#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 0.00 -4.48 0.00 -0.00 -1.26 -5.18 117.00 106.08 1hf9 n LEU 2 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 56.01 55.76 1hf9 n LEU 2 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.32 1hf9 n LEU 2 CO 0.00 0.00 -0.48 -0.54 -0.00 0.00 0.00 177.39 176.37 1hf9 s LYS 3 N 0.00 1.71 -0.25 1.47 3.01 -1.26 -5.07 119.74 119.35 1hf9 s LYS 3 Ca 0.00 -1.69 -0.16 0.00 -1.01 0.00 0.00 55.97 53.11 1hf9 s LYS 3 Cb 0.00 -1.83 -0.13 0.00 -1.01 0.00 0.00 37.83 34.87 1hf9 s LYS 3 CO 0.00 0.35 -0.20 1.63 0.51 0.00 0.00 175.35 177.64 1hf9 n LYS 4 N -0.47 0.57 -0.33 1.68 4.76 -1.26 -3.87 118.16 119.24 1hf9 n LYS 4 Ca -0.07 0.35 0.11 0.00 -2.87 0.00 0.00 58.31 55.84 1hf9 n LYS 4 Cb 0.59 -1.56 0.29 0.00 -1.84 0.00 0.00 35.03 32.51 1hf9 n LYS 4 CO 0.00 0.00 0.00 1.12 -1.37 0.00 0.00 177.40 177.15 1hf9 h HIS 5 N -1.00 0.96 0.48 2.13 2.07 -2.00 -1.05 115.15 116.74 1hf9 h HIS 5 Ca -0.51 0.03 -0.02 0.00 -2.85 0.00 0.00 60.37 57.02 1hf9 h HIS 5 Cb 1.43 -0.28 0.00 0.00 2.57 0.00 0.00 27.41 31.13 1hf9 h HIS 5 CO -0.08 0.20 -0.23 0.45 -3.07 0.00 0.00 177.93 175.20 1hf9 h HIS 6 N 0.70 -0.59 -0.23 6.12 3.86 -2.00 -2.10 115.15 120.89 1hf9 h HIS 6 Ca 0.55 -0.01 0.07 0.00 -1.16 0.00 0.00 60.37 59.81 1hf9 h HIS 6 Cb 0.84 0.20 -0.01 0.00 1.06 0.00 0.00 27.41 29.50 1hf9 h HIS 6 CO -0.04 -0.31 0.40 1.49 0.86 0.00 0.00 177.93 180.33 1hf9 h GLU 7 N -0.78 0.00 0.47 2.45 4.81 -1.43 0.10 114.58 120.21 1hf9 h GLU 7 Ca -0.07 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1hf9 h GLU 7 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1hf9 h GLU 7 CO 0.11 0.00 -0.23 -0.91 -0.73 0.00 0.00 179.01 177.25 1hf9 h ASN 8 N 0.00 -0.53 0.48 1.04 2.35 -0.54 0.02 115.58 118.40 1hf9 h ASN 8 Ca 0.11 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1hf9 h ASN 8 Cb 0.91 0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.41 1hf9 h ASN 8 CO -0.00 -0.18 0.00 -0.62 -1.65 0.00 0.00 177.43 174.98 1hf9 n GLU 9 N -4.79 0.03 0.01 0.81 1.02 -0.80 -1.87 120.64 115.05 1hf9 n GLU 9 Ca -0.08 0.30 -0.06 0.00 -0.02 0.00 0.00 57.16 57.30 1hf9 n GLU 9 Cb 0.25 -1.56 -0.12 0.00 -0.02 0.00 0.00 31.44 29.99 1hf9 n GLU 9 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1hf9 h ILE 10 N 0.00 0.92 0.01 -3.67 2.04 -0.75 -2.74 117.51 113.32 1hf9 h ILE 10 Ca 0.00 -2.66 -0.20 0.00 1.00 0.00 0.00 64.86 63.00 1hf9 h ILE 10 Cb 0.24 2.41 -0.03 0.00 -0.74 0.00 0.00 36.82 38.71 1hf9 h ILE 10 CO 0.00 0.52 -0.97 0.28 0.00 0.00 0.00 178.15 177.99 1hf9 h SER 11 N 0.00 0.02 0.00 1.72 0.02 -0.24 -1.77 113.55 113.31 1hf9 h SER 11 Ca -0.20 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.68 1hf9 h SER 11 Cb 1.86 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.39 1hf9 h SER 11 CO 0.08 0.97 -0.17 -0.74 -1.14 0.00 0.00 176.83 175.83 1hf9 h HIS 12 N 0.01 0.17 0.00 3.45 -0.00 -1.57 -2.65 115.15 114.56 1hf9 h HIS 12 Ca -0.02 -0.09 -0.04 0.00 -0.00 0.00 0.00 60.37 60.22 1hf9 h HIS 12 Cb 1.70 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 29.08 1hf9 h HIS 12 CO 0.00 0.90 -0.21 0.45 -0.00 0.00 0.00 177.93 179.07 1hf9 h HIS 13 N -0.61 0.00 -0.14 5.26 3.86 -1.57 -2.20 115.15 119.75 1hf9 h HIS 13 Ca -0.02 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 1hf9 h HIS 13 Cb 0.95 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.42 1hf9 h HIS 13 CO 0.19 0.21 0.02 0.00 0.86 0.00 0.00 177.93 179.22 1hf9 h ALA 14 N 1.79 0.18 0.00 2.45 0.00 -1.31 -1.30 119.26 121.06 1hf9 h ALA 14 Ca -0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1hf9 h ALA 14 Cb 0.44 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1hf9 h ALA 14 CO 0.03 -0.16 -0.11 -0.22 0.00 0.00 0.00 179.25 178.79 1hf9 h LYS 15 N 0.00 0.00 -0.03 0.00 3.64 -1.10 -1.52 116.57 117.57 1hf9 h LYS 15 Ca 0.04 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.20 1hf9 h LYS 15 Cb 0.30 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1hf9 h LYS 15 CO 0.00 0.11 -0.89 0.93 -2.27 0.00 0.00 179.45 177.34 1hf9 h GLU 16 N 0.00 0.45 0.00 1.90 3.07 -0.88 -1.72 114.58 117.40 1hf9 h GLU 16 Ca -0.00 -0.44 -0.09 0.00 -0.50 0.00 0.00 59.36 58.32 1hf9 h GLU 16 Cb 0.31 0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 1hf9 h GLU 16 CO 0.01 1.09 -0.43 0.97 -1.40 0.00 0.00 179.01 179.26 1hf9 h ILE 17 N 0.27 0.79 0.14 3.13 2.10 -0.63 -2.03 117.51 121.27 1hf9 h ILE 17 Ca -0.07 -1.96 -0.29 0.00 1.08 0.00 0.00 64.86 63.62 1hf9 h ILE 17 Cb 1.51 2.28 0.00 0.00 -1.09 0.00 0.00 36.82 39.52 1hf9 h ILE 17 CO 0.16 0.43 -1.36 -0.08 -1.08 0.00 0.00 178.15 176.21 1hf9 h GLU 18 N 0.00 0.29 -0.11 2.19 4.22 -1.28 -2.40 114.58 117.48 1hf9 h GLU 18 Ca -0.00 -0.49 -0.23 0.00 0.08 0.00 0.00 59.36 58.71 1hf9 h GLU 18 Cb 1.24 0.18 0.01 0.00 0.50 0.00 0.00 28.75 30.69 1hf9 h GLU 18 CO 0.06 1.20 -0.85 -0.09 -2.18 0.00 0.00 179.01 177.15 1hf9 h ARG 19 N 0.08 0.76 -0.53 1.92 2.43 -1.33 -2.39 114.38 115.31 1hf9 h ARG 19 Ca -0.18 -0.67 -0.12 0.00 -0.81 0.00 0.00 59.98 58.20 1hf9 h ARG 19 Cb 2.00 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 31.69 1hf9 h ARG 19 CO 0.20 1.27 -0.14 1.25 -1.51 0.00 0.00 179.97 181.04 1hf9 h LEU 20 N 0.50 1.03 -0.99 3.80 7.12 -1.47 -2.69 115.31 122.61 1hf9 h LEU 20 Ca -0.07 -0.35 -0.05 0.00 0.13 0.00 0.00 57.88 57.53 1hf9 h LEU 20 Cb 1.48 -0.28 -0.03 0.00 -0.53 0.00 0.00 40.66 41.31 1hf9 h LEU 20 CO 0.17 1.15 0.13 -0.61 -0.13 0.00 0.00 178.44 179.15 1hf9 h GLN 21 N 0.90 0.86 -0.48 1.25 4.15 -1.43 -2.64 115.11 117.72 1hf9 h GLN 21 Ca 0.13 -0.18 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 1hf9 h GLN 21 Cb 0.71 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.25 1hf9 h GLN 21 CO 0.05 0.78 0.27 -0.22 -1.93 0.00 0.00 178.83 177.78 1hf9 h LYS 22 N 0.83 0.67 -0.46 1.69 3.11 -1.19 -1.81 116.57 119.41 1hf9 h LYS 22 Ca 0.18 -0.07 0.03 0.00 -2.81 0.00 0.00 60.65 57.97 1hf9 h LYS 22 Cb 0.31 -0.13 -0.03 0.00 -1.00 0.00 0.00 32.23 31.38 1hf9 h LYS 22 CO 0.00 0.52 0.26 0.93 -2.81 0.00 0.00 179.45 178.35 1hf9 h GLU 23 N 0.64 0.51 -0.52 1.90 5.08 -1.18 -1.60 114.58 119.41 1hf9 h GLU 23 Ca 0.17 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1hf9 h GLU 23 Cb 0.04 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1hf9 h GLU 23 CO -0.03 0.34 0.28 -0.84 -1.00 0.00 0.00 179.01 177.76 1hf9 h ILE 24 N 0.52 1.16 -0.72 3.13 -0.00 -1.21 -2.01 117.51 118.39 1hf9 h ILE 24 Ca 0.19 -0.39 0.02 0.00 -0.00 0.00 0.00 64.86 64.68 1hf9 h ILE 24 Cb 0.04 0.46 -0.04 0.00 -0.00 0.00 0.00 36.82 37.28 1hf9 h ILE 24 CO -0.10 0.17 0.46 -0.08 -0.00 0.00 0.00 178.15 178.60 1hf9 h GLU 25 N 0.71 0.88 -0.02 0.16 4.81 -0.43 -0.34 114.58 120.34 1hf9 h GLU 25 Ca 0.18 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1hf9 h GLU 25 Cb 0.02 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1hf9 h GLU 25 CO -0.03 0.58 -0.05 -0.09 -0.73 0.00 0.00 179.01 178.69 1hf9 h ARG 26 N 0.90 -0.07 0.00 1.92 2.43 -0.90 -0.20 114.38 118.47 1hf9 h ARG 26 Ca 0.28 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 1hf9 h ARG 26 Cb -0.01 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1hf9 h ARG 26 CO -0.10 -0.05 -0.04 0.45 -1.51 0.00 0.00 179.97 178.73 1hf9 h HIS 27 N -0.07 0.00 0.00 2.20 3.86 -1.21 -0.89 115.15 119.03 1hf9 h HIS 27 Ca 0.03 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.08 1hf9 h HIS 27 Cb 0.11 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 1hf9 h HIS 27 CO -0.13 0.04 -0.74 -0.22 0.86 0.00 0.00 177.93 177.74 1hf9 h LYS 28 N 0.00 0.00 -0.12 2.45 3.64 0.49 -2.69 116.57 120.34 1hf9 h LYS 28 Ca -0.00 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.17 1hf9 h LYS 28 Cb 0.14 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1hf9 h LYS 28 CO 0.01 0.74 -0.78 0.37 -2.27 0.00 0.00 179.45 177.52 1hf9 h GLN 29 N 0.00 0.65 -0.19 1.90 4.15 0.33 -0.28 115.11 121.67 1hf9 h GLN 29 Ca -0.01 -0.55 -0.12 0.00 0.77 0.00 0.00 58.65 58.75 1hf9 h GLN 29 Cb 1.51 0.12 0.00 0.00 0.21 0.00 0.00 27.48 29.31 1hf9 h GLN 29 CO 0.10 1.16 -0.35 0.66 -1.93 0.00 0.00 178.83 178.46 1hf9 h SER 30 N 0.44 0.64 1.15 -0.69 4.64 -1.52 -1.24 113.55 116.97 1hf9 h SER 30 Ca -0.05 -0.55 -0.06 0.00 -0.47 0.00 0.00 61.79 60.66 1hf9 h SER 30 Cb 1.39 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1hf9 h SER 30 CO 0.15 1.06 -0.30 -0.29 -0.87 0.00 0.00 176.83 176.58 1hf9 h ILE 31 N 0.24 0.63 0.00 0.95 -0.00 -1.53 -2.68 117.51 115.12 1hf9 h ILE 31 Ca 0.01 -1.46 -0.14 0.00 -0.00 0.00 0.00 64.86 63.26 1hf9 h ILE 31 Cb 0.95 1.98 -0.02 0.00 -0.00 0.00 0.00 36.82 39.73 1hf9 h ILE 31 CO 0.08 0.30 -0.81 0.50 -0.00 0.00 0.00 178.15 178.22 1hf9 h LYS 32 N 0.00 0.00 -0.02 2.19 3.64 -0.99 -2.46 116.57 118.93 1hf9 h LYS 32 Ca -0.00 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.15 1hf9 h LYS 32 Cb 0.96 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.80 1hf9 h LYS 32 CO 0.04 0.55 -0.86 -0.22 -2.27 0.00 0.00 179.45 176.68 1hf9 h LYS 33 N 0.00 0.62 -0.12 1.90 1.63 -1.08 -0.35 116.57 119.18 1hf9 h LYS 33 Ca -0.05 -0.64 -0.20 0.00 -0.85 0.00 0.00 60.65 58.92 1hf9 h LYS 33 Cb 1.51 0.18 0.00 0.00 -0.60 0.00 0.00 32.23 33.32 1hf9 h LYS 33 CO 0.07 1.25 -0.73 -0.07 -3.45 0.00 0.00 179.45 176.52 1hf9 h LEU 34 N 0.26 0.67 -0.42 5.20 3.38 -1.57 -2.15 115.31 120.68 1hf9 h LEU 34 Ca -0.10 -0.43 -0.11 0.00 0.09 0.00 0.00 57.88 57.33 1hf9 h LEU 34 Cb 1.53 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.07 1hf9 h LEU 34 CO 0.17 1.19 -0.53 0.50 0.09 0.00 0.00 178.44 179.86 1hf9 h LYS 35 N 0.39 0.00 0.01 1.13 3.64 -1.50 -3.13 116.57 117.11 1hf9 h LYS 35 Ca -0.03 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.15 1hf9 h LYS 35 Cb 1.32 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.12 1hf9 h LYS 35 CO 0.14 0.53 -0.92 1.96 -2.27 0.00 0.00 179.45 178.89 1hf9 h GLN 36 N 0.00 0.06 -0.02 1.90 1.08 -0.99 -3.20 115.11 113.94 1hf9 h GLN 36 Ca -0.01 -0.08 -0.10 0.00 -1.45 0.00 0.00 58.65 57.01 1hf9 h GLN 36 Cb 1.23 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.67 1hf9 h GLN 36 CO 0.07 0.93 -0.47 0.77 -0.95 0.00 0.00 178.83 179.18 1hf9 h SER 37 N 0.03 0.05 -0.18 1.46 0.02 -1.35 1.18 113.55 114.77 1hf9 h SER 37 Ca -0.03 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 1hf9 h SER 37 Cb 1.60 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 64.11 1hf9 h SER 37 CO 0.13 0.52 -0.02 -0.08 -1.14 0.00 0.00 176.83 176.23 1hf9 h GLU 38 N 0.04 0.46 -0.80 3.45 4.22 -1.53 -3.32 114.58 117.11 1hf9 h GLU 38 Ca -0.00 -0.10 -0.33 0.00 0.08 0.00 0.00 59.36 59.01 1hf9 h GLU 38 Cb 0.85 -0.07 -0.31 0.00 0.50 0.00 0.00 28.75 29.72 1hf9 h GLU 38 CO 0.06 0.51 -0.91 -0.40 -2.18 0.00 0.00 179.01 176.10 1hf9 n ASP 39 N -4.28 0.12 -4.59 1.04 5.68 -1.07 -5.12 116.55 108.32 1hf9 n ASP 39 Ca 0.01 -2.77 -0.44 0.00 -0.50 0.00 0.00 54.79 51.08 1hf9 n ASP 39 Cb 0.25 0.09 -0.01 0.00 -1.14 0.00 0.00 41.12 40.30 1hf9 n ASP 39 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1hf9 n ASP 40 N -0.12 1.28 0.00 -1.12 -0.08 0.41 -4.94 116.55 111.98 1hf9 n ASP 40 Ca 0.08 1.18 0.00 0.00 -1.51 0.00 0.00 54.79 54.53 1hf9 n ASP 40 Cb 0.79 -1.29 0.00 0.00 2.34 0.00 0.00 41.12 42.96 1hf9 n ASP 40 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65