#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hf9 s LEU 2 N 0.00 2.03 0.00 0.00 1.43 -1.26 -5.00 118.68 115.88 1hf9 s LEU 2 Ca 0.00 -2.57 0.00 0.00 -1.03 0.00 0.00 54.13 50.53 1hf9 s LEU 2 Cb 0.00 -0.77 0.00 0.00 0.03 0.00 0.00 46.19 45.45 1hf9 s LEU 2 CO 0.00 -0.26 0.00 0.29 0.23 0.00 0.00 176.35 176.61 1hf9 n LYS 3 N 3.58 0.00 0.00 1.70 4.01 -1.26 -4.99 118.16 121.21 1hf9 n LYS 3 Ca 0.13 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.93 1hf9 n LYS 3 Cb 0.37 -0.03 0.00 0.00 -0.51 0.00 0.00 35.03 34.86 1hf9 n LYS 3 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1hf9 n LYS 4 N -1.50 0.00 -0.34 1.97 3.00 -1.26 -4.27 118.16 115.76 1hf9 n LYS 4 Ca 0.00 0.00 0.36 0.00 -0.00 0.00 0.00 58.31 58.67 1hf9 n LYS 4 Cb 0.00 0.00 0.74 0.00 0.00 0.00 0.00 35.03 35.77 1hf9 n LYS 4 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.40 178.52 1hf9 h HIS 5 N 0.00 0.00 -0.03 5.64 2.07 -2.00 0.32 115.15 121.15 1hf9 h HIS 5 Ca 0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 1hf9 h HIS 5 Cb 0.00 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 29.98 1hf9 h HIS 5 CO 0.00 0.00 -0.02 0.45 -3.07 0.00 0.00 177.93 175.29 1hf9 h HIS 6 N 0.00 0.07 -0.04 6.12 3.86 -1.99 -2.73 115.15 120.44 1hf9 h HIS 6 Ca 0.58 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.79 1hf9 h HIS 6 Cb 2.43 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 30.88 1hf9 h HIS 6 CO 0.00 0.47 0.08 1.05 0.86 0.00 0.00 177.93 180.39 1hf9 h GLU 7 N -0.35 0.00 0.40 2.45 4.11 -0.72 0.20 114.58 120.67 1hf9 h GLU 7 Ca 0.01 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.42 1hf9 h GLU 7 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1hf9 h GLU 7 CO 0.00 0.00 -0.19 -0.91 0.07 0.00 0.00 179.01 177.98 1hf9 h ASN 8 N 0.00 -0.46 0.50 3.06 2.35 -1.14 -0.40 115.58 119.49 1hf9 h ASN 8 Ca 0.02 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1hf9 h ASN 8 Cb 0.19 0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1hf9 h ASN 8 CO -0.00 -0.02 0.00 -0.62 -1.65 0.00 0.00 177.43 175.14 1hf9 n GLU 9 N -5.14 0.08 -0.02 0.81 1.02 -1.01 -2.24 120.64 114.13 1hf9 n GLU 9 Ca -0.07 0.18 -0.08 0.00 -0.02 0.00 0.00 57.16 57.18 1hf9 n GLU 9 Cb 0.23 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.01 1hf9 n GLU 9 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1hf9 n ILE 10 N -1.43 1.55 0.07 -3.67 5.41 0.68 -2.44 119.36 119.53 1hf9 n ILE 10 Ca 0.05 -0.79 -0.09 0.00 1.00 0.00 0.00 62.75 62.93 1hf9 n ILE 10 Cb 0.18 -0.97 -0.11 0.00 -0.71 0.00 0.00 39.64 38.03 1hf9 n ILE 10 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1hf9 h SER 11 N 0.00 0.10 0.00 4.38 4.64 -0.60 -1.68 113.55 120.39 1hf9 h SER 11 Ca -0.29 -0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 60.92 1hf9 h SER 11 Cb 1.98 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 64.04 1hf9 h SER 11 CO 0.07 1.06 -0.08 -0.74 -0.87 0.00 0.00 176.83 176.27 1hf9 h HIS 12 N 0.02 0.07 0.00 4.77 -0.00 -1.59 -2.77 115.15 115.65 1hf9 h HIS 12 Ca -0.04 -0.04 -0.04 0.00 -0.00 0.00 0.00 60.37 60.26 1hf9 h HIS 12 Cb 1.77 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 29.17 1hf9 h HIS 12 CO 0.01 0.88 -0.18 0.45 -0.00 0.00 0.00 177.93 179.09 1hf9 h HIS 13 N -0.76 0.00 0.02 5.26 -0.00 -1.58 -2.08 115.15 116.01 1hf9 h HIS 13 Ca -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.36 1hf9 h HIS 13 Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.32 1hf9 h HIS 13 CO 0.22 0.18 -0.01 0.00 -0.00 0.00 0.00 177.93 178.32 1hf9 h ALA 14 N 1.82 -0.03 0.00 2.45 0.00 -1.31 -1.55 119.26 120.63 1hf9 h ALA 14 Ca -0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1hf9 h ALA 14 Cb 0.40 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1hf9 h ALA 14 CO 0.02 -0.36 -0.19 1.57 0.00 0.00 0.00 179.25 180.30 1hf9 h LYS 15 N -0.35 0.00 -0.30 0.00 2.10 -1.25 -2.55 116.57 114.21 1hf9 h LYS 15 Ca -0.00 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.50 1hf9 h LYS 15 Cb 0.34 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.66 1hf9 h LYS 15 CO 0.01 0.19 -0.37 0.93 -2.00 0.00 0.00 179.45 178.20 1hf9 h GLU 16 N 0.00 0.78 -0.35 0.07 3.07 -1.14 -2.12 114.58 114.89 1hf9 h GLU 16 Ca -0.00 -0.44 -0.11 0.00 -0.50 0.00 0.00 59.36 58.31 1hf9 h GLU 16 Cb 0.40 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 1hf9 h GLU 16 CO 0.02 1.07 -0.22 -0.84 -1.40 0.00 0.00 179.01 177.64 1hf9 h ILE 17 N 0.55 1.27 0.00 3.13 -0.00 -0.92 -2.44 117.51 119.10 1hf9 h ILE 17 Ca 0.04 -1.31 -0.09 0.00 -0.00 0.00 0.00 64.86 63.50 1hf9 h ILE 17 Cb 0.96 1.24 -0.01 0.00 -0.00 0.00 0.00 36.82 39.01 1hf9 h ILE 17 CO 0.09 0.43 -0.44 -0.33 -0.00 0.00 0.00 178.15 177.90 1hf9 h GLU 18 N 0.61 0.00 -0.20 0.16 4.39 -1.43 -2.04 114.58 116.06 1hf9 h GLU 18 Ca 0.09 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.65 1hf9 h GLU 18 Cb 0.70 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1hf9 h GLU 18 CO 0.05 0.44 -0.41 -0.09 -1.16 0.00 0.00 179.01 177.85 1hf9 h ARG 19 N 0.00 0.63 0.00 2.33 9.65 -1.00 -1.86 114.38 124.14 1hf9 h ARG 19 Ca -0.00 -0.41 -0.12 0.00 -1.10 0.00 0.00 59.98 58.35 1hf9 h ARG 19 Cb 0.83 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.45 1hf9 h ARG 19 CO 0.06 1.03 -0.57 -0.07 2.80 0.00 0.00 179.97 183.21 1hf9 h LEU 20 N 0.32 0.00 -0.54 3.80 -0.00 -1.38 -2.44 115.31 115.07 1hf9 h LEU 20 Ca 0.01 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.76 1hf9 h LEU 20 Cb 1.01 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.65 1hf9 h LEU 20 CO 0.09 0.57 -0.59 -0.61 -0.00 0.00 0.00 178.44 177.90 1hf9 h GLN 21 N 0.00 0.00 0.02 1.13 4.15 -1.34 -2.29 115.11 116.79 1hf9 h GLN 21 Ca -0.01 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.20 1hf9 h GLN 21 Cb 1.11 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.79 1hf9 h GLN 21 CO 0.07 0.59 -0.96 0.87 -1.93 0.00 0.00 178.83 177.48 1hf9 h LYS 22 N 0.00 0.14 -0.10 1.69 6.56 -1.14 -2.49 116.57 121.23 1hf9 h LYS 22 Ca -0.01 -0.18 -0.07 0.00 -1.06 0.00 0.00 60.65 59.33 1hf9 h LYS 22 Cb 1.21 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.93 1hf9 h LYS 22 CO 0.08 0.99 -0.21 0.93 -2.06 0.00 0.00 179.45 179.17 1hf9 h GLU 23 N 0.06 0.31 -0.55 3.15 4.39 -1.35 -2.50 114.58 118.10 1hf9 h GLU 23 Ca -0.05 -0.21 -0.04 0.00 0.34 0.00 0.00 59.36 59.41 1hf9 h GLU 23 Cb 1.63 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 30.29 1hf9 h GLU 23 CO 0.14 0.81 0.19 0.97 -1.16 0.00 0.00 179.01 179.96 1hf9 h ILE 24 N -0.14 1.21 -0.21 3.13 6.09 -1.49 -1.85 117.51 124.25 1hf9 h ILE 24 Ca 0.00 -0.70 -0.01 0.00 -1.37 0.00 0.00 64.86 62.79 1hf9 h ILE 24 Cb 0.81 0.58 -0.01 0.00 0.47 0.00 0.00 36.82 38.67 1hf9 h ILE 24 CO 0.05 0.27 0.10 -0.08 -3.07 0.00 0.00 178.15 175.41 1hf9 h GLU 25 N 0.80 0.30 -0.47 2.19 4.81 -1.42 -0.22 114.58 120.58 1hf9 h GLU 25 Ca 0.19 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1hf9 h GLU 25 Cb 0.20 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1hf9 h GLU 25 CO -0.01 0.33 0.02 -0.09 -0.73 0.00 0.00 179.01 178.52 1hf9 h ARG 26 N 0.20 0.76 0.00 1.92 9.65 -1.19 -2.15 114.38 123.58 1hf9 h ARG 26 Ca 0.07 -0.19 -0.04 0.00 -1.10 0.00 0.00 59.98 58.72 1hf9 h ARG 26 Cb 0.13 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 1hf9 h ARG 26 CO -0.01 0.76 -0.19 0.45 2.80 0.00 0.00 179.97 183.79 1hf9 h HIS 27 N 0.72 0.00 0.01 2.20 3.86 -1.15 -2.80 115.15 117.99 1hf9 h HIS 27 Ca 0.14 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.15 1hf9 h HIS 27 Cb 0.41 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1hf9 h HIS 27 CO 0.02 0.19 -0.90 -0.22 0.86 0.00 0.00 177.93 177.87 1hf9 h LYS 28 N 0.00 0.17 -0.20 2.45 3.64 -0.41 -2.02 116.57 120.20 1hf9 h LYS 28 Ca -0.00 -0.20 -0.20 0.00 -1.27 0.00 0.00 60.65 58.97 1hf9 h LYS 28 Cb 0.86 0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.75 1hf9 h LYS 28 CO 0.02 0.96 -0.67 0.37 -2.27 0.00 0.00 179.45 177.87 1hf9 h GLN 29 N 0.09 0.80 -0.31 1.90 4.15 -1.29 -0.48 115.11 119.97 1hf9 h GLN 29 Ca -0.04 -0.60 -0.16 0.00 0.77 0.00 0.00 58.65 58.62 1hf9 h GLN 29 Cb 1.55 0.11 -0.00 0.00 0.21 0.00 0.00 27.48 29.34 1hf9 h GLN 29 CO 0.14 1.21 -0.43 0.66 -1.93 0.00 0.00 178.83 178.48 1hf9 h SER 30 N 0.55 0.92 1.09 -0.69 4.64 -1.54 -1.53 113.55 116.99 1hf9 h SER 30 Ca -0.03 -0.50 -0.08 0.00 -0.47 0.00 0.00 61.79 60.71 1hf9 h SER 30 Cb 1.29 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 63.11 1hf9 h SER 30 CO 0.14 1.24 -0.39 -0.29 -0.87 0.00 0.00 176.83 176.66 1hf9 h ILE 31 N 0.63 0.80 0.04 0.95 6.09 -1.40 -2.55 117.51 122.07 1hf9 h ILE 31 Ca 0.04 -1.68 -0.23 0.00 -1.37 0.00 0.00 64.86 61.62 1hf9 h ILE 31 Cb 1.02 2.07 -0.02 0.00 0.47 0.00 0.00 36.82 40.37 1hf9 h ILE 31 CO 0.10 0.38 -1.05 0.50 -3.07 0.00 0.00 178.15 175.01 1hf9 h LYS 32 N 0.00 0.10 -0.04 2.19 3.64 -0.99 -2.36 116.57 119.11 1hf9 h LYS 32 Ca -0.00 -0.16 -0.22 0.00 -1.27 0.00 0.00 60.65 59.00 1hf9 h LYS 32 Cb 1.04 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1hf9 h LYS 32 CO 0.05 1.05 -0.87 0.87 -2.27 0.00 0.00 179.45 178.29 1hf9 h LYS 33 N 0.03 0.49 -0.13 1.90 1.57 -1.20 -1.30 116.57 117.93 1hf9 h LYS 33 Ca -0.05 -0.47 -0.21 0.00 -1.87 0.00 0.00 60.65 58.05 1hf9 h LYS 33 Cb 1.79 0.12 0.00 0.00 0.08 0.00 0.00 32.23 34.22 1hf9 h LYS 33 CO 0.15 1.11 -0.74 -0.07 -0.57 0.00 0.00 179.45 179.33 1hf9 h LEU 34 N 0.30 0.77 -0.55 2.94 3.38 -1.52 -2.15 115.31 118.48 1hf9 h LEU 34 Ca -0.07 -0.50 -0.16 0.00 0.09 0.00 0.00 57.88 57.25 1hf9 h LEU 34 Cb 1.49 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 1hf9 h LEU 34 CO 0.16 1.27 -0.72 0.50 0.09 0.00 0.00 178.44 179.74 1hf9 h LYS 35 N 0.45 0.07 -0.01 1.13 3.64 -1.45 -3.06 116.57 117.33 1hf9 h LYS 35 Ca -0.04 -0.06 -0.16 0.00 -1.27 0.00 0.00 60.65 59.12 1hf9 h LYS 35 Cb 1.35 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.17 1hf9 h LYS 35 CO 0.14 0.75 -0.75 0.37 -2.27 0.00 0.00 179.45 177.69 1hf9 h GLN 36 N 0.04 0.09 0.00 1.90 4.15 -1.21 -3.07 115.11 117.02 1hf9 h GLN 36 Ca -0.01 -0.09 -0.08 0.00 0.77 0.00 0.00 58.65 59.24 1hf9 h GLN 36 Cb 1.27 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 1hf9 h GLN 36 CO 0.10 0.80 -0.37 1.03 -1.93 0.00 0.00 178.83 178.46 1hf9 h SER 37 N 0.06 0.00 0.38 -0.69 0.87 -1.32 -2.73 113.55 110.12 1hf9 h SER 37 Ca -0.02 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.46 1hf9 h SER 37 Cb 1.33 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.27 1hf9 h SER 37 CO 0.11 0.37 -0.40 -0.08 -0.53 0.00 0.00 176.83 176.30 1hf9 h GLU 38 N 0.00 0.02 0.00 2.24 4.81 -1.44 -2.70 114.58 117.51 1hf9 h GLU 38 Ca -0.00 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 1hf9 h GLU 38 Cb 0.79 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.15 1hf9 h GLU 38 CO 0.05 0.41 -0.75 -0.44 -0.73 0.00 0.00 179.01 177.55 1hf9 h ASP 39 N 0.02 0.00 -4.09 1.04 5.19 -1.55 -3.50 116.42 113.52 1hf9 h ASP 39 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1hf9 h ASP 39 Cb 0.71 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.22 1hf9 h ASP 39 CO 0.05 0.55 -0.50 -0.67 -3.12 0.00 0.00 179.24 175.56 1hf9 n ASP 40 N -3.15 -5.52 0.00 6.45 2.03 -1.02 -5.15 116.55 110.19 1hf9 n ASP 40 Ca -0.01 0.69 0.00 0.00 0.52 0.00 0.00 54.79 55.99 1hf9 n ASP 40 Cb 0.77 -2.17 0.00 0.00 -0.72 0.00 0.00 41.12 39.00 1hf9 n ASP 40 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75