#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkq s PHE 909 N 0.00 2.92 -0.07 0.00 0.08 -1.26 -5.03 117.98 114.63 2qkq s PHE 909 Ca 0.00 -0.10 0.21 0.00 0.12 0.00 0.00 56.93 57.16 2qkq s PHE 909 Cb 0.00 -2.52 0.54 0.00 -0.57 0.00 0.00 43.02 40.47 2qkq s PHE 909 CO 0.00 -0.60 1.66 0.78 -0.10 0.00 0.00 175.22 176.96 2qkq h GLY 910 N 0.34 0.00 -2.82 4.36 0.00 -2.02 -3.47 103.07 99.47 2qkq h GLY 910 Ca -0.42 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.92 2qkq h GLY 910 CO 0.51 0.00 0.24 -1.35 0.00 0.00 0.00 176.54 175.94 2qkq s SER 911 N -6.27 -0.48 0.31 0.19 1.04 -1.26 -5.02 113.70 102.21 2qkq s SER 911 Ca 0.03 -0.13 -0.01 0.00 0.48 0.00 0.00 55.95 56.33 2qkq s SER 911 Cb 0.08 0.61 0.50 0.00 0.10 0.00 0.00 66.02 67.31 2qkq s SER 911 CO 0.68 -1.01 1.96 0.58 0.98 0.00 0.00 173.24 176.43 2qkq h VAL 912 N 2.00 1.17 0.21 5.02 2.07 -1.91 -2.64 116.25 122.17 2qkq h VAL 912 Ca -0.30 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 66.87 2qkq h VAL 912 Cb 1.29 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2qkq h VAL 912 CO 0.34 0.19 -0.37 1.23 0.02 0.00 0.00 177.57 178.98 2qkq h GLY 913 N 1.05 -0.79 0.06 2.17 0.00 -1.94 -1.22 103.07 102.40 2qkq h GLY 913 Ca 0.31 0.44 0.12 0.00 0.00 0.00 0.00 47.33 48.21 2qkq h GLY 913 CO -0.08 -0.28 0.09 0.83 0.00 0.00 0.00 176.54 177.10 2qkq h GLU 914 N -0.66 0.20 0.30 4.80 5.08 -1.90 -0.86 114.58 121.53 2qkq h GLU 914 Ca 0.01 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2qkq h GLU 914 Cb 0.65 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 2qkq h GLU 914 CO -0.16 0.13 -0.24 2.35 -1.00 0.00 0.00 179.01 180.09 2qkq h TRP 915 N 0.20 -0.64 -0.71 4.33 7.01 -1.28 0.63 115.95 125.50 2qkq h TRP 915 Ca 0.33 -0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.39 2qkq h TRP 915 Cb 0.52 0.24 -0.05 0.00 -2.10 0.00 0.00 29.16 27.77 2qkq h TRP 915 CO -0.29 -0.36 0.41 -0.07 -2.79 0.00 0.00 178.44 175.34 2qkq h LEU 916 N -0.55 0.63 -0.68 0.65 3.38 -0.67 -0.97 115.31 117.09 2qkq h LEU 916 Ca -0.02 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 2qkq h LEU 916 Cb 0.49 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 2qkq h LEU 916 CO -0.02 0.41 0.16 0.03 0.09 0.00 0.00 178.44 179.11 2qkq h ARG 917 N 0.76 1.09 -0.78 1.13 3.08 -1.04 0.78 114.38 119.40 2qkq h ARG 917 Ca 0.31 -0.27 0.01 0.00 0.07 0.00 0.00 59.98 60.11 2qkq h ARG 917 Cb 0.17 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 2qkq h ARG 917 CO -0.17 0.97 0.51 0.00 -1.07 0.00 0.00 179.97 180.21 2qkq h ALA 918 N 1.07 0.99 -0.36 0.04 0.00 0.25 -1.80 119.26 119.45 2qkq h ALA 918 Ca 0.21 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 2qkq h ALA 918 Cb 0.38 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2qkq h ALA 918 CO 0.00 0.39 0.11 0.44 0.00 0.00 0.00 179.25 180.18 2qkq n ILE 919 N -4.55 1.64 -1.93 0.00 -5.35 -0.48 -4.86 119.36 103.83 2qkq n ILE 919 Ca 0.08 -0.80 -0.16 0.00 -0.27 0.00 0.00 62.75 61.60 2qkq n ILE 919 Cb 0.03 -0.50 -0.03 0.00 -1.74 0.00 0.00 39.64 37.40 2qkq n ILE 919 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2qkq n LYS 920 N 0.11 -1.20 -0.26 6.28 5.02 -0.68 -4.87 118.16 122.56 2qkq n LYS 920 Ca 0.19 0.90 0.08 0.00 -2.02 0.00 0.00 58.31 57.47 2qkq n LYS 920 Cb 0.85 -5.20 0.18 0.00 -0.02 0.00 0.00 35.03 30.84 2qkq n LYS 920 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 2qkq n MET 921 N -2.54 1.69 0.24 1.97 1.56 0.27 -4.75 117.12 115.57 2qkq n MET 921 Ca -0.18 -2.77 0.18 0.00 -0.27 0.00 0.00 57.70 54.66 2qkq n MET 921 Cb 0.59 -1.61 0.88 0.00 2.15 0.00 0.00 33.22 35.24 2qkq n MET 921 CO 0.00 0.00 0.00 0.78 -0.73 0.00 0.00 175.97 176.02 2qkq h GLY 922 N 0.56 0.00 1.59 -5.12 0.00 -1.69 -2.21 103.07 96.20 2qkq h GLY 922 Ca 0.01 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.39 2qkq h GLY 922 CO 0.07 0.00 0.16 0.07 0.00 0.00 0.00 176.54 176.84 2qkq h ARG 923 N 0.00 0.00 -0.54 4.80 0.11 -1.90 -1.94 114.38 114.91 2qkq h ARG 923 Ca 0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.14 2qkq h ARG 923 Cb 0.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 2qkq h ARG 923 CO -0.00 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.73 2qkq n TYR 924 N -3.98 0.76 0.03 4.08 4.01 -0.83 -4.59 117.16 116.64 2qkq n TYR 924 Ca 0.01 -0.37 -0.10 0.00 -0.16 0.00 0.00 57.90 57.28 2qkq n TYR 924 Cb 0.28 -0.02 -0.04 0.00 -0.31 0.00 0.00 39.34 39.25 2qkq n TYR 924 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 2qkq h GLU 925 N 3.10 -0.31 -0.62 -0.72 5.08 -1.53 -1.39 114.58 118.19 2qkq h GLU 925 Ca 0.00 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 2qkq h GLU 925 Cb 0.76 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.06 2qkq h GLU 925 CO 0.02 -0.21 0.11 0.93 -1.00 0.00 0.00 179.01 178.86 2qkq h GLU 926 N -0.32 0.99 -0.51 2.33 3.07 -1.84 -2.26 114.58 116.04 2qkq h GLU 926 Ca 0.08 -0.25 -0.01 0.00 -0.50 0.00 0.00 59.36 58.68 2qkq h GLU 926 Cb 0.44 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 2qkq h GLU 926 CO -0.25 0.91 0.27 0.77 -1.40 0.00 0.00 179.01 179.31 2qkq h SER 927 N 0.94 0.65 -0.27 1.42 0.02 -1.81 -0.94 113.55 113.55 2qkq h SER 927 Ca 0.19 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2qkq h SER 927 Cb 0.40 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2qkq h SER 927 CO 0.01 0.57 0.14 -0.26 -1.14 0.00 0.00 176.83 176.14 2qkq h PHE 928 N 0.68 0.38 -0.24 3.45 -1.00 -1.04 -2.33 116.94 116.83 2qkq h PHE 928 Ca 0.18 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.94 2qkq h PHE 928 Cb 0.07 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 39.50 2qkq h PHE 928 CO -0.01 0.33 0.12 0.00 -1.61 0.00 0.00 178.31 177.14 2qkq h ALA 929 N 1.01 0.31 0.00 2.45 0.00 -1.25 -0.93 119.26 120.85 2qkq h ALA 929 Ca 0.09 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2qkq h ALA 929 Cb 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2qkq h ALA 929 CO -0.01 -0.14 -0.40 0.00 0.00 0.00 0.00 179.25 178.70 2qkq h ALA 930 N 0.99 1.27 0.00 0.00 0.00 -1.19 -2.31 119.26 118.03 2qkq h ALA 930 Ca 0.08 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2qkq h ALA 930 Cb 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2qkq h ALA 930 CO -0.01 0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.74 2qkq n ALA 931 N -2.43 2.08 -0.73 0.00 0.00 -0.88 -4.93 120.51 113.63 2qkq n ALA 931 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2qkq n ALA 931 Cb 0.44 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.47 2qkq n ALA 931 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qkq n GLY 932 N 0.92 0.95 3.14 0.00 0.00 -0.87 -5.02 105.19 104.32 2qkq n GLY 932 Ca 0.05 -0.48 -0.44 0.00 0.00 0.00 0.00 46.02 45.15 2qkq n GLY 932 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qkq n PHE 933 N -2.47 3.62 0.53 1.61 3.72 -0.39 -4.75 117.46 119.33 2qkq n PHE 933 Ca 0.00 -3.13 0.06 0.00 -0.05 0.00 0.00 57.45 54.33 2qkq n PHE 933 Cb 0.12 -1.59 0.00 0.00 -0.94 0.00 0.00 39.48 37.07 2qkq n PHE 933 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qkq n GLY 934 N 2.24 -0.12 3.27 1.37 0.00 -1.26 -4.46 105.19 106.22 2qkq n GLY 934 Ca 0.28 -0.35 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 2qkq n GLY 934 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qkq s SER 935 N -1.51 2.21 0.46 1.61 1.04 -1.26 -4.65 113.70 111.61 2qkq s SER 935 Ca 0.10 -0.83 0.26 0.00 0.48 0.00 0.00 55.95 55.96 2qkq s SER 935 Cb 0.10 -0.09 0.95 0.00 0.10 0.00 0.00 66.02 67.07 2qkq s SER 935 CO 0.29 -0.11 1.83 -0.26 0.98 0.00 0.00 173.24 175.97 2qkq h PHE 936 N 3.41 0.00 -0.45 5.02 0.04 -1.98 -2.25 116.94 120.73 2qkq h PHE 936 Ca -0.40 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.40 2qkq h PHE 936 Cb 1.20 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.31 2qkq h PHE 936 CO 0.66 0.17 0.24 1.49 -0.60 0.00 0.00 178.31 180.27 2qkq h GLU 937 N 0.00 0.47 0.06 1.51 4.22 -1.99 0.48 114.58 119.32 2qkq h GLU 937 Ca -0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 59.36 59.41 2qkq h GLU 937 Cb 0.74 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2qkq h GLU 937 CO 0.02 0.31 -0.03 -0.07 -2.18 0.00 0.00 179.01 177.06 2qkq h LEU 938 N 0.48 -0.07 -2.16 1.64 3.38 -1.93 -3.28 115.31 113.38 2qkq h LEU 938 Ca 0.19 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 2qkq h LEU 938 Cb 0.07 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2qkq h LEU 938 CO -0.12 0.46 -0.05 -0.37 0.09 0.00 0.00 178.44 178.45 2qkq h VAL 939 N -0.62 0.70 0.00 1.22 -1.51 -1.32 -0.09 116.25 114.63 2qkq h VAL 939 Ca -0.01 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 65.27 2qkq h VAL 939 Cb 0.53 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 2qkq h VAL 939 CO 0.01 0.05 0.00 0.77 -1.23 0.00 0.00 177.57 177.17 2qkq h SER 940 N 0.00 0.00 -0.35 4.19 4.64 -0.95 -2.15 113.55 118.93 2qkq h SER 940 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qkq h SER 940 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2qkq h SER 940 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 2qkq n GLN 941 N -2.39 2.29 -1.86 4.77 6.02 -0.06 -4.96 117.38 121.19 2qkq n GLN 941 Ca 0.01 -2.04 -0.40 0.00 -0.01 0.00 0.00 57.00 54.56 2qkq n GLN 941 Cb 0.21 -1.37 0.00 0.00 1.02 0.00 0.00 30.24 30.10 2qkq n GLN 941 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 2qkq s ILE 942 N -1.13 2.18 0.44 5.09 2.07 -0.81 -5.04 121.20 124.00 2qkq s ILE 942 Ca 0.29 0.17 0.05 0.00 -1.41 0.00 0.00 60.65 59.76 2qkq s ILE 942 Cb 0.17 -3.11 -0.06 0.00 0.13 0.00 0.00 42.46 39.59 2qkq s ILE 942 CO 0.23 0.03 0.01 -0.94 -1.91 0.00 0.00 174.94 172.36 2qkq s SER 943 N -0.36 3.92 0.31 4.50 1.04 -1.26 -5.03 113.70 116.82 2qkq s SER 943 Ca 0.56 -1.47 0.03 0.00 0.48 0.00 0.00 55.95 55.55 2qkq s SER 943 Cb -0.44 -0.07 0.62 0.00 0.10 0.00 0.00 66.02 66.23 2qkq s SER 943 CO 0.58 -0.60 1.87 0.00 0.98 0.00 0.00 173.24 176.07 2qkq h ALA 944 N 1.63 1.61 -0.50 5.32 0.00 -1.96 -2.26 119.26 123.10 2qkq h ALA 944 Ca -0.44 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 2qkq h ALA 944 Cb 1.27 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2qkq h ALA 944 CO 0.78 0.18 0.12 1.49 0.00 0.00 0.00 179.25 181.81 2qkq h GLU 945 N 0.92 0.81 -0.37 0.00 4.81 -1.99 -0.59 114.58 118.16 2qkq h GLU 945 Ca 0.45 -0.20 0.03 0.00 -0.13 0.00 0.00 59.36 59.51 2qkq h GLU 945 Cb 0.48 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.72 2qkq h GLU 945 CO -0.22 0.78 0.18 -0.44 -0.73 0.00 0.00 179.01 178.59 2qkq h ASP 946 N 0.69 0.27 -0.73 1.04 3.32 -1.83 -1.12 116.42 118.07 2qkq h ASP 946 Ca 0.16 0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.27 2qkq h ASP 946 Cb 0.34 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.81 2qkq h ASP 946 CO 0.00 0.20 0.45 -0.07 -1.72 0.00 0.00 179.24 178.10 2qkq h LEU 947 N 0.38 0.71 -0.26 1.55 3.38 -1.12 0.20 115.31 120.15 2qkq h LEU 947 Ca 0.16 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2qkq h LEU 947 Cb 0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2qkq h LEU 947 CO -0.11 0.48 0.17 0.25 0.09 0.00 0.00 178.44 179.32 2qkq h LEU 948 N 0.85 0.30 -0.67 1.67 5.85 -0.74 0.24 115.31 122.81 2qkq h LEU 948 Ca 0.30 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 2qkq h LEU 948 Cb 0.08 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2qkq h LEU 948 CO -0.14 0.23 0.25 -0.09 -0.34 0.00 0.00 178.44 178.36 2qkq h ARG 949 N 0.35 1.02 -0.84 1.25 2.43 -0.53 -2.10 114.38 115.96 2qkq h ARG 949 Ca 0.10 -0.19 0.18 0.00 -0.81 0.00 0.00 59.98 59.25 2qkq h ARG 949 Cb -0.02 -0.16 -0.06 0.00 -0.42 0.00 0.00 29.97 29.31 2qkq h ARG 949 CO -0.02 0.86 0.56 0.82 -1.51 0.00 0.00 179.97 180.68 2qkq h ILE 950 N 0.96 0.73 0.00 1.20 2.04 -0.40 -3.45 117.51 118.59 2qkq h ILE 950 Ca 0.22 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.94 2qkq h ILE 950 Cb 0.23 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 2qkq h ILE 950 CO -0.02 0.08 0.00 0.61 0.00 0.00 0.00 178.15 178.82 2qkq n GLY 951 N -1.52 1.60 3.48 5.37 0.00 -0.79 -4.81 105.19 108.52 2qkq n GLY 951 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2qkq n GLY 951 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qkq s VAL 952 N -2.00 4.54 -0.20 1.61 1.01 0.78 -4.85 120.40 121.29 2qkq s VAL 952 Ca 0.00 -1.43 0.16 0.00 0.00 0.00 0.00 61.98 60.71 2qkq s VAL 952 Cb 0.00 -4.86 0.09 0.00 0.00 0.00 0.00 36.38 31.61 2qkq s VAL 952 CO 0.00 -1.63 1.42 0.71 0.00 0.00 0.00 175.10 175.60 2qkq h THR 953 N 6.01 0.69 -3.34 3.92 1.35 -1.87 -3.35 112.91 116.32 2qkq h THR 953 Ca 0.18 -1.99 -0.58 0.00 -0.55 0.00 0.00 66.41 63.47 2qkq h THR 953 Cb 1.01 2.31 -0.07 0.00 -1.73 0.00 0.00 68.15 69.67 2qkq h THR 953 CO 1.20 0.39 0.30 -0.76 -0.25 0.00 0.00 175.52 176.40 2qkq s LEU 954 N -6.35 4.18 0.37 3.87 1.43 -1.26 -4.94 118.68 115.98 2qkq s LEU 954 Ca 0.04 1.10 0.06 0.00 -1.03 0.00 0.00 54.13 54.30 2qkq s LEU 954 Cb 0.07 -3.14 0.72 0.00 0.03 0.00 0.00 46.19 43.87 2qkq s LEU 954 CO 0.74 -0.34 1.95 0.00 0.23 0.00 0.00 176.35 178.93 2qkq h ALA 955 N 7.31 1.52 -0.77 4.21 0.00 -1.99 -1.11 119.26 128.43 2qkq h ALA 955 Ca -0.31 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.51 2qkq h ALA 955 Cb 1.14 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 2qkq h ALA 955 CO 0.81 0.36 0.47 0.78 0.00 0.00 0.00 179.25 181.68 2qkq h GLY 956 N 0.71 1.13 1.23 0.00 0.00 -1.98 0.18 103.07 104.33 2qkq h GLY 956 Ca 0.12 -0.35 -0.16 0.00 0.00 0.00 0.00 47.33 46.94 2qkq h GLY 956 CO -0.01 0.27 -0.42 0.45 0.00 0.00 0.00 176.54 176.83 2qkq h HIS 957 N 0.90 1.01 -0.19 5.60 3.86 -1.69 -2.32 115.15 122.32 2qkq h HIS 957 Ca 0.32 -0.31 0.03 0.00 -1.16 0.00 0.00 60.37 59.25 2qkq h HIS 957 Cb 0.08 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.32 2qkq h HIS 957 CO -0.04 1.11 0.00 1.96 0.86 0.00 0.00 177.93 181.82 2qkq h GLN 958 N 0.67 0.06 -0.43 2.45 4.20 -0.72 -1.19 115.11 120.16 2qkq h GLN 958 Ca 0.05 -0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.80 2qkq h GLN 958 Cb 1.00 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.72 2qkq h GLN 958 CO 0.10 0.04 0.16 0.87 -0.67 0.00 0.00 178.83 179.33 2qkq h LYS 959 N 0.06 0.33 -0.49 1.46 1.79 -0.62 0.25 116.57 119.36 2qkq h LYS 959 Ca 0.09 -0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.49 2qkq h LYS 959 Cb 0.11 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.66 2qkq h LYS 959 CO -0.15 0.22 0.12 -0.22 -1.08 0.00 0.00 179.45 178.34 2qkq h LYS 960 N 0.34 0.78 -0.10 3.15 3.64 -1.19 0.21 116.57 123.41 2qkq h LYS 960 Ca 0.20 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2qkq h LYS 960 Cb 0.17 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2qkq h LYS 960 CO -0.19 0.76 -0.00 0.82 -2.27 0.00 0.00 179.45 178.57 2qkq h ILE 961 N 0.67 1.25 -0.28 2.00 2.04 -0.97 -2.19 117.51 120.03 2qkq h ILE 961 Ca 0.15 -0.81 -0.05 0.00 1.00 0.00 0.00 64.86 65.15 2qkq h ILE 961 Cb 0.33 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 2qkq h ILE 961 CO 0.00 0.23 -0.05 -0.07 0.00 0.00 0.00 178.15 178.27 2qkq h LEU 962 N -0.11 0.41 -0.84 1.44 3.38 -0.22 -1.89 115.31 117.48 2qkq h LEU 962 Ca 0.03 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 2qkq h LEU 962 Cb 0.36 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2qkq h LEU 962 CO 0.01 0.51 -0.51 0.00 0.09 0.00 0.00 178.44 178.54 2qkq h ALA 963 N 1.54 1.02 -0.24 1.53 0.00 -0.57 -1.86 119.26 120.68 2qkq h ALA 963 Ca 0.09 -0.48 -0.14 0.00 0.00 0.00 0.00 54.91 54.38 2qkq h ALA 963 Cb 0.35 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2qkq h ALA 963 CO 0.01 0.66 -0.40 1.03 0.00 0.00 0.00 179.25 180.55 2qkq h SER 964 N 0.15 0.77 0.90 0.00 0.87 -0.70 -3.10 113.55 112.44 2qkq h SER 964 Ca 0.00 -0.53 -0.11 0.00 -1.23 0.00 0.00 61.79 59.93 2qkq h SER 964 Cb 0.95 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.67 2qkq h SER 964 CO 0.08 1.15 -0.51 -0.37 -0.53 0.00 0.00 176.83 176.65 2qkq h VAL 965 N 0.42 1.09 -0.77 2.23 -1.51 -1.40 -3.23 116.25 113.08 2qkq h VAL 965 Ca 0.02 -1.94 0.22 0.00 -1.23 0.00 0.00 66.70 63.78 2qkq h VAL 965 Cb 1.00 2.13 -0.03 0.00 -2.13 0.00 0.00 31.29 32.26 2qkq h VAL 965 CO 0.09 0.50 0.83 -0.61 -1.23 0.00 0.00 177.57 177.15 2qkq h GLN 966 N 0.00 0.00 -5.66 5.19 4.15 -1.25 -3.26 115.11 114.28 2qkq h GLN 966 Ca -0.01 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.10 2qkq h GLN 966 Cb 1.09 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.74 2qkq h GLN 966 CO 0.07 0.00 0.86 -1.01 -1.93 0.00 0.00 178.83 176.82 2qkq s HIS 967 N -4.56 1.88 0.00 3.99 3.76 -1.22 -5.10 115.29 114.04 2qkq s HIS 967 Ca -0.04 0.52 0.00 0.00 -0.15 0.00 0.00 55.06 55.39 2qkq s HIS 967 Cb 0.16 -4.06 0.00 0.00 1.11 0.00 0.00 32.58 29.79 2qkq s HIS 967 CO 0.54 -1.60 0.00 0.00 -0.85 0.00 0.00 174.74 172.82