#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 1.16 -2.72 4.61 0.00 -2.11 -3.42 119.26 116.78 2k9j h ALA 958 Ca 0.00 -0.21 -0.50 0.00 0.00 0.00 0.00 54.91 54.20 2k9j h ALA 958 Cb 0.00 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 17.57 2k9j h ALA 958 CO 0.00 0.58 0.46 -0.51 0.00 0.00 0.00 179.25 179.77 2k9j s LEU 959 N -9.42 4.42 0.03 0.00 1.43 -1.26 -5.05 118.68 108.83 2k9j s LEU 959 Ca -0.10 2.20 0.04 0.00 -1.03 0.00 0.00 54.13 55.24 2k9j s LEU 959 Cb 0.15 -3.81 -0.02 0.00 0.03 0.00 0.00 46.19 42.55 2k9j s LEU 959 CO 0.81 -0.27 -0.11 -1.61 0.23 0.00 0.00 176.35 175.40 2k9j s GLU 960 N -1.78 0.76 0.17 1.70 0.41 -1.26 -5.05 118.70 113.64 2k9j s GLU 960 Ca 0.49 -0.68 -0.10 0.00 -0.41 0.00 0.00 54.97 54.27 2k9j s GLU 960 Cb -0.29 -0.70 0.06 0.00 -1.78 0.00 0.00 34.13 31.42 2k9j s GLU 960 CO 0.37 0.17 1.65 0.93 -0.49 0.00 0.00 175.26 177.89 2k9j h GLU 961 N 4.97 1.01 -5.38 1.61 5.08 -1.99 -3.42 114.58 116.46 2k9j h GLU 961 Ca -0.36 -0.29 -0.62 0.00 -1.00 0.00 0.00 59.36 57.08 2k9j h GLU 961 Cb 1.19 -0.10 -0.14 0.00 0.50 0.00 0.00 28.75 30.19 2k9j h GLU 961 CO 0.44 0.97 -0.55 1.03 -1.00 0.00 0.00 179.01 179.91 2k9j s ARG 962 N -5.11 3.87 -0.02 2.33 0.52 -1.26 -4.97 118.95 114.31 2k9j s ARG 962 Ca -0.12 -0.30 0.13 0.00 -0.52 0.00 0.00 55.73 54.92 2k9j s ARG 962 Cb 0.13 -3.21 -0.20 0.00 0.52 0.00 0.00 34.95 32.19 2k9j s ARG 962 CO 0.84 0.37 0.29 0.00 0.02 0.00 0.00 175.30 176.82 2k9j n ALA 963 N 3.24 2.50 -3.46 2.13 0.00 -1.26 -4.80 120.51 118.85 2k9j n ALA 963 Ca -0.17 -0.31 -0.27 0.00 0.00 0.00 0.00 53.44 52.69 2k9j n ALA 963 Cb 0.53 -0.45 -0.10 0.00 0.00 0.00 0.00 19.45 19.42 2k9j n ALA 963 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2k9j n ILE 964 N -1.95 -0.73 -1.78 0.00 -5.35 -1.26 -5.13 119.36 103.17 2k9j n ILE 964 Ca -0.02 -3.68 -0.39 0.00 -0.27 0.00 0.00 62.75 58.38 2k9j n ILE 964 Cb 0.34 -1.75 0.03 0.00 -1.74 0.00 0.00 39.64 36.52 2k9j n ILE 964 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 2k9j s PRO 965 N -0.25 3.46 0.49 6.28 0.02 -1.26 -4.91 135.00 138.83 2k9j s PRO 965 Ca 0.32 2.37 0.26 0.00 0.02 0.00 0.00 61.00 63.97 2k9j s PRO 965 Cb 0.03 -2.50 1.22 0.00 0.02 0.00 0.00 34.50 33.28 2k9j s PRO 965 CO -0.19 -0.98 1.96 0.97 -0.33 0.00 0.00 177.00 178.43 2k9j h ILE 966 N 1.96 0.54 -0.82 2.83 2.10 -2.02 -3.11 117.51 118.99 2k9j h ILE 966 Ca -0.51 -0.80 0.09 0.00 1.08 0.00 0.00 64.86 64.72 2k9j h ILE 966 Cb 1.28 1.54 -0.06 0.00 -1.09 0.00 0.00 36.82 38.49 2k9j h ILE 966 CO 0.60 0.16 0.53 -0.50 -1.08 0.00 0.00 178.15 177.86 2k9j h TRP 967 N 0.00 0.83 -0.67 2.19 4.06 -1.99 -1.49 115.95 118.88 2k9j h TRP 967 Ca -0.00 0.02 0.03 0.00 2.06 0.00 0.00 58.89 61.00 2k9j h TRP 967 Cb 0.53 -0.27 -0.04 0.00 -1.00 0.00 0.00 29.16 28.37 2k9j h TRP 967 CO 0.00 0.39 0.41 -1.49 -3.56 0.00 0.00 178.44 174.20 2k9j h TRP 968 N 0.78 0.77 -0.47 0.49 4.06 -1.94 0.14 115.95 119.79 2k9j h TRP 968 Ca 0.37 0.02 -0.05 0.00 2.06 0.00 0.00 58.89 61.29 2k9j h TRP 968 Cb 0.42 -0.25 -0.02 0.00 -1.00 0.00 0.00 29.16 28.31 2k9j h TRP 968 CO -0.00 0.44 0.09 0.28 -3.56 0.00 0.00 178.44 175.68 2k9j h VAL 969 N 0.81 1.24 -0.78 1.49 2.07 -1.50 -2.60 116.25 116.99 2k9j h VAL 969 Ca 0.27 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 2k9j h VAL 969 Cb 0.03 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 2k9j h VAL 969 CO -0.11 0.31 0.40 -0.07 0.02 0.00 0.00 177.57 178.12 2k9j h LEU 970 N 0.63 1.00 -0.46 2.57 3.38 -0.71 -1.19 115.31 120.54 2k9j h LEU 970 Ca 0.14 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2k9j h LEU 970 Cb 0.37 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2k9j h LEU 970 CO 0.01 0.84 0.28 0.58 0.09 0.00 0.00 178.44 180.23 2k9j h VAL 971 N 1.09 1.14 -0.43 1.22 2.07 -0.57 -1.46 116.25 119.31 2k9j h VAL 971 Ca 0.27 -0.32 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 2k9j h VAL 971 Cb 0.08 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 2k9j h VAL 971 CO -0.04 0.14 0.05 1.23 0.02 0.00 0.00 177.57 178.98 2k9j h GLY 972 N 0.62 0.71 0.95 2.17 0.00 -1.16 -2.62 103.07 103.74 2k9j h GLY 972 Ca 0.17 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 47.06 2k9j h GLY 972 CO -0.03 0.39 0.19 -2.08 0.00 0.00 0.00 176.54 175.01 2k9j h VAL 973 N 0.64 1.19 -0.78 4.60 2.07 -0.51 -1.80 116.25 121.67 2k9j h VAL 973 Ca 0.14 -0.58 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 2k9j h VAL 973 Cb 0.32 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 2k9j h VAL 973 CO 0.01 0.22 0.37 -0.07 0.02 0.00 0.00 177.57 178.12 2k9j h LEU 974 N 0.55 1.01 -0.77 2.57 4.07 -1.05 -1.14 115.31 120.57 2k9j h LEU 974 Ca 0.15 -0.13 -0.02 0.00 0.08 0.00 0.00 57.88 57.96 2k9j h LEU 974 Cb 0.16 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 41.61 2k9j h LEU 974 CO -0.01 0.86 0.42 1.23 -1.08 0.00 0.00 178.44 179.86 2k9j h GLY 975 N 1.09 1.15 1.23 0.83 0.00 -1.22 -1.37 103.07 104.79 2k9j h GLY 975 Ca 0.27 -0.52 -0.07 0.00 0.00 0.00 0.00 47.33 47.01 2k9j h GLY 975 CO -0.03 0.50 0.10 -1.33 0.00 0.00 0.00 176.54 175.77 2k9j h GLY 976 N 1.07 1.02 1.02 4.60 0.00 -0.91 -2.48 103.07 107.39 2k9j h GLY 976 Ca 0.27 -0.64 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 2k9j h GLY 976 CO -0.04 0.60 0.33 -2.00 0.00 0.00 0.00 176.54 175.42 2k9j h LEU 977 N 0.89 0.97 -0.78 3.11 5.85 -0.63 -2.39 115.31 122.33 2k9j h LEU 977 Ca 0.18 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 2k9j h LEU 977 Cb 0.39 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 2k9j h LEU 977 CO 0.01 0.85 0.39 -0.07 -0.34 0.00 0.00 178.44 179.27 2k9j h LEU 978 N 1.02 1.01 -0.52 2.25 3.38 -0.94 -1.33 115.31 120.19 2k9j h LEU 978 Ca 0.25 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2k9j h LEU 978 Cb 0.15 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2k9j h LEU 978 CO -0.03 0.85 0.28 0.25 0.09 0.00 0.00 178.44 179.88 2k9j h LEU 979 N 1.10 0.65 -0.60 1.67 5.85 -1.08 -0.19 115.31 122.70 2k9j h LEU 979 Ca 0.27 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 2k9j h LEU 979 Cb 0.10 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2k9j h LEU 979 CO -0.04 0.56 0.20 0.25 -0.34 0.00 0.00 178.44 179.07 2k9j h LEU 980 N 0.69 0.86 -0.41 2.25 5.85 -1.15 -1.59 115.31 121.81 2k9j h LEU 980 Ca 0.18 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 2k9j h LEU 980 Cb 0.06 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 2k9j h LEU 980 CO -0.03 0.83 0.20 0.74 -0.34 0.00 0.00 178.44 179.84 2k9j h THR 981 N 0.85 1.17 -0.49 1.05 2.02 -0.91 -0.82 112.91 115.79 2k9j h THR 981 Ca 0.20 -0.49 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 2k9j h THR 981 Cb 0.27 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 2k9j h THR 981 CO -0.01 0.19 0.18 0.40 0.37 0.00 0.00 175.52 176.65 2k9j h ILE 982 N 0.52 1.22 -0.57 3.11 2.04 -0.88 0.05 117.51 123.00 2k9j h ILE 982 Ca 0.14 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 2k9j h ILE 982 Cb 0.11 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 2k9j h ILE 982 CO -0.02 0.26 0.27 0.25 0.00 0.00 0.00 178.15 178.91 2k9j h LEU 983 N 0.66 0.76 -0.42 1.44 5.85 -1.12 -0.61 115.31 121.87 2k9j h LEU 983 Ca 0.16 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 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 0.68 0.14 0.58 -0.34 0.00 0.00 178.44 179.49 2k9j h VAL 984 N 0.78 1.21 -0.63 1.05 2.07 -0.93 -2.31 116.25 117.50 2k9j h VAL 984 Ca 0.20 -0.69 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 2k9j h VAL 984 Cb 0.13 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 2k9j h VAL 984 CO -0.02 0.25 0.30 0.25 0.02 0.00 0.00 177.57 178.36 2k9j h LEU 985 N 0.53 0.82 -0.71 2.57 5.85 -0.74 -1.64 115.31 122.00 2k9j h LEU 985 Ca 0.14 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2k9j h LEU 985 Cb 0.24 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2k9j h LEU 985 CO -0.01 0.73 0.35 0.00 -0.34 0.00 0.00 178.44 179.17 2k9j h ALA 986 N 1.13 0.91 -0.64 1.25 0.00 -0.96 0.56 119.26 121.51 2k9j h ALA 986 Ca 0.22 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2k9j h ALA 986 Cb 0.12 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2k9j h ALA 986 CO -0.03 0.47 0.04 0.52 0.00 0.00 0.00 179.25 180.25 2k9j h MET 987 N 0.98 1.10 -0.64 0.00 2.86 -1.18 -2.31 114.93 115.74 2k9j h MET 987 Ca 0.24 -0.33 -0.08 0.00 -2.06 0.00 0.00 59.70 57.47 2k9j h MET 987 Cb 0.10 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 2k9j h MET 987 CO -0.03 1.04 0.08 2.35 1.06 0.00 0.00 176.91 181.42 2k9j h TRP 988 N 1.02 1.15 0.00 -0.22 7.01 -0.94 -2.03 115.95 121.94 2k9j h TRP 988 Ca 0.19 -0.17 0.00 0.00 2.11 0.00 0.00 58.89 61.02 2k9j h TRP 988 Cb 0.52 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 27.27 2k9j h TRP 988 CO 0.04 0.98 0.00 1.63 -2.79 0.00 0.00 178.44 178.30 2k9j n LYS 989 N -4.23 0.05 0.09 2.65 4.76 0.16 -1.78 118.16 119.86 2k9j n LYS 989 Ca 0.04 0.30 0.12 0.00 -2.87 0.00 0.00 58.31 55.90 2k9j n LYS 989 Cb 0.30 -1.59 0.12 0.00 -1.84 0.00 0.00 35.03 32.02 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 -0.80 -3.47 116.25 113.86 2k9j h VAL 990 Ca 0.00 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.83 2k9j h VAL 990 Cb 0.27 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 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 1.27 0.60 0.28 2.17 0.00 -0.73 -4.94 105.19 103.84 2k9j n GLY 991 Ca 0.02 -0.05 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 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 0.91 -0.01 1.61 3.57 -1.78 -1.69 116.94 119.55 2k9j h PHE 992 Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2k9j h PHE 992 Cb 0.00 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.45 2k9j h PHE 992 CO 0.00 0.63 -0.07 1.19 -2.23 0.00 0.00 178.31 177.83 2k9j n PHE 993 N -4.54 0.00 -4.84 0.41 3.72 -1.26 -4.78 117.46 106.18 2k9j n PHE 993 Ca 0.05 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.13 2k9j n PHE 993 Cb 0.07 -0.07 -0.15 0.00 -0.94 0.00 0.00 39.48 38.40 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 -2.22 3.27 0.09 -1.08 2.20 -0.64 -5.12 119.74 116.25 2k9j s LYS 994 Ca 0.35 -0.71 0.05 0.00 -0.36 0.00 0.00 55.97 55.30 2k9j s LYS 994 Cb 0.21 -2.57 -0.03 0.00 -1.51 0.00 0.00 37.83 33.92 2k9j s LYS 994 CO 0.41 0.25 -0.12 1.03 -0.36 0.00 0.00 175.35 176.56 2k9j s ARG 995 N 0.25 0.85 -0.43 4.03 0.52 -1.26 -4.81 118.95 118.11 2k9j s ARG 995 Ca -0.10 -1.08 -0.26 0.00 -0.52 0.00 0.00 55.73 53.77 2k9j s ARG 995 Cb -0.16 -0.70 0.02 0.00 0.52 0.00 0.00 34.95 34.64 2k9j s ARG 995 CO 0.06 0.13 0.95 -0.80 0.02 0.00 0.00 175.30 175.67 2k9j s ASN 996 N -2.15 6.59 0.08 0.23 0.01 -1.26 -5.02 114.94 113.43 2k9j s ASN 996 Ca 0.03 0.34 0.06 0.00 -0.71 0.00 0.00 52.86 52.58 2k9j s ASN 996 Cb -0.06 -2.47 -0.04 0.00 0.41 0.00 0.00 41.25 39.09 2k9j s ASN 996 CO 0.02 -1.00 -0.09 0.00 -1.51 0.00 0.00 177.10 174.51 2k9j s ARG 997 N 3.74 2.24 0.00 -0.60 1.70 -1.26 -5.34 118.95 119.43 2k9j s ARG 997 Ca 0.39 -0.95 0.15 0.00 -0.47 0.00 0.00 55.73 54.85 2k9j s ARG 997 Cb -0.10 -2.36 0.90 0.00 -0.57 0.00 0.00 34.95 32.82 2k9j s ARG 997 CO 0.24 0.53 1.31 -0.35 -1.08 0.00 0.00 175.30 175.96