#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3knj n LYS 3 N 0.00 0.00 0.00 1.61 5.02 -1.26 0.12 118.16 123.65 3knj n LYS 3 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3knj n LYS 3 Cb 0.00 -1.00 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 3knj n LYS 3 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3knj n GLY 4 N -0.38 0.04 3.58 0.72 0.00 -1.26 -4.73 105.19 103.16 3knj n GLY 4 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3knj n GLY 4 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3knj s ASP 5 N -1.74 5.62 0.20 1.61 -1.08 0.33 -4.85 116.67 116.76 3knj s ASP 5 Ca 0.00 0.92 -0.11 0.00 -0.52 0.00 0.00 52.55 52.83 3knj s ASP 5 Cb 0.00 -2.53 0.23 0.00 -1.46 0.00 0.00 42.92 39.17 3knj s ASP 5 CO 0.00 -1.99 1.73 0.03 0.52 0.00 0.00 175.17 175.46 3knj h ARG 6 N 13.81 0.31 -2.95 4.34 3.08 -1.84 -3.20 114.38 127.93 3knj h ARG 6 Ca -0.30 -0.02 -0.41 0.00 0.07 0.00 0.00 59.98 59.32 3knj h ARG 6 Cb 1.17 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.15 3knj h ARG 6 CO 1.11 0.21 2.25 0.54 -1.07 0.00 0.00 179.97 183.01 3knj n ARG 7 N -5.05 2.48 -3.87 0.04 1.74 -1.26 -3.82 116.66 106.92 3knj n ARG 7 Ca 0.07 -1.51 -0.09 0.00 -0.77 0.00 0.00 57.85 55.55 3knj n ARG 7 Cb 0.26 -2.41 -0.00 0.00 -1.02 0.00 0.00 32.46 29.29 3knj n ARG 7 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3knj s THR 8 N 2.45 0.00 0.00 0.55 -4.23 -1.21 -5.00 115.64 108.20 3knj s THR 8 Ca 0.53 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.93 3knj s THR 8 Cb 0.17 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.43 3knj s THR 8 CO -0.03 0.00 0.00 -1.14 -0.54 0.00 0.00 174.62 172.91 3knj n ARG 9 N -0.51 0.00 0.00 3.99 3.00 -1.25 -0.19 116.66 121.70 3knj n ARG 9 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.79 3knj n ARG 9 Cb 0.60 -0.35 0.00 0.00 0.00 0.00 0.00 32.46 32.71 3knj n ARG 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3knj n ARG 10 N 0.00 0.00 0.01 -0.14 1.74 -1.26 -0.29 116.66 116.71 3knj n ARG 10 Ca 0.00 0.22 -0.21 0.00 -0.77 0.00 0.00 57.85 57.09 3knj n ARG 10 Cb 0.00 -1.53 -0.14 0.00 -1.02 0.00 0.00 32.46 29.77 3knj n ARG 10 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3knj h GLY 11 N 0.00 0.27 1.82 -0.13 0.00 -1.72 -3.31 103.07 100.00 3knj h GLY 11 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.64 3knj h GLY 11 CO 0.00 0.61 -0.13 1.17 0.00 0.00 0.00 176.54 178.19 3knj n LYS 12 N -4.01 0.24 0.01 4.80 3.00 0.73 -3.58 118.16 119.34 3knj n LYS 12 Ca -0.22 0.17 -0.00 0.00 -0.00 0.00 0.00 58.31 58.25 3knj n LYS 12 Cb 0.86 -1.75 -0.00 0.00 0.00 0.00 0.00 35.03 34.14 3knj n LYS 12 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 3knj h ILE 13 N 0.00 0.00 0.00 3.15 2.04 -1.37 -2.04 117.51 119.29 3knj h ILE 13 Ca 0.00 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3knj h ILE 13 Cb 0.71 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 3knj h ILE 13 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 178.15 180.02 3knj n TRP 14 N -2.09 0.00 0.94 1.37 -0.00 -1.24 0.12 117.44 116.53 3knj n TRP 14 Ca -0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.50 57.60 3knj n TRP 14 Cb 0.01 -0.11 -0.02 0.00 -0.00 0.00 0.00 31.31 31.18 3knj n TRP 14 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 177.69 175.56 3knj n ARG 15 N -1.11 1.20 -2.64 5.87 3.00 -1.21 -4.98 116.66 116.78 3knj n ARG 15 Ca 0.00 -0.84 -0.17 0.00 -0.00 0.00 0.00 57.85 56.85 3knj n ARG 15 Cb 0.00 -1.44 0.01 0.00 0.00 0.00 0.00 32.46 31.04 3knj n ARG 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3knj n GLY 16 N 1.38 -0.26 3.23 5.14 0.00 0.32 -5.02 105.19 109.97 3knj n GLY 16 Ca 0.08 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 3knj n GLY 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3knj s THR 17 N -2.95 0.73 0.07 2.61 -4.23 -0.78 -5.06 115.64 106.04 3knj s THR 17 Ca 0.15 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 58.76 3knj s THR 17 Cb -0.07 -2.01 -0.03 0.00 1.34 0.00 0.00 72.50 71.73 3knj s THR 17 CO 0.18 -0.58 -0.21 -0.31 -0.54 0.00 0.00 174.62 173.17 3knj s TYR 18 N -3.62 1.83 0.00 3.99 1.51 -1.26 -4.47 117.35 115.33 3knj s TYR 18 Ca 0.21 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 3knj s TYR 18 Cb 0.06 -1.04 0.00 0.00 -0.11 0.00 0.00 41.96 40.86 3knj s TYR 18 CO 0.02 0.16 0.00 0.41 -1.11 0.00 0.00 175.55 175.03 3knj n GLY 19 N 1.44 1.89 0.00 0.71 0.00 -1.04 -4.96 105.19 103.24 3knj n GLY 19 Ca -0.18 -0.46 0.04 0.00 0.00 0.00 0.00 46.02 45.42 3knj n GLY 19 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3knj n LYS 20 N 0.00 0.07 -2.25 1.61 4.81 -1.26 -2.35 118.16 118.79 3knj n LYS 20 Ca 0.00 0.26 -0.23 0.00 -0.87 0.00 0.00 58.31 57.48 3knj n LYS 20 Cb 0.00 -1.50 0.02 0.00 0.02 0.00 0.00 35.03 33.57 3knj n LYS 20 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3knj n TYR 21 N -1.38 2.82 0.00 5.64 4.02 -1.26 -4.83 117.16 122.17 3knj n TYR 21 Ca 0.03 -2.54 0.00 0.00 -0.01 0.00 0.00 57.90 55.39 3knj n TYR 21 Cb 0.08 -0.25 0.00 0.00 -0.02 0.00 0.00 39.34 39.16 3knj n TYR 21 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 3knj n ARG 22 N -0.60 0.00 0.00 -0.72 0.63 -0.99 -3.93 116.66 111.05 3knj n ARG 22 Ca 0.39 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.32 3knj n ARG 22 Cb 0.85 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.76 3knj n ARG 22 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 3knj n PRO 23 N 0.00 0.45 -0.10 -0.14 -0.02 -1.08 -2.50 135.00 131.61 3knj n PRO 23 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.39 3knj n PRO 23 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 33.50 33.32 3knj n PRO 23 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3knj n ARG 24 N -0.47 0.69 0.00 -0.52 1.74 -1.26 -4.88 116.66 111.96 3knj n ARG 24 Ca 0.00 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 3knj n ARG 24 Cb 0.00 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 3knj n ARG 24 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 3knj n LYS 25 N -2.73 0.00 0.00 5.56 4.81 -1.26 -5.25 118.16 119.29 3knj n LYS 25 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.12 3knj n LYS 25 Cb 1.13 0.00 0.00 0.00 0.02 0.00 0.00 35.03 36.18 3knj n LYS 25 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93