#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hf9 h LEU 2 N 0.00 0.00 -3.29 0.00 6.46 -2.09 -3.19 115.31 113.19 1hf9 h LEU 2 Ca 0.00 0.00 -0.24 0.00 -0.12 0.00 0.00 57.88 57.52 1hf9 h LEU 2 Cb 0.00 0.00 -0.14 0.00 -0.73 0.00 0.00 40.66 39.79 1hf9 h LEU 2 CO 0.00 0.59 0.30 0.29 -0.62 0.00 0.00 178.44 179.00 1hf9 n LYS 3 N -3.27 2.78 -0.04 1.25 5.02 -1.26 -4.35 118.16 118.28 1hf9 n LYS 3 Ca 0.01 -2.34 -0.11 0.00 -2.02 0.00 0.00 58.31 53.86 1hf9 n LYS 3 Cb 0.76 -1.98 0.03 0.00 -0.02 0.00 0.00 35.03 33.82 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 1.69 0.71 -0.38 1.97 3.11 -2.03 -2.94 116.57 118.70 1hf9 h LYS 4 Ca 0.29 -0.41 0.11 0.00 -2.81 0.00 0.00 60.65 57.83 1hf9 h LYS 4 Cb 2.11 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 33.36 1hf9 h LYS 4 CO 0.66 1.03 0.31 1.12 -2.81 0.00 0.00 179.45 179.76 1hf9 h HIS 5 N 0.56 0.00 -0.58 1.91 2.07 -1.86 -1.10 115.15 116.15 1hf9 h HIS 5 Ca 0.03 0.00 0.02 0.00 -2.85 0.00 0.00 60.37 57.57 1hf9 h HIS 5 Cb 1.05 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.99 1hf9 h HIS 5 CO 0.05 0.00 0.36 0.45 -3.07 0.00 0.00 177.93 175.72 1hf9 h HIS 6 N 0.00 0.67 -0.13 6.12 3.86 -1.85 -0.91 115.15 122.92 1hf9 h HIS 6 Ca 0.18 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.45 1hf9 h HIS 6 Cb 0.80 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 29.04 1hf9 h HIS 6 CO 0.00 0.39 0.13 1.49 0.86 0.00 0.00 177.93 180.80 1hf9 h GLU 7 N 0.71 0.00 0.38 2.45 4.22 -1.34 -0.92 114.58 120.08 1hf9 h GLU 7 Ca 0.23 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.65 1hf9 h GLU 7 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1hf9 h GLU 7 CO -0.09 0.00 -0.18 -0.91 -2.18 0.00 0.00 179.01 175.64 1hf9 h ASN 8 N 0.00 -0.44 -0.05 1.04 4.21 -1.22 -2.66 115.58 116.47 1hf9 h ASN 8 Ca 0.06 -0.04 0.01 0.00 1.21 0.00 0.00 56.30 57.54 1hf9 h ASN 8 Cb 0.31 0.11 -0.00 0.00 -1.12 0.00 0.00 38.32 37.62 1hf9 h ASN 8 CO -0.00 0.01 0.17 -0.33 -1.29 0.00 0.00 177.43 175.99 1hf9 h GLU 9 N -1.10 0.00 0.12 0.81 5.08 -1.12 -1.60 114.58 116.77 1hf9 h GLU 9 Ca -0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1hf9 h GLU 9 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1hf9 h GLU 9 CO 0.09 0.00 -0.06 0.97 -1.00 0.00 0.00 179.01 179.01 1hf9 h ILE 10 N 0.00 1.06 0.00 3.13 2.10 -1.09 -2.13 117.51 120.58 1hf9 h ILE 10 Ca 0.02 -1.08 -0.01 0.00 1.08 0.00 0.00 64.86 64.87 1hf9 h ILE 10 Cb 0.37 1.69 -0.00 0.00 -1.09 0.00 0.00 36.82 37.79 1hf9 h ILE 10 CO -0.00 0.24 -0.07 -1.28 -1.08 0.00 0.00 178.15 175.96 1hf9 h SER 11 N -0.71 0.00 0.02 2.19 0.87 -0.95 -2.20 113.55 112.77 1hf9 h SER 11 Ca -0.02 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.41 1hf9 h SER 11 Cb 0.53 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.50 1hf9 h SER 11 CO 0.03 0.07 -0.54 -0.74 -0.53 0.00 0.00 176.83 175.12 1hf9 h HIS 12 N 0.00 0.51 0.00 2.24 -0.00 -1.38 -2.77 115.15 113.75 1hf9 h HIS 12 Ca -0.00 -0.29 -0.03 0.00 -0.00 0.00 0.00 60.37 60.05 1hf9 h HIS 12 Cb 0.23 -0.05 -0.00 0.00 -0.00 0.00 0.00 27.41 27.59 1hf9 h HIS 12 CO 0.00 1.12 -0.14 0.45 -0.00 0.00 0.00 177.93 179.36 1hf9 h HIS 13 N -0.24 0.00 0.27 5.26 -0.00 -1.00 -0.23 115.15 119.20 1hf9 h HIS 13 Ca -0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.28 1hf9 h HIS 13 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.70 1hf9 h HIS 13 CO 0.16 0.14 -0.13 0.00 -0.00 0.00 0.00 177.93 178.11 1hf9 h ALA 14 N 1.86 -0.36 0.00 2.45 0.00 -1.40 -1.25 119.26 120.55 1hf9 h ALA 14 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1hf9 h ALA 14 Cb 0.34 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1hf9 h ALA 14 CO 0.02 -0.46 0.00 1.63 0.00 0.00 0.00 179.25 180.44 1hf9 n LYS 15 N -5.05 0.19 0.05 0.00 5.02 -1.05 -2.01 118.16 115.31 1hf9 n LYS 15 Ca -0.09 0.46 -0.15 0.00 -2.02 0.00 0.00 58.31 56.52 1hf9 n LYS 15 Cb 0.26 -1.89 -0.14 0.00 -0.02 0.00 0.00 35.03 33.24 1hf9 n LYS 15 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1hf9 h GLU 16 N 0.00 0.20 0.06 1.97 4.39 -0.90 -1.43 114.58 118.86 1hf9 h GLU 16 Ca 0.00 -0.34 -0.24 0.00 0.34 0.00 0.00 59.36 59.12 1hf9 h GLU 16 Cb 0.30 0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1hf9 h GLU 16 CO 0.00 1.04 -1.08 0.97 -1.16 0.00 0.00 179.01 178.78 1hf9 h ILE 17 N 0.05 1.50 0.20 3.13 -0.00 -0.83 -0.63 117.51 120.93 1hf9 h ILE 17 Ca -0.23 -2.88 -0.32 0.00 -0.00 0.00 0.00 64.86 61.44 1hf9 h ILE 17 Cb 1.99 2.72 0.03 0.00 -0.00 0.00 0.00 36.82 41.56 1hf9 h ILE 17 CO 0.15 0.84 -1.38 -0.33 -0.00 0.00 0.00 178.15 177.43 1hf9 h GLU 18 N 0.11 0.53 0.00 2.19 4.39 -1.53 -2.55 114.58 117.72 1hf9 h GLU 18 Ca -0.09 -0.84 -0.13 0.00 0.34 0.00 0.00 59.36 58.64 1hf9 h GLU 18 Cb 1.77 0.30 -0.02 0.00 -0.10 0.00 0.00 28.75 30.70 1hf9 h GLU 18 CO 0.17 1.39 -0.62 -0.09 -1.16 0.00 0.00 179.01 178.70 1hf9 h ARG 19 N 0.18 0.00 -0.20 2.33 2.43 -1.33 -2.76 114.38 115.03 1hf9 h ARG 19 Ca -0.22 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.74 1hf9 h ARG 19 Cb 2.06 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 31.62 1hf9 h ARG 19 CO 0.26 0.62 -0.71 -0.07 -1.51 0.00 0.00 179.97 178.56 1hf9 h LEU 20 N 0.00 0.96 -0.41 3.80 3.38 -1.16 -2.45 115.31 119.42 1hf9 h LEU 20 Ca -0.01 -0.59 -0.01 0.00 0.09 0.00 0.00 57.88 57.36 1hf9 h LEU 20 Cb 1.17 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1hf9 h LEU 20 CO 0.08 1.39 0.22 -0.61 0.09 0.00 0.00 178.44 179.61 1hf9 h GLN 21 N 0.58 0.58 -0.55 1.13 4.15 -1.39 -1.77 115.11 117.85 1hf9 h GLN 21 Ca -0.03 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.27 1hf9 h GLN 21 Cb 1.33 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.89 1hf9 h GLN 21 CO 0.15 0.49 0.16 -0.22 -1.93 0.00 0.00 178.83 177.47 1hf9 h LYS 22 N 0.53 0.83 -0.59 1.69 3.64 -1.50 -2.51 116.57 118.66 1hf9 h LYS 22 Ca 0.14 -0.16 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1hf9 h LYS 22 Cb 0.08 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1hf9 h LYS 22 CO -0.02 0.73 0.10 1.49 -2.27 0.00 0.00 179.45 179.48 1hf9 h GLU 23 N 0.81 0.94 -0.68 1.90 4.57 -1.01 -2.63 114.58 118.48 1hf9 h GLU 23 Ca 0.18 -0.23 -0.08 0.00 -1.18 0.00 0.00 59.36 58.06 1hf9 h GLU 23 Cb 0.25 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 1hf9 h GLU 23 CO -0.01 0.87 0.11 -0.84 -1.18 0.00 0.00 179.01 177.96 1hf9 h ILE 24 N 0.89 1.26 -0.59 2.32 -0.00 -0.92 -2.76 117.51 117.71 1hf9 h ILE 24 Ca 0.18 -1.04 0.03 0.00 -0.00 0.00 0.00 64.86 64.03 1hf9 h ILE 24 Cb 0.38 0.62 -0.04 0.00 -0.00 0.00 0.00 36.82 37.79 1hf9 h ILE 24 CO 0.01 0.39 0.36 -0.08 -0.00 0.00 0.00 178.15 178.83 1hf9 h GLU 25 N 1.04 0.69 -0.19 0.16 4.57 -1.16 -0.67 114.58 119.02 1hf9 h GLU 25 Ca 0.21 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.38 1hf9 h GLU 25 Cb 0.44 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.84 1hf9 h GLU 25 CO 0.01 0.45 -0.03 -0.09 -1.18 0.00 0.00 179.01 178.17 1hf9 h ARG 26 N 0.71 0.02 0.00 1.92 1.12 -1.23 0.26 114.38 117.17 1hf9 h ARG 26 Ca 0.24 -0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 59.09 1hf9 h ARG 26 Cb 0.03 -0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 29.98 1hf9 h ARG 26 CO -0.10 0.01 -0.08 0.45 -3.11 0.00 0.00 179.97 177.14 1hf9 h HIS 27 N 0.02 0.00 0.00 2.20 3.86 -1.18 -0.98 115.15 119.06 1hf9 h HIS 27 Ca 0.09 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.18 1hf9 h HIS 27 Cb 0.13 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.58 1hf9 h HIS 27 CO -0.20 0.08 -0.55 -0.22 0.86 0.00 0.00 177.93 177.90 1hf9 h LYS 28 N 0.00 0.00 0.02 2.45 3.64 0.53 -2.61 116.57 120.60 1hf9 h LYS 28 Ca -0.00 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 59.14 1hf9 h LYS 28 Cb 0.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1hf9 h LYS 28 CO 0.01 0.55 -0.99 0.37 -2.27 0.00 0.00 179.45 177.12 1hf9 h GLN 29 N 0.00 0.42 -0.12 1.90 5.75 0.29 -1.81 115.11 121.53 1hf9 h GLN 29 Ca -0.01 -0.47 -0.20 0.00 -0.15 0.00 0.00 58.65 57.82 1hf9 h GLN 29 Cb 1.32 0.14 0.01 0.00 1.07 0.00 0.00 27.48 30.02 1hf9 h GLN 29 CO 0.07 1.14 -0.72 0.77 -2.65 0.00 0.00 178.83 177.44 1hf9 h SER 30 N 0.22 0.85 0.76 -0.69 0.02 -1.49 -1.81 113.55 111.41 1hf9 h SER 30 Ca -0.09 -0.64 -0.09 0.00 -0.84 0.00 0.00 61.79 60.12 1hf9 h SER 30 Cb 1.63 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.91 1hf9 h SER 30 CO 0.17 1.36 -0.43 -0.29 -1.14 0.00 0.00 176.83 176.50 1hf9 h ILE 31 N 0.40 1.04 0.15 3.27 6.09 -1.53 -1.30 117.51 125.63 1hf9 h ILE 31 Ca -0.05 -1.64 -0.29 0.00 -1.37 0.00 0.00 64.86 61.50 1hf9 h ILE 31 Cb 1.36 1.96 0.01 0.00 0.47 0.00 0.00 36.82 40.62 1hf9 h ILE 31 CO 0.15 0.42 -1.29 0.50 -3.07 0.00 0.00 178.15 174.86 1hf9 h LYS 32 N 0.00 0.36 0.00 2.19 1.63 -1.30 -2.30 116.57 117.14 1hf9 h LYS 32 Ca -0.00 -0.59 -0.13 0.00 -0.85 0.00 0.00 60.65 59.08 1hf9 h LYS 32 Cb 0.93 0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 32.76 1hf9 h LYS 32 CO 0.06 1.28 -0.60 -0.22 -3.45 0.00 0.00 179.45 176.51 1hf9 h LYS 33 N 0.11 0.00 0.10 1.90 3.64 -1.26 -2.44 116.57 118.62 1hf9 h LYS 33 Ca -0.16 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 58.95 1hf9 h LYS 33 Cb 2.00 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.82 1hf9 h LYS 33 CO 0.22 0.60 -1.21 -0.07 -2.27 0.00 0.00 179.45 176.72 1hf9 h LEU 34 N 0.00 0.32 -0.32 5.20 3.38 -1.30 -2.17 115.31 120.43 1hf9 h LEU 34 Ca -0.01 -0.35 -0.20 0.00 0.09 0.00 0.00 57.88 57.41 1hf9 h LEU 34 Cb 1.36 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1hf9 h LEU 34 CO 0.08 1.28 -0.83 0.11 0.09 0.00 0.00 178.44 179.17 1hf9 h LYS 35 N 0.06 0.33 0.02 1.13 1.79 -1.43 -1.86 116.57 116.62 1hf9 h LYS 35 Ca -0.11 -0.32 -0.21 0.00 -2.18 0.00 0.00 60.65 57.83 1hf9 h LYS 35 Cb 1.93 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 32.65 1hf9 h LYS 35 CO 0.18 0.99 -0.95 0.37 -1.08 0.00 0.00 179.45 178.96 1hf9 h GLN 36 N 0.21 0.16 0.00 3.15 4.15 -1.51 -3.04 115.11 118.22 1hf9 h GLN 36 Ca -0.05 -0.20 -0.13 0.00 0.77 0.00 0.00 58.65 59.04 1hf9 h GLN 36 Cb 1.43 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 29.17 1hf9 h GLN 36 CO 0.14 0.99 -0.64 0.66 -1.93 0.00 0.00 178.83 178.05 1hf9 h SER 37 N 0.07 0.00 1.00 -0.69 4.64 -1.39 -3.12 113.55 114.07 1hf9 h SER 37 Ca -0.05 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.17 1hf9 h SER 37 Cb 1.62 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.70 1hf9 h SER 37 CO 0.14 0.64 -0.47 -0.08 -0.87 0.00 0.00 176.83 176.19 1hf9 h GLU 38 N 0.00 0.00 0.00 4.77 4.22 -1.33 -3.04 114.58 119.19 1hf9 h GLU 38 Ca -0.01 0.00 -0.10 0.00 0.08 0.00 0.00 59.36 59.34 1hf9 h GLU 38 Cb 1.32 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.55 1hf9 h GLU 38 CO 0.08 0.47 -0.46 0.22 -2.18 0.00 0.00 179.01 177.14 1hf9 h ASP 39 N 0.00 0.00 -2.28 1.04 3.58 -1.46 -3.45 116.42 113.85 1hf9 h ASP 39 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1hf9 h ASP 39 Cb 1.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.14 1hf9 h ASP 39 CO 0.06 0.46 0.00 -0.67 -2.88 0.00 0.00 179.24 176.21 1hf9 n ASP 40 N -3.76 0.62 0.00 2.28 2.03 -1.15 -5.13 116.55 111.43 1hf9 n ASP 40 Ca -0.01 -0.30 0.00 0.00 0.52 0.00 0.00 54.79 55.00 1hf9 n ASP 40 Cb 0.52 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 1hf9 n ASP 40 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75