#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 0.96 -3.87 0.00 4.77 -1.26 -5.07 117.00 112.53 1hf9 n LEU 2 Ca 0.00 -1.96 -0.12 0.00 -0.03 0.00 0.00 56.01 53.90 1hf9 n LEU 2 Cb 0.00 -0.10 -0.13 0.00 -2.33 0.00 0.00 43.42 40.87 1hf9 n LEU 2 CO 0.00 0.53 -0.30 -0.54 -1.33 0.00 0.00 177.39 175.76 1hf9 s LYS 3 N -0.60 0.15 -0.03 3.23 3.01 -1.26 -5.09 119.74 119.15 1hf9 s LYS 3 Ca 0.23 -0.08 -0.03 0.00 -1.01 0.00 0.00 55.97 55.08 1hf9 s LYS 3 Cb 0.25 0.06 -0.01 0.00 -1.01 0.00 0.00 37.83 37.12 1hf9 s LYS 3 CO -0.08 -0.03 -0.05 1.63 0.51 0.00 0.00 175.35 177.33 1hf9 n LYS 4 N 2.64 0.08 -0.34 1.68 4.01 -1.26 -3.87 118.16 121.11 1hf9 n LYS 4 Ca -0.15 0.08 0.12 0.00 -0.51 0.00 0.00 58.31 57.84 1hf9 n LYS 4 Cb 0.58 -0.69 0.30 0.00 -0.51 0.00 0.00 35.03 34.71 1hf9 n LYS 4 CO 0.00 0.00 0.00 1.12 -1.11 0.00 0.00 177.40 177.41 1hf9 h HIS 5 N -0.16 0.98 -0.84 2.13 2.07 -2.00 0.15 115.15 117.48 1hf9 h HIS 5 Ca 0.00 0.03 -0.02 0.00 -2.85 0.00 0.00 60.37 57.53 1hf9 h HIS 5 Cb 0.15 -0.29 -0.04 0.00 2.57 0.00 0.00 27.41 29.80 1hf9 h HIS 5 CO -0.06 0.21 0.43 1.25 -3.07 0.00 0.00 177.93 176.69 1hf9 h HIS 6 N 0.71 1.18 0.00 6.12 6.17 -2.00 -1.80 115.15 125.53 1hf9 h HIS 6 Ca 0.55 -0.04 -0.07 0.00 0.71 0.00 0.00 60.37 61.52 1hf9 h HIS 6 Cb 0.85 -0.37 -0.01 0.00 2.52 0.00 0.00 27.41 30.40 1hf9 h HIS 6 CO -0.03 0.83 -0.34 1.49 0.71 0.00 0.00 177.93 180.59 1hf9 h GLU 7 N 1.19 0.00 -0.19 5.26 4.81 -0.86 -2.73 114.58 122.06 1hf9 h GLU 7 Ca 0.29 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 1hf9 h GLU 7 Cb 0.07 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1hf9 h GLU 7 CO -0.04 0.34 0.03 -0.91 -0.73 0.00 0.00 179.01 177.70 1hf9 h ASN 8 N 0.00 0.30 0.28 1.04 2.35 -0.43 0.00 115.58 119.13 1hf9 h ASN 8 Ca -0.00 -0.25 -0.00 0.00 -0.55 0.00 0.00 56.30 55.49 1hf9 h ASN 8 Cb 0.63 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.90 1hf9 h ASN 8 CO 0.04 0.47 -0.25 -0.08 -1.65 0.00 0.00 177.43 175.97 1hf9 h GLU 9 N 0.11 -0.53 0.00 0.81 4.57 -1.26 -0.74 114.58 117.54 1hf9 h GLU 9 Ca 0.06 0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1hf9 h GLU 9 Cb 0.30 0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1hf9 h GLU 9 CO 0.00 -0.36 -0.02 -0.84 -1.18 0.00 0.00 179.01 176.62 1hf9 h ILE 10 N -0.55 0.42 -0.40 2.32 3.07 -1.46 -1.28 117.51 119.63 1hf9 h ILE 10 Ca -0.01 -0.07 0.00 0.00 1.55 0.00 0.00 64.86 66.32 1hf9 h ILE 10 Cb 0.50 1.05 -0.02 0.00 -0.27 0.00 0.00 36.82 38.08 1hf9 h ILE 10 CO -0.03 0.02 0.26 -1.28 -1.05 0.00 0.00 178.15 176.06 1hf9 h SER 11 N 0.00 0.46 -0.05 2.16 0.87 0.54 0.21 113.55 117.75 1hf9 h SER 11 Ca -0.00 -0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.46 1hf9 h SER 11 Cb 0.05 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 1hf9 h SER 11 CO 0.00 0.35 -0.20 -0.74 -0.53 0.00 0.00 176.83 175.72 1hf9 h HIS 12 N 0.53 0.46 0.00 2.24 -0.00 -0.85 -1.73 115.15 115.80 1hf9 h HIS 12 Ca 0.14 -0.08 0.00 0.00 -0.00 0.00 0.00 60.37 60.43 1hf9 h HIS 12 Cb -0.04 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.25 1hf9 h HIS 12 CO -0.04 0.60 0.00 0.45 -0.00 0.00 0.00 177.93 178.93 1hf9 h HIS 13 N 0.38 0.00 0.23 5.26 3.86 -0.93 -2.05 115.15 121.90 1hf9 h HIS 13 Ca 0.06 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 58.95 1hf9 h HIS 13 Cb 0.56 0.00 0.04 0.00 1.06 0.00 0.00 27.41 29.07 1hf9 h HIS 13 CO 0.02 0.00 -1.42 0.00 0.86 0.00 0.00 177.93 177.39 1hf9 h ALA 14 N 2.13 -0.13 0.00 2.45 0.00 0.30 -1.64 119.26 122.36 1hf9 h ALA 14 Ca 0.00 -0.84 -0.09 0.00 0.00 0.00 0.00 54.91 53.98 1hf9 h ALA 14 Cb 0.61 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1hf9 h ALA 14 CO 0.00 0.68 -0.45 -0.22 0.00 0.00 0.00 179.25 179.26 1hf9 h LYS 15 N 0.16 0.00 0.21 0.00 3.64 -1.42 -1.81 116.57 117.35 1hf9 h LYS 15 Ca -0.24 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 58.82 1hf9 h LYS 15 Cb 2.11 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.95 1hf9 h LYS 15 CO 0.27 0.45 -1.41 0.93 -2.27 0.00 0.00 179.45 177.42 1hf9 h GLU 16 N 0.00 0.44 0.00 1.90 3.07 -1.43 -1.74 114.58 116.82 1hf9 h GLU 16 Ca -0.00 -0.74 -0.22 0.00 -0.50 0.00 0.00 59.36 57.89 1hf9 h GLU 16 Cb 1.23 0.28 -0.00 0.00 -0.84 0.00 0.00 28.75 29.42 1hf9 h GLU 16 CO 0.06 1.35 -0.92 0.97 -1.40 0.00 0.00 179.01 179.07 1hf9 h ILE 17 N 0.12 1.43 0.00 3.13 -0.00 -1.33 -1.79 117.51 119.08 1hf9 h ILE 17 Ca -0.22 -2.52 -0.15 0.00 -0.00 0.00 0.00 64.86 61.98 1hf9 h ILE 17 Cb 2.10 2.44 -0.02 0.00 -0.00 0.00 0.00 36.82 41.34 1hf9 h ILE 17 CO 0.25 0.74 -0.72 -0.08 -0.00 0.00 0.00 178.15 178.34 1hf9 h GLU 18 N 0.19 0.00 0.12 2.19 4.81 -1.42 -2.26 114.58 118.20 1hf9 h GLU 18 Ca -0.07 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.89 1hf9 h GLU 18 Cb 1.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.94 1hf9 h GLU 18 CO 0.15 0.72 -1.25 -0.09 -0.73 0.00 0.00 179.01 177.82 1hf9 h ARG 19 N 0.00 0.25 0.00 1.92 2.43 -1.31 -2.51 114.38 115.16 1hf9 h ARG 19 Ca -0.01 -0.43 -0.13 0.00 -0.81 0.00 0.00 59.98 58.60 1hf9 h ARG 19 Cb 1.48 0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 31.17 1hf9 h ARG 19 CO 0.09 1.20 -0.63 -0.07 -1.51 0.00 0.00 179.97 179.05 1hf9 h LEU 20 N 0.07 0.00 -0.10 3.80 3.38 -1.38 -2.84 115.31 118.24 1hf9 h LEU 20 Ca -0.13 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.59 1hf9 h LEU 20 Cb 1.96 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.73 1hf9 h LEU 20 CO 0.20 0.63 -0.93 -0.61 0.09 0.00 0.00 178.44 177.82 1hf9 h GLN 21 N 0.00 0.67 -0.27 1.13 4.15 -1.46 -2.50 115.11 116.82 1hf9 h GLN 21 Ca -0.01 -0.65 -0.01 0.00 0.77 0.00 0.00 58.65 58.75 1hf9 h GLN 21 Cb 1.47 0.17 -0.01 0.00 0.21 0.00 0.00 27.48 29.32 1hf9 h GLN 21 CO 0.08 1.25 0.14 -0.22 -1.93 0.00 0.00 178.83 178.16 1hf9 h LYS 22 N 0.41 0.39 0.10 1.69 3.64 -1.46 0.95 116.57 122.29 1hf9 h LYS 22 Ca -0.09 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1hf9 h LYS 22 Cb 1.57 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.31 1hf9 h LYS 22 CO 0.18 0.36 -0.09 1.49 -2.27 0.00 0.00 179.45 179.12 1hf9 h GLU 23 N 0.32 -0.20 0.00 1.90 4.57 -1.53 -1.08 114.58 118.56 1hf9 h GLU 23 Ca 0.10 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 1hf9 h GLU 23 Cb 0.09 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1hf9 h GLU 23 CO -0.01 -0.13 0.00 0.97 -1.18 0.00 0.00 179.01 178.66 1hf9 h ILE 24 N -0.20 0.00 -0.28 2.32 -0.00 -1.30 -1.87 117.51 116.17 1hf9 h ILE 24 Ca 0.00 -0.22 -0.18 0.00 -0.00 0.00 0.00 64.86 64.46 1hf9 h ILE 24 Cb 0.19 1.14 -0.00 0.00 -0.00 0.00 0.00 36.82 38.15 1hf9 h ILE 24 CO -0.02 0.00 -0.54 -0.08 -0.00 0.00 0.00 178.15 177.51 1hf9 h GLU 25 N 0.00 0.84 -0.05 2.19 4.81 0.48 0.09 114.58 122.94 1hf9 h GLU 25 Ca 0.00 -0.53 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 1hf9 h GLU 25 Cb 0.23 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1hf9 h GLU 25 CO 0.00 1.16 0.00 0.00 -0.73 0.00 0.00 179.01 179.44 1hf9 h ARG 26 N 0.65 0.09 0.00 1.92 3.08 -0.80 -1.34 114.38 117.97 1hf9 h ARG 26 Ca 0.02 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1hf9 h ARG 26 Cb 1.14 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.18 1hf9 h ARG 26 CO 0.12 0.36 -0.13 0.45 -1.07 0.00 0.00 179.97 179.71 1hf9 h HIS 27 N -0.20 0.00 0.00 3.04 3.86 -1.51 -1.90 115.15 118.44 1hf9 h HIS 27 Ca 0.01 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.13 1hf9 h HIS 27 Cb 0.32 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.78 1hf9 h HIS 27 CO 0.03 0.13 -0.44 -0.22 0.86 0.00 0.00 177.93 178.29 1hf9 h LYS 28 N 0.00 0.00 0.13 2.45 3.64 -0.59 -2.20 116.57 120.00 1hf9 h LYS 28 Ca -0.00 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.09 1hf9 h LYS 28 Cb 0.42 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.26 1hf9 h LYS 28 CO 0.02 0.44 -1.24 0.37 -2.27 0.00 0.00 179.45 176.76 1hf9 h GLN 29 N 0.00 0.50 -0.12 1.90 4.15 -0.44 -0.84 115.11 120.26 1hf9 h GLN 29 Ca -0.00 -0.71 -0.16 0.00 0.77 0.00 0.00 58.65 58.55 1hf9 h GLN 29 Cb 1.25 0.24 0.01 0.00 0.21 0.00 0.00 27.48 29.19 1hf9 h GLN 29 CO 0.06 1.32 -0.54 0.77 -1.93 0.00 0.00 178.83 178.51 1hf9 h SER 30 N 0.20 0.68 0.59 -0.69 0.02 -1.52 -0.70 113.55 112.13 1hf9 h SER 30 Ca -0.17 -0.63 -0.15 0.00 -0.84 0.00 0.00 61.79 60.00 1hf9 h SER 30 Cb 1.93 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 64.25 1hf9 h SER 30 CO 0.23 1.20 -0.67 -0.29 -1.14 0.00 0.00 176.83 176.16 1hf9 h ILE 31 N 0.21 1.46 0.00 3.27 6.09 -1.50 -2.66 117.51 124.38 1hf9 h ILE 31 Ca -0.03 -2.24 -0.07 0.00 -1.37 0.00 0.00 64.86 61.15 1hf9 h ILE 31 Cb 1.18 2.20 -0.01 0.00 0.47 0.00 0.00 36.82 40.65 1hf9 h ILE 31 CO 0.11 0.65 -0.34 0.50 -3.07 0.00 0.00 178.15 176.00 1hf9 h LYS 32 N 0.05 0.00 -0.01 2.19 3.64 -1.16 -2.39 116.57 118.89 1hf9 h LYS 32 Ca -0.01 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.11 1hf9 h LYS 32 Cb 1.19 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.03 1hf9 h LYS 32 CO 0.09 0.34 -1.02 -0.22 -2.27 0.00 0.00 179.45 176.36 1hf9 h LYS 33 N 0.00 0.72 0.01 1.90 3.64 -0.95 -1.01 116.57 120.88 1hf9 h LYS 33 Ca -0.00 -0.75 -0.20 0.00 -1.27 0.00 0.00 60.65 58.43 1hf9 h LYS 33 Cb 1.24 0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 33.24 1hf9 h LYS 33 CO 0.04 1.33 -0.92 1.25 -2.27 0.00 0.00 179.45 178.88 1hf9 h LEU 34 N 0.41 0.06 -0.33 5.20 7.12 -1.53 -1.22 115.31 125.02 1hf9 h LEU 34 Ca -0.12 -0.06 -0.17 0.00 0.13 0.00 0.00 57.88 57.66 1hf9 h LEU 34 Cb 1.68 -0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 41.76 1hf9 h LEU 34 CO 0.20 0.95 -0.79 0.50 -0.13 0.00 0.00 178.44 179.17 1hf9 h LYS 35 N 0.02 0.00 0.00 1.25 3.64 -1.47 -0.79 116.57 119.22 1hf9 h LYS 35 Ca -0.02 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.15 1hf9 h LYS 35 Cb 1.61 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.40 1hf9 h LYS 35 CO 0.13 0.79 -1.23 1.96 -2.27 0.00 0.00 179.45 178.83 1hf9 h GLN 36 N 0.00 0.00 0.00 1.90 4.20 -1.18 -3.03 115.11 117.00 1hf9 h GLN 36 Ca -0.01 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.58 1hf9 h GLN 36 Cb 1.45 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.21 1hf9 h GLN 36 CO 0.10 0.62 -0.84 0.77 -0.67 0.00 0.00 178.83 178.82 1hf9 h SER 37 N 0.00 0.00 1.35 1.46 0.02 -1.23 0.54 113.55 115.69 1hf9 h SER 37 Ca -0.13 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.70 1hf9 h SER 37 Cb 1.76 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.28 1hf9 h SER 37 CO 0.09 0.51 -0.67 -0.08 -1.14 0.00 0.00 176.83 175.54 1hf9 h GLU 38 N 0.00 0.00 -0.28 3.45 4.81 -1.23 -3.36 114.58 117.98 1hf9 h GLU 38 Ca -0.06 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 58.95 1hf9 h GLU 38 Cb 1.44 0.00 -0.39 0.00 0.63 0.00 0.00 28.75 30.43 1hf9 h GLU 38 CO 0.06 0.52 -1.06 -0.25 -0.73 0.00 0.00 179.01 177.54 1hf9 n ASP 39 N -3.19 1.27 -4.56 1.04 8.00 -1.15 -5.08 116.55 112.89 1hf9 n ASP 39 Ca 0.00 -2.02 -0.41 0.00 0.71 0.00 0.00 54.79 53.07 1hf9 n ASP 39 Cb 0.77 -0.38 0.02 0.00 -0.02 0.00 0.00 41.12 41.50 1hf9 n ASP 39 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1hf9 n ASP 40 N -0.27 0.47 0.00 -2.24 -0.08 0.19 -4.90 116.55 109.72 1hf9 n ASP 40 Ca 0.05 0.96 0.13 0.00 -1.51 0.00 0.00 54.79 54.42 1hf9 n ASP 40 Cb 0.91 -1.28 0.75 0.00 2.34 0.00 0.00 41.12 43.85 1hf9 n ASP 40 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79