#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 2.49 0.00 -0.72 0.00 -1.26 -4.77 120.51 116.25 1wmg n ALA 855 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wmg n ALA 855 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1wmg n ALA 855 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1wmg n PHE 856 N -0.41 0.00 -4.51 0.00 7.35 -1.26 -4.42 117.46 114.21 1wmg n PHE 856 Ca 0.00 0.00 -0.21 0.00 -0.76 0.00 0.00 57.45 56.48 1wmg n PHE 856 Cb 0.04 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 39.72 1wmg n PHE 856 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 1wmg s LYS 857 N -1.24 0.99 0.05 -4.13 -0.14 -1.26 -4.80 119.74 109.20 1wmg s LYS 857 Ca 0.00 -0.41 -0.30 0.00 -1.36 0.00 0.00 55.97 53.90 1wmg s LYS 857 Cb 0.00 -0.94 -0.04 0.00 -1.68 0.00 0.00 37.83 35.17 1wmg s LYS 857 CO 0.00 0.23 0.96 0.42 -0.76 0.00 0.00 175.35 176.20 1wmg s ILE 858 N -0.19 4.71 0.16 2.17 1.01 -1.26 -4.98 121.20 122.82 1wmg s ILE 858 Ca 0.03 2.05 -0.33 0.00 0.00 0.00 0.00 60.65 62.39 1wmg s ILE 858 Cb -0.05 -4.31 -0.13 0.00 0.01 0.00 0.00 42.46 37.97 1wmg s ILE 858 CO -0.00 0.23 1.66 -0.81 0.00 0.00 0.00 174.94 176.02 1wmg n PRO 859 N 3.40 2.38 -0.33 2.79 -0.04 -1.26 -4.74 135.00 137.20 1wmg n PRO 859 Ca 0.04 0.86 0.34 0.00 -0.04 0.00 0.00 63.50 64.70 1wmg n PRO 859 Cb 0.50 -2.67 0.72 0.00 -0.04 0.00 0.00 33.50 32.01 1wmg n PRO 859 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1wmg h LEU 860 N 6.57 0.06 0.32 1.53 6.46 -1.99 0.76 115.31 129.03 1wmg h LEU 860 Ca -0.45 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.32 1wmg h LEU 860 Cb 1.24 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.16 1wmg h LEU 860 CO 0.92 0.01 -0.21 -1.28 -0.62 0.00 0.00 178.44 177.25 1wmg h SER 861 N 0.05 -0.54 -0.42 1.25 0.87 -2.00 -1.65 113.55 111.12 1wmg h SER 861 Ca 0.58 0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 61.11 1wmg h SER 861 Cb 2.20 0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 64.31 1wmg h SER 861 CO -0.05 -0.34 -0.02 0.40 -0.53 0.00 0.00 176.83 176.29 1wmg h ILE 862 N -0.53 1.26 0.11 2.23 2.04 -1.26 -2.71 117.51 118.66 1wmg h ILE 862 Ca -0.03 -1.06 0.02 0.00 1.00 0.00 0.00 64.86 64.79 1wmg h ILE 862 Cb 0.44 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.60 1wmg h ILE 862 CO 0.02 0.36 -0.48 -0.09 0.00 0.00 0.00 178.15 177.96 1wmg h ARG 863 N 0.58 -0.68 -0.85 2.37 2.43 -1.13 0.11 114.38 117.21 1wmg h ARG 863 Ca 0.12 0.05 0.15 0.00 -0.81 0.00 0.00 59.98 59.48 1wmg h ARG 863 Cb 0.51 0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 30.15 1wmg h ARG 863 CO 0.03 -0.45 0.56 0.37 -1.51 0.00 0.00 179.97 178.96 1wmg h GLN 864 N -0.71 0.55 0.74 0.20 5.75 -1.31 -0.54 115.11 119.79 1wmg h GLN 864 Ca 0.01 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.44 1wmg h GLN 864 Cb 0.73 -0.12 0.01 0.00 1.07 0.00 0.00 27.48 29.16 1wmg h GLN 864 CO -0.28 0.36 -0.35 -0.22 -2.65 0.00 0.00 178.83 175.69 1wmg h LYS 865 N 0.57 -0.95 -0.53 1.69 1.63 -0.86 -2.14 116.57 115.98 1wmg h LYS 865 Ca 0.43 0.06 0.09 0.00 -0.85 0.00 0.00 60.65 60.38 1wmg h LYS 865 Cb 0.82 0.22 -0.07 0.00 -0.60 0.00 0.00 32.23 32.60 1wmg h LYS 865 CO -0.18 -0.62 0.15 0.82 -3.45 0.00 0.00 179.45 176.18 1wmg h ILE 866 N -1.19 0.75 -0.49 2.00 2.04 -0.18 -2.20 117.51 118.23 1wmg h ILE 866 Ca -0.10 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1wmg h ILE 866 Cb 0.78 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1wmg h ILE 866 CO 0.17 0.06 0.27 0.00 0.00 0.00 0.00 178.15 178.64 1wmg h SER 868 N 0.64 0.84 -0.12 0.00 0.02 -1.09 0.14 113.55 113.98 1wmg h SER 868 Ca 0.17 -0.09 -0.19 0.00 -0.84 0.00 0.00 61.79 60.84 1wmg h SER 868 Cb 0.04 -0.21 0.01 0.00 0.14 0.00 0.00 62.40 62.38 1wmg h SER 868 CO -0.03 0.71 -0.67 -1.28 -1.14 0.00 0.00 176.83 174.43 1wmg h SER 869 N 0.93 0.80 0.68 3.07 0.87 -0.99 -3.37 113.55 115.54 1wmg h SER 869 Ca 0.23 -0.64 -0.11 0.00 -1.23 0.00 0.00 61.79 60.04 1wmg h SER 869 Cb 0.10 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 1wmg h SER 869 CO -0.03 1.32 -1.40 0.18 -0.53 0.00 0.00 176.83 176.37 1wmg n LEU 870 N -4.07 0.73 0.22 2.23 4.77 0.31 -4.20 117.00 116.99 1wmg n LEU 870 Ca -0.08 0.31 0.07 0.00 -0.03 0.00 0.00 56.01 56.28 1wmg n LEU 870 Cb 0.69 0.05 0.50 0.00 -2.33 0.00 0.00 43.42 42.33 1wmg n LEU 870 CO 0.50 0.05 0.82 0.44 -1.33 0.00 0.00 177.39 177.87 1wmg h ASP 871 N 0.00 0.00 -2.92 -1.43 3.32 -0.89 -1.73 116.42 112.77 1wmg h ASP 871 Ca -0.12 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.37 1wmg h ASP 871 Cb 1.38 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.90 1wmg h ASP 871 CO 0.03 0.26 0.95 0.00 -1.72 0.00 0.00 179.24 178.76 1wmg s ALA 872 N -4.07 3.57 0.37 3.45 0.00 -1.26 -4.91 121.76 118.92 1wmg s ALA 872 Ca -0.02 0.43 -0.27 0.00 0.00 0.00 0.00 51.96 52.10 1wmg s ALA 872 Cb 0.13 -3.68 -0.10 0.00 0.00 0.00 0.00 23.12 19.47 1wmg s ALA 872 CO 0.66 -1.37 1.35 -1.25 0.00 0.00 0.00 175.76 175.16 1wmg s PRO 873 N 3.77 4.13 0.13 0.00 0.04 -1.26 -4.82 135.00 136.98 1wmg s PRO 873 Ca 0.58 2.29 -0.08 0.00 0.04 0.00 0.00 61.00 63.83 1wmg s PRO 873 Cb -0.22 -2.92 -0.01 0.00 0.04 0.00 0.00 34.50 31.39 1wmg s PRO 873 CO 0.19 -0.41 0.22 0.54 0.04 0.00 0.00 177.00 177.58 1wmg s ASN 874 N -0.49 0.11 -0.02 6.66 2.20 -1.26 -5.03 114.94 117.11 1wmg s ASN 874 Ca 0.53 -0.82 0.03 0.00 -0.94 0.00 0.00 52.86 51.66 1wmg s ASN 874 Cb -0.41 0.38 0.12 0.00 -2.00 0.00 0.00 41.25 39.33 1wmg s ASN 874 CO 0.54 -0.81 0.92 -1.54 -2.94 0.00 0.00 177.10 173.27 1wmg n SER 875 N -0.13 1.13 -0.17 3.54 3.41 -1.26 -3.07 113.62 117.07 1wmg n SER 875 Ca -0.10 -2.07 0.10 0.00 -0.26 0.00 0.00 58.87 56.54 1wmg n SER 875 Cb 0.63 -0.28 -0.07 0.00 -0.26 0.00 0.00 64.21 64.22 1wmg n SER 875 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1wmg n ARG 876 N -0.04 0.77 -1.17 4.33 1.74 -1.26 -4.92 116.66 116.10 1wmg n ARG 876 Ca 0.04 -0.34 -0.06 0.00 -0.77 0.00 0.00 57.85 56.72 1wmg n ARG 876 Cb 0.23 -1.43 -0.02 0.00 -1.02 0.00 0.00 32.46 30.21 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 1.43 0.70 2.09 -0.13 0.00 -1.17 -4.86 105.19 103.25 1wmg n GLY 877 Ca 0.05 -0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 1wmg n GLY 877 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1wmg n ASN 878 N -0.51 6.81 -0.51 1.61 2.85 -1.26 -4.29 115.26 119.96 1wmg n ASN 878 Ca -0.06 -3.28 0.00 0.00 -0.11 0.00 0.00 54.58 51.13 1wmg n ASN 878 Cb 0.39 -1.06 0.00 0.00 1.24 0.00 0.00 39.78 40.35 1wmg n ASN 878 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1wmg n ASP 879 N 0.06 1.61 0.16 1.20 3.85 -1.26 -4.88 116.55 117.28 1wmg n ASP 879 Ca 0.41 -0.26 0.17 0.00 -0.71 0.00 0.00 54.79 54.40 1wmg n ASP 879 Cb 0.59 0.00 0.77 0.00 -1.35 0.00 0.00 41.12 41.13 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 0.21 0.00 -0.64 2.11 5.08 -1.64 -1.38 115.95 119.68 1wmg h TRP 880 Ca 0.00 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 59.88 1wmg h TRP 880 Cb 0.00 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.14 1wmg h TRP 880 CO 0.00 0.00 0.06 0.00 -1.28 0.00 0.00 178.44 177.22 1wmg h ARG 881 N 0.00 1.07 -0.24 0.12 3.08 -1.90 -0.93 114.38 115.58 1wmg h ARG 881 Ca 0.12 -0.30 -0.18 0.00 0.07 0.00 0.00 59.98 59.69 1wmg h ARG 881 Cb 0.60 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 1wmg h ARG 881 CO -0.00 1.01 -0.57 1.25 -1.07 0.00 0.00 179.97 180.58 1wmg h LEU 882 N 1.00 0.85 -0.56 3.04 5.85 -1.44 -2.17 115.31 121.87 1wmg h LEU 882 Ca 0.19 -0.46 0.01 0.00 0.84 0.00 0.00 57.88 58.45 1wmg h LEU 882 Cb 0.48 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1wmg h LEU 882 CO 0.02 1.24 0.36 0.25 -0.34 0.00 0.00 178.44 179.97 1wmg h LEU 883 N 0.57 0.62 -0.51 2.25 5.85 -1.29 0.35 115.31 123.16 1wmg h LEU 883 Ca 0.01 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.75 1wmg h LEU 883 Cb 1.16 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 1wmg h LEU 883 CO 0.12 0.45 0.28 0.00 -0.34 0.00 0.00 178.44 178.95 1wmg h ALA 884 N 1.21 0.66 -0.07 1.25 0.00 -1.03 -1.26 119.26 120.01 1wmg h ALA 884 Ca 0.21 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1wmg h ALA 884 Cb -0.07 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1wmg h ALA 884 CO -0.05 -0.05 0.04 0.37 0.00 0.00 0.00 179.25 179.56 1wmg h GLN 885 N 0.55 0.10 0.00 0.00 4.15 -0.83 -2.57 115.11 116.50 1wmg h GLN 885 Ca 0.22 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.62 1wmg h GLN 885 Cb 0.09 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 1wmg h GLN 885 CO -0.13 0.13 -0.03 0.87 -1.93 0.00 0.00 178.83 177.74 1wmg h LYS 886 N 0.04 0.00 -0.70 1.69 1.57 -0.49 -1.47 116.57 117.21 1wmg h LYS 886 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1wmg h LYS 886 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1wmg h LYS 886 CO -0.00 0.03 0.00 1.28 -0.57 0.00 0.00 179.45 180.19 1wmg n LEU 887 N -3.32 4.15 -2.44 2.94 4.77 -0.52 -4.97 117.00 117.61 1wmg n LEU 887 Ca -0.02 -2.08 -0.04 0.00 -0.03 0.00 0.00 56.01 53.84 1wmg n LEU 887 Cb 0.16 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 1wmg n LEU 887 CO 0.25 0.91 -0.11 -1.20 -1.33 0.00 0.00 177.39 175.91 1wmg n SER 888 N 1.46 -6.36 0.00 -1.43 7.64 -0.55 -5.05 113.62 109.32 1wmg n SER 888 Ca 0.25 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.76 1wmg n SER 888 Cb 0.70 -4.19 0.00 0.00 -1.01 0.00 0.00 64.21 59.71 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 -0.04 0.00 0.21 6.43 -0.08 -1.20 -5.01 116.55 116.87 1wmg n ASP 890 Ca 0.06 0.00 0.15 0.00 -1.51 0.00 0.00 54.79 53.48 1wmg n ASP 890 Cb 0.21 0.00 0.69 0.00 2.34 0.00 0.00 41.12 44.36 1wmg n ASP 890 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 1wmg h ARG 891 N 0.03 0.00 -0.47 -0.67 0.11 -1.98 -2.43 114.38 108.98 1wmg h ARG 891 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1wmg h ARG 891 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1wmg h ARG 891 CO 0.00 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.73 1wmg n TYR 892 N -2.59 1.14 -0.23 4.08 4.02 -1.26 -4.68 117.16 117.64 1wmg n TYR 892 Ca -0.00 -0.67 0.01 0.00 -0.01 0.00 0.00 57.90 57.23 1wmg n TYR 892 Cb 0.17 -0.23 0.09 0.00 -0.02 0.00 0.00 39.34 39.35 1wmg n TYR 892 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1wmg h LEU 893 N 2.97 -0.53 -0.96 7.72 5.85 -1.87 -0.95 115.31 127.55 1wmg h LEU 893 Ca 0.00 0.20 0.17 0.00 0.84 0.00 0.00 57.88 59.08 1wmg h LEU 893 Cb 1.32 0.39 -0.10 0.00 0.37 0.00 0.00 40.66 42.64 1wmg h LEU 893 CO 0.20 -0.20 0.56 0.78 -0.34 0.00 0.00 178.44 179.43 1wmg h ASN 894 N 0.03 0.72 0.76 1.25 -0.26 -1.86 -2.41 115.58 113.82 1wmg h ASN 894 Ca 0.34 0.09 -0.04 0.00 -0.56 0.00 0.00 56.30 56.13 1wmg h ASN 894 Cb 0.54 -0.04 0.01 0.00 -1.06 0.00 0.00 38.32 37.77 1wmg h ASN 894 CO -0.67 0.29 -0.36 0.22 -1.06 0.00 0.00 177.43 175.85 1wmg h TYR 895 N 0.75 -0.94 -0.90 1.19 3.20 -1.53 -3.18 116.97 115.56 1wmg h TYR 895 Ca 0.53 -0.02 0.21 0.00 3.14 0.00 0.00 58.73 62.59 1wmg h TYR 895 Cb 0.76 0.31 -0.12 0.00 1.54 0.00 0.00 36.73 39.22 1wmg h TYR 895 CO -0.03 -0.57 0.43 0.74 -1.64 0.00 0.00 178.16 177.09 1wmg h PHE 896 N -1.17 0.72 0.00 -3.82 0.04 -1.31 0.46 116.94 111.86 1wmg h PHE 896 Ca -0.10 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1wmg h PHE 896 Cb 0.80 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.77 1wmg h PHE 896 CO -0.00 0.00 0.08 0.00 -0.60 0.00 0.00 178.31 177.79 1wmg h ALA 897 N 1.69 1.07 0.00 2.45 0.00 -1.42 -0.90 119.26 122.15 1wmg h ALA 897 Ca 0.56 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 55.29 1wmg h ALA 897 Cb 1.02 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1wmg h ALA 897 CO -0.50 -0.07 -0.85 1.15 0.00 0.00 0.00 179.25 178.99 1wmg h THR 898 N 0.00 1.47 -4.23 0.00 2.02 -0.10 -3.47 112.91 108.60 1wmg h THR 898 Ca 0.00 -3.06 -0.51 0.00 0.77 0.00 0.00 66.41 63.62 1wmg h THR 898 Cb 0.17 2.71 0.06 0.00 -1.74 0.00 0.00 68.15 69.35 1wmg h THR 898 CO 0.00 0.83 0.36 -0.54 0.37 0.00 0.00 175.52 176.55 1wmg s LYS 899 N -2.81 3.53 0.19 6.66 -0.14 -0.34 -4.98 119.74 121.85 1wmg s LYS 899 Ca 0.02 0.63 -0.08 0.00 -1.36 0.00 0.00 55.97 55.18 1wmg s LYS 899 Cb 0.09 -2.13 0.09 0.00 -1.68 0.00 0.00 37.83 34.21 1wmg s LYS 899 CO 0.80 -0.54 1.61 0.00 -0.76 0.00 0.00 175.35 176.46 1wmg h ALA 900 N -0.25 0.81 -3.17 5.17 0.00 -1.91 -3.36 119.26 116.56 1wmg h ALA 900 Ca -0.45 -0.35 -0.62 0.00 0.00 0.00 0.00 54.91 53.49 1wmg h ALA 900 Cb 1.20 -0.19 -0.40 0.00 0.00 0.00 0.00 17.79 18.40 1wmg h ALA 900 CO 0.62 0.66 -0.71 0.45 0.00 0.00 0.00 179.25 180.27 1wmg s SER 901 N -6.68 3.95 0.26 0.00 0.15 -1.26 -4.99 113.70 105.14 1wmg s SER 901 Ca -0.11 -2.61 -0.04 0.00 0.70 0.00 0.00 55.95 53.89 1wmg s SER 901 Cb 0.13 -1.23 0.32 0.00 -1.71 0.00 0.00 66.02 63.52 1wmg s SER 901 CO 0.86 -0.28 1.84 1.55 1.20 0.00 0.00 173.24 178.41 1wmg h PRO 902 N 6.85 1.03 -0.49 5.44 0.13 -1.74 -2.19 132.00 141.04 1wmg h PRO 902 Ca -0.04 -0.17 -0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1wmg h PRO 902 Cb 0.93 -0.18 -0.02 0.00 0.13 0.00 0.00 31.00 31.86 1wmg h PRO 902 CO 0.54 0.83 0.29 1.15 -0.23 0.00 0.00 178.00 180.58 1wmg h THR 903 N 1.02 1.14 -0.44 1.56 2.02 -1.91 -0.62 112.91 115.67 1wmg h THR 903 Ca 0.24 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 1wmg h THR 903 Cb 0.17 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 1wmg h THR 903 CO -0.02 0.14 0.21 1.23 0.37 0.00 0.00 175.52 177.45 1wmg h GLY 904 N 0.70 0.68 1.01 2.16 0.00 -1.78 -0.01 103.07 105.82 1wmg h GLY 904 Ca 0.18 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 47.12 1wmg h GLY 904 CO -0.03 0.33 0.19 -2.08 0.00 0.00 0.00 176.54 174.94 1wmg h VAL 905 N 0.57 1.24 -0.14 4.60 2.07 -1.10 -0.42 116.25 123.08 1wmg h VAL 905 Ca 0.15 -0.82 0.01 0.00 0.82 0.00 0.00 66.70 66.86 1wmg h VAL 905 Cb 0.13 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1wmg h VAL 905 CO -0.02 0.31 0.05 0.40 0.02 0.00 0.00 177.57 178.34 1wmg h ILE 906 N 0.85 0.98 -0.85 4.57 2.04 -0.79 -1.17 117.51 123.14 1wmg h ILE 906 Ca 0.19 -0.04 0.02 0.00 1.00 0.00 0.00 64.86 66.03 1wmg h ILE 906 Cb 0.28 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1wmg h ILE 906 CO -0.01 0.02 0.56 -0.07 0.00 0.00 0.00 178.15 178.66 1wmg h LEU 907 N 0.13 0.95 -0.11 1.44 3.38 -0.73 0.52 115.31 120.89 1wmg h LEU 907 Ca 0.06 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1wmg h LEU 907 Cb 0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1wmg h LEU 907 CO -0.06 0.67 0.03 0.44 0.09 0.00 0.00 178.44 179.62 1wmg h ASP 908 N 1.11 0.03 -0.82 -0.43 3.32 -0.29 0.24 116.42 119.59 1wmg h ASP 908 Ca 0.32 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.35 1wmg h ASP 908 Cb -0.07 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 1wmg h ASP 908 CO -0.08 0.04 0.39 -0.07 -1.72 0.00 0.00 179.24 177.80 1wmg h LEU 909 N 0.09 1.08 -0.64 1.55 3.38 -0.75 0.10 115.31 120.11 1wmg h LEU 909 Ca 0.05 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1wmg h LEU 909 Cb 0.03 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1wmg h LEU 909 CO -0.05 0.92 0.20 -0.25 0.09 0.00 0.00 178.44 179.34 1wmg h TRP 910 N 1.18 1.03 -0.59 1.13 7.01 -0.36 -2.24 115.95 123.11 1wmg h TRP 910 Ca 0.28 -0.10 -0.10 0.00 2.11 0.00 0.00 58.89 61.08 1wmg h TRP 910 Cb 0.12 -0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 26.87 1wmg h TRP 910 CO 0.02 0.84 -0.01 0.93 -2.79 0.00 0.00 178.44 177.42 1wmg h GLU 911 N 0.92 1.05 -0.95 2.65 5.08 -0.08 -3.17 114.58 120.06 1wmg h GLU 911 Ca 0.21 -0.34 0.04 0.00 -1.00 0.00 0.00 59.36 58.27 1wmg h GLU 911 Cb 0.29 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.39 1wmg h GLU 911 CO -0.01 1.03 0.62 0.00 -1.00 0.00 0.00 179.01 179.65 1wmg h ALA 912 N 0.98 1.27 -0.11 3.43 0.00 -0.57 -2.53 119.26 121.73 1wmg h ALA 912 Ca 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1wmg h ALA 912 Cb 0.57 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1wmg h ALA 912 CO 0.03 0.48 0.00 2.89 0.00 0.00 0.00 179.25 182.65 1wmg n ARG 913 N -4.49 1.46 -2.35 0.00 1.85 -0.88 -4.85 116.66 107.40 1wmg n ARG 913 Ca 0.13 -0.69 -0.40 0.00 -1.00 0.00 0.00 57.85 55.88 1wmg n ARG 913 Cb 0.11 -1.33 -0.04 0.00 -1.05 0.00 0.00 32.46 30.15 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 -1.85 4.54 0.00 2.89 -1.52 -0.95 -5.04 119.66 117.72 1wmg s GLN 914 Ca 0.29 1.95 0.00 0.00 -1.95 0.00 0.00 55.36 55.65 1wmg s GLN 914 Cb 0.15 -3.15 0.00 0.00 -0.22 0.00 0.00 33.01 29.79 1wmg s GLN 914 CO 0.23 0.07 0.00 1.04 -0.25 0.00 0.00 175.29 176.38 1wmg n GLN 915 N 1.05 1.04 0.26 2.91 1.13 -1.26 -4.33 117.38 118.19 1wmg n GLN 915 Ca -0.01 0.00 -0.15 0.00 -1.94 0.00 0.00 57.00 54.91 1wmg n GLN 915 Cb 0.44 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.71 1wmg n GLN 915 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 1wmg h ASP 916 N 0.00 -0.57 0.00 1.08 3.45 -1.97 -2.90 116.42 115.51 1wmg h ASP 916 Ca 0.00 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.39 1wmg h ASP 916 Cb 0.00 0.15 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 1wmg h ASP 916 CO 0.00 -0.24 0.07 -0.67 -1.57 0.00 0.00 179.24 176.83 1wmg n ASP 917 N -5.29 0.00 0.00 6.45 -0.08 -1.26 -4.85 116.55 111.52 1wmg n ASP 917 Ca -0.11 0.13 0.00 0.00 -1.51 0.00 0.00 54.79 53.30 1wmg n ASP 917 Cb 0.32 -0.13 0.00 0.00 2.34 0.00 0.00 41.12 43.65 1wmg n ASP 917 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1wmg n GLY 918 N -1.03 0.00 3.01 0.27 0.00 -1.10 -4.94 105.19 101.41 1wmg n GLY 918 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1wmg n GLY 918 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wmg s ASP 919 N 0.00 1.03 0.00 1.61 3.68 -1.26 -4.96 116.67 116.77 1wmg s ASP 919 Ca 0.00 -0.16 0.04 0.00 2.13 0.00 0.00 52.55 54.56 1wmg s ASP 919 Cb 0.00 -0.15 0.21 0.00 -1.45 0.00 0.00 42.92 41.53 1wmg s ASP 919 CO 0.00 0.09 0.92 0.18 0.13 0.00 0.00 175.17 176.49 1wmg n LEU 920 N 2.97 0.00 -0.17 -1.34 4.77 -1.26 -3.92 117.00 118.05 1wmg n LEU 920 Ca -0.14 0.24 -0.10 0.00 -0.03 0.00 0.00 56.01 55.97 1wmg n LEU 920 Cb 0.56 -0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 1wmg n LEU 920 CO 0.25 -0.21 0.56 -1.13 -1.33 0.00 0.00 177.39 175.53 1wmg h ASN 921 N 0.00 -1.54 -0.30 -1.43 -0.73 -1.98 0.23 115.58 109.83 1wmg h ASN 921 Ca 0.00 0.24 0.04 0.00 1.87 0.00 0.00 56.30 58.44 1wmg h ASN 921 Cb 0.03 0.68 -0.02 0.00 0.27 0.00 0.00 38.32 39.28 1wmg h ASN 921 CO 0.00 -0.36 0.20 0.77 -0.37 0.00 0.00 177.43 177.68 1wmg h SER 922 N -0.29 0.22 -0.05 1.15 4.64 -2.00 0.30 113.55 117.52 1wmg h SER 922 Ca 0.14 -0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.39 1wmg h SER 922 Cb 0.58 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1wmg h SER 922 CO -0.63 0.15 -0.26 0.25 -0.87 0.00 0.00 176.83 175.47 1wmg h LEU 923 N 0.26 0.32 -0.68 5.97 5.85 -1.37 -2.36 115.31 123.28 1wmg h LEU 923 Ca 0.13 -0.66 -0.01 0.00 0.84 0.00 0.00 57.88 58.17 1wmg h LEU 923 Cb 0.19 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1wmg h LEU 923 CO -0.03 0.92 0.37 0.00 -0.34 0.00 0.00 178.44 179.37 1wmg h ALA 924 N 0.40 0.87 -0.90 1.25 0.00 -0.00 -1.62 119.26 119.26 1wmg h ALA 924 Ca -0.02 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1wmg h ALA 924 Cb 0.92 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1wmg h ALA 924 CO 0.05 0.39 0.59 1.03 0.00 0.00 0.00 179.25 181.31 1wmg h SER 925 N 0.93 1.00 -0.25 0.00 0.87 -0.44 0.91 113.55 116.57 1wmg h SER 925 Ca 0.24 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.76 1wmg h SER 925 Cb 0.05 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 1wmg h SER 925 CO -0.04 0.70 0.08 0.00 -0.53 0.00 0.00 176.83 177.04 1wmg h ALA 926 N 1.35 0.33 -0.68 6.23 0.00 -0.95 -2.12 119.26 123.42 1wmg h ALA 926 Ca 0.34 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.15 1wmg h ALA 926 Cb -0.07 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 1wmg h ALA 926 CO -0.10 -0.04 0.41 -0.07 0.00 0.00 0.00 179.25 179.46 1wmg h LEU 927 N 0.24 0.65 -0.34 0.00 3.38 -0.72 -2.79 115.31 115.74 1wmg h LEU 927 Ca 0.08 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.08 1wmg h LEU 927 Cb 0.25 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1wmg h LEU 927 CO -0.00 0.44 0.18 -0.08 0.09 0.00 0.00 178.44 179.08 1wmg h GLU 928 N 0.79 0.37 -2.37 1.13 4.22 -0.55 -2.79 114.58 115.37 1wmg h GLU 928 Ca 0.28 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 59.68 1wmg h GLU 928 Cb 0.07 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1wmg h GLU 928 CO -0.13 0.24 0.15 0.39 -2.18 0.00 0.00 179.01 177.49 1wmg n GLU 929 N -4.92 0.27 -2.72 1.92 1.02 -0.82 -4.04 120.64 111.35 1wmg n GLU 929 Ca -0.00 -0.09 -0.09 0.00 -0.02 0.00 0.00 57.16 56.96 1wmg n GLU 929 Cb 0.06 -1.49 0.06 0.00 -0.02 0.00 0.00 31.44 30.05 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 2.36 1.58 1.11 0.62 0.00 -1.16 -5.11 105.19 104.59 1wmg n GLY 931 Ca 0.04 -0.87 0.03 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.19 1.15 -0.12 1.61 4.76 -1.06 -4.87 118.16 119.45 1wmg n LYS 932 Ca 0.06 -2.90 0.26 0.00 -2.87 0.00 0.00 58.31 52.86 1wmg n LYS 932 Cb 0.81 -1.08 0.72 0.00 -1.84 0.00 0.00 35.03 33.64 1wmg n LYS 932 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1wmg h SER 933 N 1.14 0.00 0.00 4.39 4.64 -1.83 -1.85 113.55 120.05 1wmg h SER 933 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1wmg h SER 933 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1wmg h SER 933 CO 0.09 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.43 1wmg n GLU 934 N -4.21 0.31 0.00 4.77 -0.58 -1.26 -2.57 120.64 117.10 1wmg n GLU 934 Ca 0.16 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.90 1wmg n GLU 934 Cb 0.87 -1.22 0.00 0.00 -0.57 0.00 0.00 31.44 30.52 1wmg n GLU 934 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1wmg n LEU 936 N 0.50 0.00 0.25 -4.62 4.77 -0.70 -1.53 117.00 115.68 1wmg n LEU 936 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 1wmg n LEU 936 Cb 0.10 0.00 0.65 0.00 -2.33 0.00 0.00 43.42 41.84 1wmg n LEU 936 CO 0.00 0.00 0.96 0.58 -1.33 0.00 0.00 177.39 177.60 1wmg h VAL 937 N 0.00 0.82 0.00 4.08 2.07 -1.80 0.11 116.25 121.53 1wmg h VAL 937 Ca 0.00 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.01 1wmg h VAL 937 Cb 0.00 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1wmg h VAL 937 CO 0.00 0.13 0.00 0.00 0.02 0.00 0.00 177.57 177.72 1wmg n ALA 938 N -2.39 1.62 0.00 1.67 0.00 -0.58 -1.85 120.51 118.98 1wmg n ALA 938 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1wmg n ALA 938 Cb 0.22 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 0.64 0.00 1.09 0.00 0.00 0.37 -5.08 120.51 117.53 1wmg n ALA 940 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1wmg n ALA 940 Cb 0.11 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.07 1wmg n ALA 940 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91