#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hf9 n LEU 2 N 0.00 0.33 -1.90 0.00 4.32 -1.26 -4.96 117.00 113.53 1hf9 n LEU 2 Ca 0.00 0.15 -0.11 0.00 -0.02 0.00 0.00 56.01 56.03 1hf9 n LEU 2 Cb 0.00 0.34 -0.03 0.00 -1.62 0.00 0.00 43.42 42.11 1hf9 n LEU 2 CO 0.00 0.41 -0.13 0.29 -1.22 0.00 0.00 177.39 176.74 1hf9 n LYS 3 N -2.82 -1.78 0.01 3.23 5.02 -1.26 -4.81 118.16 115.76 1hf9 n LYS 3 Ca -0.25 0.61 -0.18 0.00 -2.02 0.00 0.00 58.31 56.47 1hf9 n LYS 3 Cb 1.07 -5.01 -0.10 0.00 -0.02 0.00 0.00 35.03 30.96 1hf9 n LYS 3 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1hf9 h LYS 4 N 0.00 0.55 -0.07 1.97 3.64 -2.02 -3.16 116.57 117.48 1hf9 h LYS 4 Ca -0.25 -0.57 0.02 0.00 -1.27 0.00 0.00 60.65 58.58 1hf9 h LYS 4 Cb 0.97 0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1hf9 h LYS 4 CO 0.33 1.19 0.09 1.12 -2.27 0.00 0.00 179.45 179.90 1hf9 h HIS 5 N 0.13 0.00 -0.67 1.91 2.07 -2.02 -1.15 115.15 115.42 1hf9 h HIS 5 Ca -0.09 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.38 1hf9 h HIS 5 Cb 1.44 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.39 1hf9 h HIS 5 CO 0.13 0.00 0.23 1.25 -3.07 0.00 0.00 177.93 176.46 1hf9 h HIS 6 N 0.00 1.02 0.00 6.12 2.76 -1.93 -1.77 115.15 121.35 1hf9 h HIS 6 Ca 0.03 -0.08 -0.03 0.00 -2.20 0.00 0.00 60.37 58.09 1hf9 h HIS 6 Cb 0.20 -0.30 -0.00 0.00 1.55 0.00 0.00 27.41 28.86 1hf9 h HIS 6 CO 0.00 0.81 -0.14 0.93 -1.30 0.00 0.00 177.93 178.22 1hf9 h GLU 7 N 0.97 0.00 0.21 5.26 5.08 -1.33 -1.05 114.58 123.72 1hf9 h GLU 7 Ca 0.22 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 1hf9 h GLU 7 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1hf9 h GLU 7 CO -0.01 0.14 -0.10 -0.97 -1.00 0.00 0.00 179.01 177.07 1hf9 h ASN 8 N 0.00 -0.24 0.18 1.42 -0.73 -1.36 -2.12 115.58 112.73 1hf9 h ASN 8 Ca -0.00 -0.27 -0.01 0.00 1.87 0.00 0.00 56.30 57.88 1hf9 h ASN 8 Cb 0.35 0.06 -0.00 0.00 0.27 0.00 0.00 38.32 39.00 1hf9 h ASN 8 CO 0.02 0.29 -0.05 -0.08 -0.37 0.00 0.00 177.43 177.23 1hf9 h GLU 9 N -0.91 0.00 -0.08 6.67 4.57 -1.36 -2.02 114.58 121.45 1hf9 h GLU 9 Ca -0.03 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.08 1hf9 h GLU 9 Cb 0.50 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 1hf9 h GLU 9 CO 0.05 0.05 -0.24 0.82 -1.18 0.00 0.00 179.01 178.51 1hf9 h ILE 10 N 0.00 1.41 0.00 2.32 2.04 -1.17 -1.98 117.51 120.14 1hf9 h ILE 10 Ca -0.00 -1.59 -0.04 0.00 1.00 0.00 0.00 64.86 64.23 1hf9 h ILE 10 Cb 0.16 2.22 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 1hf9 h ILE 10 CO 0.01 0.46 -0.17 0.28 0.00 0.00 0.00 178.15 178.72 1hf9 h SER 11 N -0.16 0.00 0.11 1.72 0.02 -0.82 -2.29 113.55 112.14 1hf9 h SER 11 Ca -0.01 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.66 1hf9 h SER 11 Cb 0.86 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.43 1hf9 h SER 11 CO 0.05 0.17 -1.17 -0.74 -1.14 0.00 0.00 176.83 174.00 1hf9 h HIS 12 N 0.00 0.97 0.00 3.45 -0.00 -1.32 -2.80 115.15 115.45 1hf9 h HIS 12 Ca -0.00 -0.61 -0.05 0.00 -0.00 0.00 0.00 60.37 59.71 1hf9 h HIS 12 Cb 0.47 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 27.80 1hf9 h HIS 12 CO 0.00 1.45 -0.25 0.45 -0.00 0.00 0.00 177.93 179.57 1hf9 h HIS 13 N 0.21 0.00 0.30 5.26 -0.00 -1.07 0.14 115.15 119.99 1hf9 h HIS 13 Ca -0.18 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.18 1hf9 h HIS 13 Cb 1.86 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.27 1hf9 h HIS 13 CO 0.12 0.25 -0.15 0.00 -0.00 0.00 0.00 177.93 178.16 1hf9 h ALA 14 N 1.75 -0.41 0.00 2.45 0.00 -1.42 -0.93 119.26 120.70 1hf9 h ALA 14 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1hf9 h ALA 14 Cb 0.53 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1hf9 h ALA 14 CO 0.03 -0.47 0.00 1.17 0.00 0.00 0.00 179.25 179.99 1hf9 n LYS 15 N -5.07 0.13 0.02 0.00 4.81 -1.06 -2.35 118.16 114.65 1hf9 n LYS 15 Ca -0.08 0.36 -0.11 0.00 -0.87 0.00 0.00 58.31 57.61 1hf9 n LYS 15 Cb 0.26 -1.75 -0.14 0.00 0.02 0.00 0.00 35.03 33.43 1hf9 n LYS 15 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1hf9 h GLU 16 N 0.00 0.08 0.07 1.64 4.57 -0.61 -2.10 114.58 118.23 1hf9 h GLU 16 Ca 0.00 -0.14 -0.27 0.00 -1.18 0.00 0.00 59.36 57.77 1hf9 h GLU 16 Cb 0.33 0.05 0.02 0.00 -0.16 0.00 0.00 28.75 28.99 1hf9 h GLU 16 CO 0.00 0.83 -1.12 0.97 -1.18 0.00 0.00 179.01 178.51 1hf9 h ILE 17 N 0.02 1.35 0.02 2.32 -0.00 -0.78 -0.78 117.51 119.66 1hf9 h ILE 17 Ca -0.21 -2.51 -0.25 0.00 -0.00 0.00 0.00 64.86 61.88 1hf9 h ILE 17 Cb 1.95 2.59 0.01 0.00 -0.00 0.00 0.00 36.82 41.38 1hf9 h ILE 17 CO 0.11 0.76 -1.04 -0.08 -0.00 0.00 0.00 178.15 177.90 1hf9 h GLU 18 N 0.25 0.54 0.00 2.19 4.22 -1.60 -2.58 114.58 117.61 1hf9 h GLU 18 Ca -0.14 -0.62 -0.13 0.00 0.08 0.00 0.00 59.36 58.55 1hf9 h GLU 18 Cb 1.78 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 31.20 1hf9 h GLU 18 CO 0.20 1.23 -0.64 -0.09 -2.18 0.00 0.00 179.01 177.53 1hf9 h ARG 19 N 0.29 0.00 -0.23 1.92 9.65 -1.44 -2.78 114.38 121.79 1hf9 h ARG 19 Ca -0.12 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.57 1hf9 h ARG 19 Cb 1.69 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.27 1hf9 h ARG 19 CO 0.19 0.64 -0.61 -0.07 2.80 0.00 0.00 179.97 182.92 1hf9 h LEU 20 N 0.00 0.89 -0.22 3.80 -0.00 -1.14 -2.25 115.31 116.39 1hf9 h LEU 20 Ca -0.01 -0.51 -0.01 0.00 -0.00 0.00 0.00 57.88 57.36 1hf9 h LEU 20 Cb 1.16 -0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 41.55 1hf9 h LEU 20 CO 0.08 1.29 0.11 -0.61 -0.00 0.00 0.00 178.44 179.32 1hf9 h GLN 21 N 0.59 0.32 -0.29 1.13 4.15 -1.38 -1.59 115.11 118.04 1hf9 h GLN 21 Ca -0.01 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.34 1hf9 h GLN 21 Cb 1.22 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.83 1hf9 h GLN 21 CO 0.13 0.31 0.04 -0.22 -1.93 0.00 0.00 178.83 177.16 1hf9 h LYS 22 N 0.24 0.42 -0.35 1.69 3.11 -1.50 -2.19 116.57 117.99 1hf9 h LYS 22 Ca 0.08 -0.07 -0.10 0.00 -2.81 0.00 0.00 60.65 57.75 1hf9 h LYS 22 Cb 0.10 -0.07 -0.02 0.00 -1.00 0.00 0.00 32.23 31.24 1hf9 h LYS 22 CO -0.01 0.43 -0.20 1.49 -2.81 0.00 0.00 179.45 178.34 1hf9 h GLU 23 N 0.42 0.67 -0.57 1.90 4.57 -0.91 -2.64 114.58 118.02 1hf9 h GLU 23 Ca 0.10 -0.25 -0.08 0.00 -1.18 0.00 0.00 59.36 57.95 1hf9 h GLU 23 Cb 0.22 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 1hf9 h GLU 23 CO 0.00 0.82 0.04 -0.84 -1.18 0.00 0.00 179.01 177.85 1hf9 h ILE 24 N 0.59 1.26 -0.71 2.32 -0.00 -0.68 -2.76 117.51 117.54 1hf9 h ILE 24 Ca 0.09 -1.07 0.02 0.00 -0.00 0.00 0.00 64.86 63.90 1hf9 h ILE 24 Cb 0.67 0.83 -0.04 0.00 -0.00 0.00 0.00 36.82 38.28 1hf9 h ILE 24 CO 0.05 0.39 0.46 -0.08 -0.00 0.00 0.00 178.15 178.96 1hf9 h GLU 25 N 0.87 0.88 -0.15 0.16 4.57 -1.29 -1.01 114.58 118.62 1hf9 h GLU 25 Ca 0.17 -0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.33 1hf9 h GLU 25 Cb 0.49 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.85 1hf9 h GLU 25 CO 0.02 0.58 -0.09 -0.09 -1.18 0.00 0.00 179.01 178.26 1hf9 h ARG 26 N 0.91 -0.08 0.00 1.92 2.43 -1.25 0.84 114.38 119.16 1hf9 h ARG 26 Ca 0.27 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.44 1hf9 h ARG 26 Cb -0.04 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1hf9 h ARG 26 CO -0.08 -0.05 -0.06 0.45 -1.51 0.00 0.00 179.97 178.72 1hf9 h HIS 27 N -0.08 0.00 0.00 2.20 3.86 -1.18 -0.82 115.15 119.13 1hf9 h HIS 27 Ca 0.09 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.15 1hf9 h HIS 27 Cb 0.21 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 1hf9 h HIS 27 CO -0.22 0.06 -0.71 -0.22 0.86 0.00 0.00 177.93 177.70 1hf9 h LYS 28 N 0.00 0.00 0.00 2.45 3.64 0.45 -2.08 116.57 121.04 1hf9 h LYS 28 Ca -0.00 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.19 1hf9 h LYS 28 Cb 0.16 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1hf9 h LYS 28 CO 0.01 0.71 -0.85 0.37 -2.27 0.00 0.00 179.45 177.42 1hf9 h GLN 29 N 0.00 0.13 0.06 1.90 4.15 0.28 -1.17 115.11 120.45 1hf9 h GLN 29 Ca -0.01 -0.14 -0.28 0.00 0.77 0.00 0.00 58.65 59.00 1hf9 h GLN 29 Cb 1.26 0.04 0.02 0.00 0.21 0.00 0.00 27.48 29.01 1hf9 h GLN 29 CO 0.09 0.90 -1.14 0.77 -1.93 0.00 0.00 178.83 177.52 1hf9 h SER 30 N 0.07 0.82 0.87 -0.69 0.02 -1.39 -1.52 113.55 111.73 1hf9 h SER 30 Ca -0.03 -0.72 -0.15 0.00 -0.84 0.00 0.00 61.79 60.06 1hf9 h SER 30 Cb 1.47 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.74 1hf9 h SER 30 CO 0.12 1.52 -0.70 -0.29 -1.14 0.00 0.00 176.83 176.34 1hf9 h ILE 31 N 0.30 1.40 0.11 3.27 6.09 -1.42 -1.41 117.51 125.85 1hf9 h ILE 31 Ca -0.15 -2.49 -0.26 0.00 -1.37 0.00 0.00 64.86 60.58 1hf9 h ILE 31 Cb 1.80 2.38 0.00 0.00 0.47 0.00 0.00 36.82 41.47 1hf9 h ILE 31 CO 0.22 0.69 -1.20 0.50 -3.07 0.00 0.00 178.15 175.28 1hf9 h LYS 32 N 0.00 0.24 0.00 2.19 1.63 -1.25 -2.25 116.57 117.13 1hf9 h LYS 32 Ca -0.01 -0.40 -0.19 0.00 -0.85 0.00 0.00 60.65 59.20 1hf9 h LYS 32 Cb 1.33 0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 33.08 1hf9 h LYS 32 CO 0.09 1.19 -0.92 -0.22 -3.45 0.00 0.00 179.45 176.14 1hf9 h LYS 33 N 0.07 0.00 0.04 1.90 3.64 -1.28 -2.50 116.57 118.44 1hf9 h LYS 33 Ca -0.12 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.04 1hf9 h LYS 33 Cb 1.93 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.74 1hf9 h LYS 33 CO 0.19 0.92 -1.02 -0.07 -2.27 0.00 0.00 179.45 177.21 1hf9 h LEU 34 N 0.00 0.23 -0.21 5.20 3.38 -1.32 -2.29 115.31 120.30 1hf9 h LEU 34 Ca -0.01 -0.22 -0.22 0.00 0.09 0.00 0.00 57.88 57.52 1hf9 h LEU 34 Cb 1.65 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.33 1hf9 h LEU 34 CO 0.12 1.11 -0.86 0.50 0.09 0.00 0.00 178.44 179.39 1hf9 h LYS 35 N 0.07 0.54 -0.07 1.13 3.64 -1.44 -2.70 116.57 117.74 1hf9 h LYS 35 Ca -0.06 -0.50 -0.17 0.00 -1.27 0.00 0.00 60.65 58.65 1hf9 h LYS 35 Cb 1.71 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.65 1hf9 h LYS 35 CO 0.15 1.13 -0.68 0.37 -2.27 0.00 0.00 179.45 178.16 1hf9 h GLN 36 N 0.34 0.31 0.00 1.90 5.75 -1.50 -3.03 115.11 118.88 1hf9 h GLN 36 Ca -0.07 -0.24 -0.10 0.00 -0.15 0.00 0.00 58.65 58.09 1hf9 h GLN 36 Cb 1.48 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 30.06 1hf9 h GLN 36 CO 0.16 0.88 -0.46 0.77 -2.65 0.00 0.00 178.83 177.53 1hf9 h SER 37 N 0.22 0.00 0.42 -0.69 0.02 -1.41 -2.62 113.55 109.49 1hf9 h SER 37 Ca -0.02 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.88 1hf9 h SER 37 Cb 1.23 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 1hf9 h SER 37 CO 0.11 0.46 -0.22 -0.08 -1.14 0.00 0.00 176.83 175.96 1hf9 h GLU 38 N 0.00 0.00 0.00 3.45 4.81 -1.35 -2.12 114.58 119.37 1hf9 h GLU 38 Ca -0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1hf9 h GLU 38 Cb 0.82 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 1hf9 h GLU 38 CO 0.06 0.22 -0.17 0.22 -0.73 0.00 0.00 179.01 178.62 1hf9 h ASP 39 N 0.00 0.00 -3.91 1.04 3.58 -1.49 -3.49 116.42 112.15 1hf9 h ASP 39 Ca -0.00 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.48 1hf9 h ASP 39 Cb 0.49 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.52 1hf9 h ASP 39 CO 0.03 0.17 -0.47 -0.67 -2.88 0.00 0.00 179.24 175.41 1hf9 n ASP 40 N -3.63 -3.77 -0.94 2.28 -0.08 -0.80 -5.16 116.55 104.45 1hf9 n ASP 40 Ca -0.01 0.81 0.12 0.00 -1.51 0.00 0.00 54.79 54.20 1hf9 n ASP 40 Cb 0.30 -1.86 0.11 0.00 2.34 0.00 0.00 41.12 42.01 1hf9 n ASP 40 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65