#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9j h ALA 958 N 0.00 1.14 -0.66 4.61 0.00 -2.07 -2.68 119.26 119.60 2k9j h ALA 958 Ca 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2k9j h ALA 958 Cb 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2k9j h ALA 958 CO 0.00 0.59 0.29 -0.07 0.00 0.00 0.00 179.25 180.06 2k9j h LEU 959 N 0.93 0.89 -9.77 0.00 3.38 -2.09 -3.42 115.31 105.23 2k9j h LEU 959 Ca 0.21 -0.15 -0.52 0.00 0.09 0.00 0.00 57.88 57.50 2k9j h LEU 959 Cb 0.28 -0.23 0.05 0.00 0.09 0.00 0.00 40.66 40.85 2k9j h LEU 959 CO -0.01 0.79 0.67 -1.61 0.09 0.00 0.00 178.44 178.38 2k9j s GLU 960 N -5.62 4.35 0.25 1.13 0.41 -1.01 -4.96 118.70 113.25 2k9j s GLU 960 Ca -0.13 2.17 -0.30 0.00 -0.41 0.00 0.00 54.97 56.30 2k9j s GLU 960 Cb 0.14 -3.13 -0.10 0.00 -1.78 0.00 0.00 34.13 29.26 2k9j s GLU 960 CO 0.80 -0.26 1.36 -1.21 -0.49 0.00 0.00 175.26 175.47 2k9j s GLU 961 N -0.79 4.33 0.19 1.61 0.41 -1.26 -4.82 118.70 118.37 2k9j s GLU 961 Ca 0.54 2.19 -0.09 0.00 -0.41 0.00 0.00 54.97 57.20 2k9j s GLU 961 Cb -0.39 -3.13 0.11 0.00 -1.78 0.00 0.00 34.13 28.94 2k9j s GLU 961 CO 0.45 -0.31 1.72 0.00 -0.49 0.00 0.00 175.26 176.62 2k9j h ARG 962 N 4.85 1.10 -6.93 1.61 3.08 -1.91 -3.43 114.38 112.74 2k9j h ARG 962 Ca -0.46 -0.25 -0.51 0.00 0.07 0.00 0.00 59.98 58.83 2k9j h ARG 962 Cb 1.22 -0.15 0.06 0.00 0.08 0.00 0.00 29.97 31.17 2k9j h ARG 962 CO 0.75 0.96 0.52 0.00 -1.07 0.00 0.00 179.97 181.14 2k9j s ALA 963 N -5.36 3.19 -0.28 0.04 0.00 -1.26 -4.97 121.76 113.13 2k9j s ALA 963 Ca -0.12 1.02 0.20 0.00 0.00 0.00 0.00 51.96 53.06 2k9j s ALA 963 Cb 0.14 -3.40 0.48 0.00 0.00 0.00 0.00 23.12 20.35 2k9j s ALA 963 CO 0.84 -0.56 1.23 0.44 0.00 0.00 0.00 175.76 177.70 2k9j n ILE 964 N 0.15 0.93 0.29 0.00 -5.35 -1.26 -4.92 119.36 109.19 2k9j n ILE 964 Ca 0.04 -2.40 0.17 0.00 -0.27 0.00 0.00 62.75 60.29 2k9j n ILE 964 Cb 0.46 1.22 0.83 0.00 -1.74 0.00 0.00 39.64 40.41 2k9j n ILE 964 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 2k9j h PRO 965 N 2.17 0.00 -0.51 6.28 0.13 -1.99 -3.04 132.00 135.04 2k9j h PRO 965 Ca -0.22 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.87 2k9j h PRO 965 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 2k9j h PRO 965 CO 0.08 0.05 0.18 0.82 -0.23 0.00 0.00 178.00 178.90 2k9j h ILE 966 N 0.00 1.22 -0.72 -3.56 2.04 -2.00 -2.06 117.51 112.43 2k9j h ILE 966 Ca -0.00 -0.72 -0.02 0.00 1.00 0.00 0.00 64.86 65.12 2k9j h ILE 966 Cb 0.34 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 2k9j h ILE 966 CO 0.01 0.27 0.37 -0.50 0.00 0.00 0.00 178.15 178.30 2k9j h TRP 967 N 0.69 1.01 -0.77 1.37 4.06 -1.95 -1.09 115.95 119.27 2k9j h TRP 967 Ca 0.17 -0.04 -0.03 0.00 2.06 0.00 0.00 58.89 61.05 2k9j h TRP 967 Cb 0.24 -0.32 -0.03 0.00 -1.00 0.00 0.00 29.16 28.04 2k9j h TRP 967 CO 0.01 0.73 0.35 -1.49 -3.56 0.00 0.00 178.44 174.48 2k9j h TRP 968 N 1.00 1.13 -0.44 0.49 4.06 -1.61 -1.38 115.95 119.20 2k9j h TRP 968 Ca 0.25 -0.06 -0.04 0.00 2.06 0.00 0.00 58.89 61.10 2k9j h TRP 968 Cb 0.07 -0.35 -0.02 0.00 -1.00 0.00 0.00 29.16 27.87 2k9j h TRP 968 CO 0.00 0.84 0.13 0.28 -3.56 0.00 0.00 178.44 176.13 2k9j h VAL 969 N 1.10 1.22 -0.78 1.49 2.07 -0.97 -2.07 116.25 118.32 2k9j h VAL 969 Ca 0.26 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 2k9j h VAL 969 Cb 0.15 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 2k9j h VAL 969 CO -0.03 0.27 0.40 -0.07 0.02 0.00 0.00 177.57 178.16 2k9j h LEU 970 N 0.57 1.00 -0.45 2.57 3.38 -0.92 -1.37 115.31 120.08 2k9j h LEU 970 Ca 0.14 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2k9j h LEU 970 Cb 0.28 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2k9j h LEU 970 CO -0.00 0.83 0.24 0.58 0.09 0.00 0.00 178.44 180.17 2k9j h VAL 971 N 1.09 1.17 -0.76 1.22 2.07 -1.07 -0.91 116.25 119.07 2k9j h VAL 971 Ca 0.27 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 2k9j h VAL 971 Cb 0.07 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2k9j h VAL 971 CO -0.04 0.18 0.37 1.23 0.02 0.00 0.00 177.57 179.34 2k9j h GLY 972 N 0.59 1.16 0.95 2.17 0.00 -1.03 -1.18 103.07 105.74 2k9j h GLY 972 Ca 0.16 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 2k9j h GLY 972 CO -0.02 0.54 0.15 -2.08 0.00 0.00 0.00 176.54 175.13 2k9j h VAL 973 N 1.06 1.22 -0.65 4.60 2.07 -0.96 -1.28 116.25 122.31 2k9j h VAL 973 Ca 0.26 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 2k9j h VAL 973 Cb 0.10 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 2k9j h VAL 973 CO -0.03 0.26 0.34 0.25 0.02 0.00 0.00 177.57 178.40 2k9j h LEU 974 N 0.59 0.83 -0.76 2.57 5.85 -0.87 -1.18 115.31 122.33 2k9j h LEU 974 Ca 0.15 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2k9j h LEU 974 Cb 0.25 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2k9j h LEU 974 CO -0.01 0.70 0.32 1.23 -0.34 0.00 0.00 178.44 180.35 2k9j h GLY 975 N 0.89 1.21 1.07 3.75 0.00 -1.00 -1.79 103.07 107.20 2k9j h GLY 975 Ca 0.23 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.86 2k9j h GLY 975 CO -0.03 0.61 0.24 -1.33 0.00 0.00 0.00 176.54 176.02 2k9j h GLY 976 N 1.09 1.25 1.04 4.60 0.00 -0.82 -2.28 103.07 107.96 2k9j h GLY 976 Ca 0.26 -0.74 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 2k9j h GLY 976 CO -0.02 0.69 0.31 1.41 0.00 0.00 0.00 176.54 178.93 2k9j h LEU 977 N 1.12 1.06 -0.75 3.11 3.38 -0.86 -2.39 115.31 119.97 2k9j h LEU 977 Ca 0.24 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2k9j h LEU 977 Cb 0.30 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2k9j h LEU 977 CO -0.01 0.94 0.41 0.25 0.09 0.00 0.00 178.44 180.13 2k9j h LEU 978 N 1.12 0.94 -0.49 1.67 5.85 -0.97 -0.60 115.31 122.83 2k9j h LEU 978 Ca 0.26 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2k9j h LEU 978 Cb 0.21 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2k9j h LEU 978 CO -0.02 0.77 0.28 0.25 -0.34 0.00 0.00 178.44 179.37 2k9j h LEU 979 N 1.04 0.61 -0.57 2.25 6.46 -1.06 -0.19 115.31 123.86 2k9j h LEU 979 Ca 0.27 -0.09 -0.04 0.00 -0.12 0.00 0.00 57.88 57.90 2k9j h LEU 979 Cb 0.03 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 39.78 2k9j h LEU 979 CO -0.04 0.52 0.21 0.25 -0.62 0.00 0.00 178.44 178.76 2k9j h LEU 980 N 0.66 0.80 -0.40 2.25 5.85 -1.08 -1.96 115.31 121.43 2k9j h LEU 980 Ca 0.17 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2k9j h LEU 980 Cb 0.04 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2k9j h LEU 980 CO -0.03 0.76 0.18 0.74 -0.34 0.00 0.00 178.44 179.75 2k9j h THR 981 N 0.79 1.18 -0.45 1.05 2.02 -0.77 -1.16 112.91 115.57 2k9j h THR 981 Ca 0.19 -0.54 -0.03 0.00 0.77 0.00 0.00 66.41 66.80 2k9j h THR 981 Cb 0.22 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2k9j h THR 981 CO -0.01 0.20 0.17 0.40 0.37 0.00 0.00 175.52 176.64 2k9j h ILE 982 N 0.50 1.21 -0.54 3.11 2.04 -0.91 0.69 117.51 123.61 2k9j h ILE 982 Ca 0.13 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 2k9j h ILE 982 Cb 0.15 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 2k9j h ILE 982 CO -0.01 0.25 0.23 0.25 0.00 0.00 0.00 178.15 178.86 2k9j h LEU 983 N 0.59 0.74 -0.42 1.44 5.85 -1.25 -1.43 115.31 120.83 2k9j h LEU 983 Ca 0.15 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 2k9j h LEU 983 Cb 0.22 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 2k9j h LEU 983 CO -0.01 0.69 0.11 0.58 -0.34 0.00 0.00 178.44 179.47 2k9j h VAL 984 N 0.74 1.23 -0.63 1.05 2.07 -1.01 -2.50 116.25 117.19 2k9j h VAL 984 Ca 0.18 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 2k9j h VAL 984 Cb 0.17 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 2k9j h VAL 984 CO -0.02 0.27 0.32 0.25 0.02 0.00 0.00 177.57 178.41 2k9j h LEU 985 N 0.54 0.81 -0.48 2.57 6.46 -0.67 -0.05 115.31 124.49 2k9j h LEU 985 Ca 0.13 -0.12 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 2k9j h LEU 985 Cb 0.30 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.00 2k9j h LEU 985 CO 0.00 0.70 0.26 0.00 -0.62 0.00 0.00 178.44 178.78 2k9j h ALA 986 N 1.14 0.61 -0.63 1.25 0.00 -1.16 0.11 119.26 120.59 2k9j h ALA 986 Ca 0.22 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 2k9j h ALA 986 Cb 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2k9j h ALA 986 CO -0.03 0.14 0.13 0.52 0.00 0.00 0.00 179.25 180.01 2k9j h MET 987 N 0.63 1.02 -0.81 0.00 2.86 -1.22 -0.72 114.93 116.70 2k9j h MET 987 Ca 0.17 -0.26 -0.03 0.00 -2.06 0.00 0.00 59.70 57.52 2k9j h MET 987 Cb 0.06 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 31.56 2k9j h MET 987 CO -0.03 0.94 0.39 2.35 1.06 0.00 0.00 176.91 181.62 2k9j h TRP 988 N 0.94 1.16 0.00 -0.22 7.01 -0.63 -1.16 115.95 123.05 2k9j h TRP 988 Ca 0.19 -0.06 0.00 0.00 2.11 0.00 0.00 58.89 61.14 2k9j h TRP 988 Cb 0.39 -0.36 0.00 0.00 -2.10 0.00 0.00 29.16 27.09 2k9j h TRP 988 CO 0.03 0.85 0.00 1.63 -2.79 0.00 0.00 178.44 178.15 2k9j n LYS 989 N -4.35 0.09 0.08 2.65 4.76 0.35 -2.51 118.16 119.23 2k9j n LYS 989 Ca 0.08 0.16 0.12 0.00 -2.87 0.00 0.00 58.31 55.80 2k9j n LYS 989 Cb 0.14 -1.62 0.10 0.00 -1.84 0.00 0.00 35.03 31.81 2k9j n LYS 989 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2k9j h VAL 990 N 0.00 0.00 0.00 -0.18 2.07 0.11 -3.47 116.25 114.77 2k9j h VAL 990 Ca 0.00 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.85 2k9j h VAL 990 Cb 0.48 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 2k9j h VAL 990 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 2k9j n GLY 991 N 1.28 0.55 0.28 2.17 0.00 -0.93 -4.93 105.19 103.61 2k9j n GLY 991 Ca 0.02 -0.15 -0.06 0.00 0.00 0.00 0.00 46.02 45.83 2k9j n GLY 991 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2k9j h PHE 992 N 0.00 0.94 -0.03 1.61 3.57 -1.73 -2.79 116.94 118.51 2k9j h PHE 992 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2k9j h PHE 992 Cb 0.00 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.44 2k9j h PHE 992 CO 0.00 0.66 -0.09 1.19 -2.23 0.00 0.00 178.31 177.85 2k9j n PHE 993 N -4.51 0.00 -4.62 0.41 3.72 -1.26 -4.89 117.46 106.31 2k9j n PHE 993 Ca 0.06 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.12 2k9j n PHE 993 Cb 0.09 -0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.49 2k9j n PHE 993 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2k9j s LYS 994 N -2.09 3.50 0.07 -1.08 2.20 -1.05 -5.11 119.74 116.17 2k9j s LYS 994 Ca 0.27 -0.62 0.03 0.00 -0.36 0.00 0.00 55.97 55.29 2k9j s LYS 994 Cb 0.20 -2.75 -0.03 0.00 -1.51 0.00 0.00 37.83 33.74 2k9j s LYS 994 CO 0.36 0.22 -0.09 1.03 -0.36 0.00 0.00 175.35 176.50 2k9j s ARG 995 N 0.37 0.73 -0.43 4.03 0.52 -1.26 -4.79 118.95 118.11 2k9j s ARG 995 Ca -0.08 -1.01 -0.26 0.00 -0.52 0.00 0.00 55.73 53.86 2k9j s ARG 995 Cb -0.15 -0.45 0.02 0.00 0.52 0.00 0.00 34.95 34.89 2k9j s ARG 995 CO 0.05 0.07 0.93 1.21 0.02 0.00 0.00 175.30 177.58 2k9j s ASN 996 N -2.11 6.56 0.26 0.23 2.47 -1.26 -5.02 114.94 116.07 2k9j s ASN 996 Ca -0.00 0.28 0.06 0.00 0.42 0.00 0.00 52.86 53.62 2k9j s ASN 996 Cb -0.05 -2.46 -0.03 0.00 -1.45 0.00 0.00 41.25 37.26 2k9j s ASN 996 CO -0.00 -1.00 0.31 0.00 -3.72 0.00 0.00 177.10 172.69 2k9j s ARG 997 N 3.70 3.19 0.00 0.43 1.70 -1.26 -5.35 118.95 121.37 2k9j s ARG 997 Ca 0.38 -0.92 0.14 0.00 -0.47 0.00 0.00 55.73 54.86 2k9j s ARG 997 Cb -0.11 -2.75 0.81 0.00 -0.57 0.00 0.00 34.95 32.33 2k9j s ARG 997 CO 0.24 0.36 1.23 -0.35 -1.08 0.00 0.00 175.30 175.71