wmg s LYS 899 Ca 0.34 0.34 0.10 0.00 -1.36 0.00 0.00 55.97 55.40 1wmg s LYS 899 Cb 0.18 -2.73 0.88 0.00 -1.68 0.00 0.00 37.83 34.48 1wmg s LYS 899 CO 0.29 0.37 1.93 0.00 -0.76 0.00 0.00 175.35 177.18 1wmg h ALA 900 N 2.86 1.88 -2.83 5.17 0.00 -1.90 -3.28 119.26 121.16 1wmg h ALA 900 Ca -0.47 -0.01 -0.61 0.00 0.00 0.00 0.00 54.91 53.82 1wmg h ALA 900 Cb 1.18 -0.13 -0.40 0.00 0.00 0.00 0.00 17.79 18.44 1wmg h ALA 900 CO 0.68 -0.05 -0.77 0.45 0.00 0.00 0.00 179.25 179.56 1wmg s SER 901 N -6.06 3.31 0.31 0.00 0.15 -1.26 -4.98 113.70 105.17 1wmg s SER 901 Ca -0.09 -2.95 0.02 0.00 0.70 0.00 0.00 55.95 53.63 1wmg s SER 901 Cb 0.20 -0.97 0.57 0.00 -1.71 0.00 0.00 66.02 64.11 1wmg s SER 901 CO 0.77 -0.21 1.91 1.55 1.20 0.00 0.00 173.24 178.46 1wmg h PRO 902 N 6.22 0.95 -0.23 5.44 0.13 -1.73 -0.16 132.00 142.62 1wmg h PRO 902 Ca 0.09 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 65.12 1wmg h PRO 902 Cb 0.89 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 1wmg h PRO 902 CO 0.49 0.63 -0.05 1.15 -0.23 0.00 0.00 178.00 179.99 1wmg h THR 903 N 0.98 1.17 -0.49 1.56 2.02 -1.91 -1.44 112.91 114.80 1wmg h THR 903 Ca 0.39 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 1wmg h THR 903 Cb 0.24 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1wmg h THR 903 CO -0.15 0.23 0.14 1.23 0.37 0.00 0.00 175.52 177.34 1wmg h GLY 904 N 0.72 0.82 0.98 2.16 0.00 -1.42 -1.44 103.07 104.90 1wmg h GLY 904 Ca 0.07 -0.50 -0.09 0.00 0.00 0.00 0.00 47.33 46.81 1wmg h GLY 904 CO 0.01 0.47 -0.11 -2.08 0.00 0.00 0.00 176.54 174.83 1wmg h VAL 905 N 0.65 1.28 -0.69 4.60 2.07 -1.01 -2.05 116.25 121.10 1wmg h VAL 905 Ca 0.15 -1.21 0.04 0.00 0.82 0.00 0.00 66.70 66.50 1wmg h VAL 905 Cb 0.30 1.24 -0.05 0.00 -1.52 0.00 0.00 31.29 31.26 1wmg h VAL 905 CO -0.00 0.40 0.42 0.40 0.02 0.00 0.00 177.57 178.81 1wmg h ILE 906 N 0.59 1.06 -0.03 4.57 2.04 -1.11 -1.10 117.51 123.53 1wmg h ILE 906 Ca 0.10 -0.28 -0.16 0.00 1.00 0.00 0.00 64.86 65.52 1wmg h ILE 906 Cb 0.64 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1wmg h ILE 906 CO 0.04 0.15 -0.70 -0.07 0.00 0.00 0.00 178.15 177.57 1wmg h LEU 907 N 0.81 0.18 -0.17 1.44 3.38 -1.21 -1.71 115.31 118.04 1wmg h LEU 907 Ca 0.29 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1wmg h LEU 907 Cb 0.06 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1wmg h LEU 907 CO -0.13 0.83 0.03 0.44 0.09 0.00 0.00 178.44 179.70 1wmg h ASP 908 N 0.10 0.26 -0.79 -0.43 3.45 -0.94 0.04 116.42 118.13 1wmg h ASP 908 Ca -0.02 -0.26 0.01 0.00 0.43 0.00 0.00 57.03 57.19 1wmg h ASP 908 Cb 1.25 -0.07 -0.04 0.00 -0.56 0.00 0.00 39.33 39.91 1wmg h ASP 908 CO 0.10 0.45 0.52 -0.07 -1.57 0.00 0.00 179.24 178.67 1wmg h LEU 909 N 0.06 0.91 -0.62 1.55 3.38 -1.18 -0.45 115.31 118.96 1wmg h LEU 909 Ca 0.05 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1wmg h LEU 909 Cb 0.30 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1wmg h LEU 909 CO 0.00 0.66 0.40 -0.25 0.09 0.00 0.00 178.44 179.35 1wmg h TRP 910 N 1.07 0.78 -0.32 1.13 7.01 -1.07 -2.54 115.95 122.02 1wmg h TRP 910 Ca 0.29 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.28 1wmg h TRP 910 Cb -0.12 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 26.67 1wmg h TRP 910 CO -0.02 0.50 0.11 0.93 -2.79 0.00 0.00 178.44 177.17 1wmg h GLU 911 N 0.84 0.49 -0.73 2.65 5.08 -0.52 -2.92 114.58 119.45 1wmg h GLU 911 Ca 0.22 -0.10 0.17 0.00 -1.00 0.00 0.00 59.36 58.65 1wmg h GLU 911 Cb -0.08 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 1wmg h GLU 911 CO -0.05 0.51 0.50 0.00 -1.00 0.00 0.00 179.01 178.97 1wmg h ALA 912 N 0.95 2.29 -0.16 3.43 0.00 -0.75 -1.15 119.26 123.87 1wmg h ALA 912 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1wmg h ALA 912 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1wmg h ALA 912 CO -0.01 -0.50 0.00 2.89 0.00 0.00 0.00 179.25 181.64 1wmg n ARG 913 N -4.44 1.83 -2.37 0.00 1.85 -0.99 -4.93 116.66 107.62 1wmg n ARG 913 Ca 0.14 -1.24 -0.27 0.00 -1.00 0.00 0.00 57.85 55.48 1wmg n ARG 913 Cb 0.61 -1.43 0.03 0.00 -1.05 0.00 0.00 32.46 30.62 1wmg n ARG 913 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1wmg s GLN 914 N -1.81 3.06 0.50 2.89 -1.52 -0.44 -5.11 119.66 117.24 1wmg s GLN 914 Ca 0.34 0.11 0.02 0.00 -1.95 0.00 0.00 55.36 53.87 1wmg s GLN 914 Cb 0.19 -2.26 0.02 0.00 -0.22 0.00 0.00 33.01 30.74 1wmg s GLN 914 CO 0.28 -0.63 0.16 1.04 -0.25 0.00 0.00 175.29 175.89 1wmg n GLN 915 N -2.57 0.79 -3.85 2.91 1.13 -1.26 -4.77 117.38 109.77 1wmg n GLN 915 Ca 0.04 -3.40 -0.30 0.00 -1.94 0.00 0.00 57.00 51.40 1wmg n GLN 915 Cb 0.57 0.69 -0.14 0.00 0.11 0.00 0.00 30.24 31.47 1wmg n GLN 915 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1wmg s ASP 916 N -3.82 4.04 0.07 1.08 -1.08 -1.26 -4.63 116.67 111.08 1wmg s ASP 916 Ca 0.12 -2.78 0.01 0.00 -0.52 0.00 0.00 52.55 49.39 1wmg s ASP 916 Cb -0.01 -1.36 0.01 0.00 -1.46 0.00 0.00 42.92 40.10 1wmg s ASP 916 CO 0.08 -0.26 0.10 0.61 0.52 0.00 0.00 175.17 176.22 1wmg n GLY 918 N 3.39 2.02 1.27 2.66 0.00 -1.26 -5.14 105.19 108.13 1wmg n GLY 918 Ca 0.06 -2.15 -0.08 0.00 0.00 0.00 0.00 46.02 43.86 1wmg n GLY 918 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wmg n ASP 919 N -2.85 -0.14 -0.25 1.61 3.85 -1.26 -5.05 116.55 112.46 1wmg n ASP 919 Ca 0.02 -1.87 0.00 0.00 -0.71 0.00 0.00 54.79 52.23 1wmg n ASP 919 Cb 0.07 0.64 0.00 0.00 -1.35 0.00 0.00 41.12 40.48 1wmg n ASP 919 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1wmg n LEU 920 N 0.00 0.51 -0.20 -2.12 4.77 -1.26 -4.45 117.00 114.25 1wmg n LEU 920 Ca 0.03 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 1wmg n LEU 920 Cb 0.24 -0.23 0.11 0.00 -2.33 0.00 0.00 43.42 41.20 1wmg n LEU 920 CO 0.12 0.12 0.93 -1.13 -1.33 0.00 0.00 177.39 176.11 1wmg h ASN 921 N 0.05 0.05 0.88 -1.43 -1.24 -1.99 0.79 115.58 112.70 1wmg h ASN 921 Ca 0.00 0.10 -0.08 0.00 0.71 0.00 0.00 56.30 57.03 1wmg h ASN 921 Cb 0.24 0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.41 1wmg h ASN 921 CO 0.00 0.04 -0.37 0.77 -1.29 0.00 0.00 177.43 176.58 1wmg h SER 922 N 0.29 0.00 0.01 1.15 4.64 -1.99 -0.53 113.55 117.12 1wmg h SER 922 Ca 0.31 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.56 1wmg h SER 922 Cb 0.44 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.54 1wmg h SER 922 CO -0.38 0.37 -0.28 0.25 -0.87 0.00 0.00 176.83 175.93 1wmg h LEU 923 N 0.00 0.24 -0.56 5.97 5.85 -1.72 -2.18 115.31 122.89 1wmg h LEU 923 Ca -0.00 -0.80 0.00 0.00 0.84 0.00 0.00 57.88 57.92 1wmg h LEU 923 Cb 0.91 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 1wmg h LEU 923 CO 0.05 1.01 0.37 0.00 -0.34 0.00 0.00 178.44 179.52 1wmg h ALA 924 N 0.23 0.72 -0.05 1.25 0.00 -0.82 -1.65 119.26 118.95 1wmg h ALA 924 Ca -0.04 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1wmg h ALA 924 Cb 1.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1wmg h ALA 924 CO 0.05 0.16 -0.22 1.03 0.00 0.00 0.00 179.25 180.28 1wmg h SER 925 N 0.76 0.08 -0.02 0.00 0.87 -1.14 -1.71 113.55 112.39 1wmg h SER 925 Ca 0.21 -0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.62 1wmg h SER 925 Cb -0.08 -0.02 0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1wmg h SER 925 CO -0.04 0.30 -0.49 0.00 -0.53 0.00 0.00 176.83 176.07 1wmg h ALA 926 N 1.71 0.08 -0.09 6.23 0.00 -0.89 -2.85 119.26 123.45 1wmg h ALA 926 Ca 0.01 -0.53 0.03 0.00 0.00 0.00 0.00 54.91 54.42 1wmg h ALA 926 Cb 0.44 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1wmg h ALA 926 CO 0.03 0.28 0.07 -0.07 0.00 0.00 0.00 179.25 179.56 1wmg h LEU 927 N -0.17 0.00 -0.26 0.00 3.38 -1.13 -1.85 115.31 115.28 1wmg h LEU 927 Ca -0.06 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1wmg h LEU 927 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1wmg h LEU 927 CO 0.10 0.00 -0.20 -0.08 0.09 0.00 0.00 178.44 178.35 1wmg h GLU 928 N 0.00 0.58 -2.29 1.13 4.22 -1.22 -1.15 114.58 115.86 1wmg h GLU 928 Ca 0.04 -0.29 -0.04 0.00 0.08 0.00 0.00 59.36 59.15 1wmg h GLU 928 Cb 0.17 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1wmg h GLU 928 CO -0.00 0.87 0.05 0.39 -2.18 0.00 0.00 179.01 178.14 1wmg n GLU 929 N -4.39 0.69 -0.81 1.92 1.02 -0.70 -4.35 120.64 114.01 1wmg n GLU 929 Ca -0.04 -0.24 -0.04 0.00 -0.02 0.00 0.00 57.16 56.82 1wmg n GLU 929 Cb 0.41 -1.51 -0.04 0.00 -0.02 0.00 0.00 31.44 30.27 1wmg n GLU 929 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wmg n GLY 931 N 2.30 0.69 2.31 0.62 0.00 -1.14 -5.12 105.19 104.86 1wmg n GLY 931 Ca 0.10 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1wmg n GLY 931 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wmg n LYS 932 N 0.00 3.13 -0.30 1.61 4.76 -0.45 -4.76 118.16 122.16 1wmg n LYS 932 Ca -0.17 -2.22 0.03 0.00 -2.87 0.00 0.00 58.31 53.08 1wmg n LYS 932 Cb 0.63 -2.38 0.11 0.00 -1.84 0.00 0.00 35.03 31.55 1wmg n LYS 932 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1wmg h SER 933 N 3.85 -0.78 0.00 4.39 0.02 -1.91 -2.47 113.55 116.66 1wmg h SER 933 Ca 0.53 0.25 0.00 0.00 -0.84 0.00 0.00 61.79 61.73 1wmg h SER 933 Cb 0.73 0.52 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1wmg h SER 933 CO 1.06 -0.28 0.00 1.21 -1.14 0.00 0.00 176.83 177.68 1wmg n GLU 934 N -5.54 0.11 0.00 3.45 2.13 -1.26 -1.95 120.64 117.57 1wmg n GLU 934 Ca 0.13 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.95 1wmg n GLU 934 Cb 0.43 -1.41 0.00 0.00 0.27 0.00 0.00 31.44 30.73 1wmg n GLU 934 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1wmg n LEU 936 N 0.90 0.00 -0.15 4.31 4.77 -0.93 -0.39 117.00 125.50 1wmg n LEU 936 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.93 1wmg n LEU 936 Cb 0.05 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.18 1wmg n LEU 936 CO 0.00 0.00 1.00 0.58 -1.33 0.00 0.00 177.39 177.64 1wmg h VAL 937 N 0.00 0.94 0.00 4.08 2.07 -1.68 -2.31 116.25 119.35 1wmg h VAL 937 Ca 0.00 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1wmg h VAL 937 Cb 0.00 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1wmg h VAL 937 CO 0.00 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.67 1wmg n ALA 938 N -2.33 0.76 0.00 1.67 0.00 0.47 -0.92 120.51 120.16 1wmg n ALA 938 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1wmg n ALA 938 Cb 0.13 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1wmg n ALA 938 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmg n ALA 940 N 0.42 0.00 0.19 0.00 0.00 -0.87 -2.88 120.51 117.37 1wmg n ALA 940 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 1wmg n ALA 940 Cb 0.00 0.00 0.81 0.00 0.00 0.00 0.00 19.45 20.26 1wmg n ALA 940 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1wmg h THR 941 N 0.00 0.32 0.00 0.00 2.02 -1.30 -3.55 112.91 110.40 1wmg h THR 941 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1wmg h THR 941 Cb 0.00 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 1wmg h THR 941 CO 0.00 0.00 0.00 -0.67 0.37 0.00 0.00 175.52 175.22