#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 3.06 -0.28 0.00 1.43 -1.26 -5.02 118.68 116.61 1hf9 s LEU 2 Ca 0.00 -0.98 0.08 0.00 -1.03 0.00 0.00 54.13 52.20 1hf9 s LEU 2 Cb 0.00 -1.62 0.63 0.00 0.03 0.00 0.00 46.19 45.23 1hf9 s LEU 2 CO 0.00 -0.93 1.65 0.29 0.23 0.00 0.00 176.35 177.59 1hf9 n LYS 3 N -1.72 3.23 0.02 1.70 4.01 -1.26 -4.21 118.16 119.93 1hf9 n LYS 3 Ca 0.03 -2.58 -0.08 0.00 -0.51 0.00 0.00 58.31 55.17 1hf9 n LYS 3 Cb 0.63 -2.07 -0.13 0.00 -0.51 0.00 0.00 35.03 32.95 1hf9 n LYS 3 CO 0.00 0.00 0.00 1.57 -1.11 0.00 0.00 177.40 177.86 1hf9 h LYS 4 N 2.17 0.01 -0.17 1.97 5.09 -2.03 -3.30 116.57 120.31 1hf9 h LYS 4 Ca 0.25 -0.01 0.05 0.00 0.09 0.00 0.00 60.65 61.02 1hf9 h LYS 4 Cb 2.13 0.01 -0.01 0.00 0.10 0.00 0.00 32.23 34.46 1hf9 h LYS 4 CO 0.65 0.76 0.26 1.12 -2.09 0.00 0.00 179.45 180.15 1hf9 h HIS 5 N 0.00 0.00 0.59 0.07 2.07 -2.01 -2.28 115.15 113.59 1hf9 h HIS 5 Ca -0.15 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.34 1hf9 h HIS 5 Cb 1.90 0.00 0.01 0.00 2.57 0.00 0.00 27.41 31.88 1hf9 h HIS 5 CO 0.00 0.00 -0.28 1.25 -3.07 0.00 0.00 177.93 175.83 1hf9 h HIS 6 N 0.00 -0.74 -0.43 6.12 2.76 -1.89 -2.35 115.15 118.63 1hf9 h HIS 6 Ca 0.08 -0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.36 1hf9 h HIS 6 Cb 0.60 0.24 -0.02 0.00 1.55 0.00 0.00 27.41 29.79 1hf9 h HIS 6 CO 0.00 -0.40 0.48 0.93 -1.30 0.00 0.00 177.93 177.64 1hf9 h GLU 7 N -1.06 0.00 0.37 5.26 5.08 -1.62 -1.03 114.58 121.58 1hf9 h GLU 7 Ca -0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1hf9 h GLU 7 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1hf9 h GLU 7 CO 0.13 0.00 -0.18 -0.91 -1.00 0.00 0.00 179.01 177.06 1hf9 h ASN 8 N 0.00 -0.42 -0.06 1.42 4.21 -1.39 -2.70 115.58 116.64 1hf9 h ASN 8 Ca 0.20 -0.08 0.02 0.00 1.21 0.00 0.00 56.30 57.65 1hf9 h ASN 8 Cb 1.17 0.11 -0.00 0.00 -1.12 0.00 0.00 38.32 38.47 1hf9 h ASN 8 CO -0.00 0.03 0.18 -0.08 -1.29 0.00 0.00 177.43 176.26 1hf9 h GLU 9 N -1.06 0.00 0.21 0.81 4.57 -0.75 -1.63 114.58 116.74 1hf9 h GLU 9 Ca -0.05 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1hf9 h GLU 9 Cb 0.48 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 1hf9 h GLU 9 CO 0.08 0.00 -0.10 0.97 -1.18 0.00 0.00 179.01 178.78 1hf9 h ILE 10 N 0.00 0.81 0.00 2.32 2.10 -1.13 -1.60 117.51 120.01 1hf9 h ILE 10 Ca 0.03 -0.90 -0.03 0.00 1.08 0.00 0.00 64.86 65.04 1hf9 h ILE 10 Cb 0.39 1.27 -0.00 0.00 -1.09 0.00 0.00 36.82 37.39 1hf9 h ILE 10 CO -0.00 0.18 -0.12 -1.28 -1.08 0.00 0.00 178.15 175.85 1hf9 h SER 11 N -0.79 0.00 0.18 2.19 0.87 -1.00 -2.21 113.55 112.79 1hf9 h SER 11 Ca -0.03 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.29 1hf9 h SER 11 Cb 0.51 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.48 1hf9 h SER 11 CO 0.05 0.12 -0.95 -0.74 -0.53 0.00 0.00 176.83 174.78 1hf9 h HIS 12 N 0.00 0.79 -0.14 2.24 -0.00 -1.29 -2.82 115.15 113.94 1hf9 h HIS 12 Ca -0.00 -0.42 -0.07 0.00 -0.00 0.00 0.00 60.37 59.88 1hf9 h HIS 12 Cb 0.33 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 27.63 1hf9 h HIS 12 CO 0.00 1.24 -0.25 0.45 -0.00 0.00 0.00 177.93 179.37 1hf9 h HIS 13 N 0.32 0.27 0.56 5.26 -0.00 -0.69 -0.90 115.15 119.96 1hf9 h HIS 13 Ca -0.09 -0.05 -0.03 0.00 -0.00 0.00 0.00 60.37 60.20 1hf9 h HIS 13 Cb 1.59 -0.07 0.01 0.00 -0.00 0.00 0.00 27.41 28.93 1hf9 h HIS 13 CO 0.08 0.48 -0.27 0.00 -0.00 0.00 0.00 177.93 178.22 1hf9 h ALA 14 N 1.53 -0.75 0.00 2.45 0.00 -1.40 -0.88 119.26 120.21 1hf9 h ALA 14 Ca 0.04 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1hf9 h ALA 14 Cb 0.56 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1hf9 h ALA 14 CO 0.04 -0.80 0.00 0.87 0.00 0.00 0.00 179.25 179.36 1hf9 h LYS 15 N -0.99 0.00 0.11 0.00 1.79 -1.42 -1.37 116.57 114.70 1hf9 h LYS 15 Ca -0.08 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.12 1hf9 h LYS 15 Cb 0.64 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1hf9 h LYS 15 CO 0.13 0.00 -1.24 1.49 -1.08 0.00 0.00 179.45 178.75 1hf9 h GLU 16 N 0.00 0.24 -0.11 3.15 4.81 -0.69 -2.05 114.58 119.94 1hf9 h GLU 16 Ca 0.00 -0.41 -0.17 0.00 -0.13 0.00 0.00 59.36 58.64 1hf9 h GLU 16 Cb 0.10 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1hf9 h GLU 16 CO 0.00 1.19 -0.66 -0.84 -0.73 0.00 0.00 179.01 177.97 1hf9 h ILE 17 N 0.07 1.36 -0.03 2.32 -0.00 -0.03 -0.03 117.51 121.17 1hf9 h ILE 17 Ca -0.13 -2.01 -0.14 0.00 -0.00 0.00 0.00 64.86 62.58 1hf9 h ILE 17 Cb 1.96 2.00 0.01 0.00 -0.00 0.00 0.00 36.82 40.78 1hf9 h ILE 17 CO 0.19 0.61 -0.54 -0.08 -0.00 0.00 0.00 178.15 178.33 1hf9 h GLU 18 N 0.31 0.41 0.00 0.16 4.57 -1.56 -2.69 114.58 115.78 1hf9 h GLU 18 Ca -0.02 -0.41 -0.05 0.00 -1.18 0.00 0.00 59.36 57.70 1hf9 h GLU 18 Cb 1.21 0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.90 1hf9 h GLU 18 CO 0.11 1.07 -0.24 -0.09 -1.18 0.00 0.00 179.01 178.69 1hf9 h ARG 19 N -0.09 0.00 -0.19 1.92 9.65 -1.40 -2.77 114.38 121.50 1hf9 h ARG 19 Ca -0.06 0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 58.70 1hf9 h ARG 19 Cb 1.24 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.82 1hf9 h ARG 19 CO 0.11 0.24 -0.34 -0.07 2.80 0.00 0.00 179.97 182.70 1hf9 h LEU 20 N 0.00 0.64 0.05 3.80 -0.00 -0.97 -1.49 115.31 117.34 1hf9 h LEU 20 Ca -0.00 -0.54 -0.00 0.00 -0.00 0.00 0.00 57.88 57.34 1hf9 h LEU 20 Cb 0.69 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1hf9 h LEU 20 CO 0.03 1.05 -0.03 -0.61 -0.00 0.00 0.00 178.44 178.89 1hf9 h GLN 21 N 0.24 -0.07 0.00 1.13 -0.00 -1.29 -0.88 115.11 114.24 1hf9 h GLN 21 Ca 0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.65 1hf9 h GLN 21 Cb 0.93 0.02 -0.00 0.00 0.00 0.00 0.00 27.48 28.43 1hf9 h GLN 21 CO 0.08 -0.05 -0.10 0.87 0.00 0.00 0.00 178.83 179.63 1hf9 h LYS 22 N -0.07 0.00 -0.01 1.69 6.56 -1.53 -1.73 116.57 121.48 1hf9 h LYS 22 Ca -0.01 0.00 -0.17 0.00 -1.06 0.00 0.00 60.65 59.41 1hf9 h LYS 22 Cb 0.06 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.70 1hf9 h LYS 22 CO 0.01 0.10 -0.76 1.49 -2.06 0.00 0.00 179.45 178.23 1hf9 h GLU 23 N 0.00 0.11 -0.28 3.15 4.57 -0.36 -2.57 114.58 119.21 1hf9 h GLU 23 Ca -0.00 -0.11 -0.12 0.00 -1.18 0.00 0.00 59.36 57.95 1hf9 h GLU 23 Cb 0.26 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.87 1hf9 h GLU 23 CO 0.01 0.82 -0.29 -0.84 -1.18 0.00 0.00 179.01 177.53 1hf9 h ILE 24 N 0.07 1.30 -0.50 2.32 -0.00 -0.27 -2.45 117.51 117.99 1hf9 h ILE 24 Ca -0.02 -1.46 -0.03 0.00 -0.00 0.00 0.00 64.86 63.35 1hf9 h ILE 24 Cb 1.34 1.61 -0.02 0.00 -0.00 0.00 0.00 36.82 39.74 1hf9 h ILE 24 CO 0.11 0.47 0.20 -0.08 -0.00 0.00 0.00 178.15 178.84 1hf9 h GLU 25 N 0.43 0.75 -0.78 0.16 4.57 -1.50 -1.92 114.58 116.28 1hf9 h GLU 25 Ca 0.04 -0.14 0.04 0.00 -1.18 0.00 0.00 59.36 58.12 1hf9 h GLU 25 Cb 0.86 -0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 29.29 1hf9 h GLU 25 CO 0.07 0.67 0.51 0.00 -1.18 0.00 0.00 179.01 179.08 1hf9 h ARG 26 N 0.67 0.91 0.00 1.92 3.08 -1.42 0.23 114.38 119.77 1hf9 h ARG 26 Ca 0.17 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 1hf9 h ARG 26 Cb 0.20 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1hf9 h ARG 26 CO -0.01 0.60 -0.39 0.45 -1.07 0.00 0.00 179.97 179.55 1hf9 h HIS 27 N 0.94 0.00 0.00 3.04 3.86 -0.93 -2.45 115.15 119.60 1hf9 h HIS 27 Ca 0.31 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.41 1hf9 h HIS 27 Cb 0.07 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.53 1hf9 h HIS 27 CO -0.00 0.39 -0.54 -0.22 0.86 0.00 0.00 177.93 178.42 1hf9 h LYS 28 N 0.00 0.00 0.06 2.45 3.64 -0.21 -1.74 116.57 120.76 1hf9 h LYS 28 Ca -0.00 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.13 1hf9 h LYS 28 Cb 0.74 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1hf9 h LYS 28 CO 0.05 0.54 -1.08 0.37 -2.27 0.00 0.00 179.45 177.06 1hf9 h GLN 29 N 0.00 0.36 -0.01 1.90 5.75 -0.93 -2.18 115.11 120.00 1hf9 h GLN 29 Ca -0.01 -0.47 -0.19 0.00 -0.15 0.00 0.00 58.65 57.83 1hf9 h GLN 29 Cb 1.04 0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.73 1hf9 h GLN 29 CO 0.07 1.16 -0.83 0.77 -2.65 0.00 0.00 178.83 177.35 1hf9 h SER 30 N 0.17 0.29 0.71 -0.69 0.02 -1.38 -1.90 113.55 110.76 1hf9 h SER 30 Ca -0.11 -0.22 -0.19 0.00 -0.84 0.00 0.00 61.79 60.43 1hf9 h SER 30 Cb 1.75 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 64.19 1hf9 h SER 30 CO 0.18 1.00 -0.88 -0.29 -1.14 0.00 0.00 176.83 175.70 1hf9 h ILE 31 N 0.13 1.55 0.04 3.27 -0.00 -1.37 -1.72 117.51 119.41 1hf9 h ILE 31 Ca -0.04 -2.78 -0.25 0.00 -0.00 0.00 0.00 64.86 61.80 1hf9 h ILE 31 Cb 1.44 2.54 0.01 0.00 -0.00 0.00 0.00 36.82 40.81 1hf9 h ILE 31 CO 0.13 0.80 -1.05 0.50 -0.00 0.00 0.00 178.15 178.54 1hf9 h LYS 32 N 0.06 0.42 -0.02 2.19 3.64 -1.39 -2.24 116.57 119.23 1hf9 h LYS 32 Ca -0.03 -0.51 -0.19 0.00 -1.27 0.00 0.00 60.65 58.65 1hf9 h LYS 32 Cb 1.53 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 33.50 1hf9 h LYS 32 CO 0.13 1.17 -0.83 -0.22 -2.27 0.00 0.00 179.45 177.43 1hf9 h LYS 33 N 0.21 0.25 -0.04 1.90 3.64 -1.37 -2.58 116.57 118.57 1hf9 h LYS 33 Ca -0.11 -0.24 -0.17 0.00 -1.27 0.00 0.00 60.65 58.86 1hf9 h LYS 33 Cb 1.70 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.58 1hf9 h LYS 33 CO 0.18 0.94 -0.72 -0.07 -2.27 0.00 0.00 179.45 177.51 1hf9 h LEU 34 N 0.15 0.26 -0.28 5.20 3.38 -1.35 -1.33 115.31 121.34 1hf9 h LEU 34 Ca -0.04 -0.18 -0.19 0.00 0.09 0.00 0.00 57.88 57.56 1hf9 h LEU 34 Cb 1.43 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1hf9 h LEU 34 CO 0.13 0.90 -0.57 0.50 0.09 0.00 0.00 178.44 179.49 1hf9 h LYS 35 N 0.15 0.88 0.00 1.13 3.64 -1.38 -1.72 116.57 119.27 1hf9 h LYS 35 Ca -0.02 -0.57 -0.12 0.00 -1.27 0.00 0.00 60.65 58.67 1hf9 h LYS 35 Cb 1.28 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.16 1hf9 h LYS 35 CO 0.11 1.21 -0.57 0.37 -2.27 0.00 0.00 179.45 178.30 1hf9 h GLN 36 N 0.67 0.00 0.00 1.90 5.75 -1.45 -3.07 115.11 118.90 1hf9 h GLN 36 Ca 0.01 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.40 1hf9 h GLN 36 Cb 1.18 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.71 1hf9 h GLN 36 CO 0.13 0.57 -0.53 0.77 -2.65 0.00 0.00 178.83 177.12 1hf9 h SER 37 N 0.00 0.00 0.92 -0.69 0.02 -1.16 -3.15 113.55 109.48 1hf9 h SER 37 Ca -0.01 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.85 1hf9 h SER 37 Cb 1.22 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 1hf9 h SER 37 CO 0.07 0.53 -0.46 -0.08 -1.14 0.00 0.00 176.83 175.75 1hf9 h GLU 38 N 0.00 0.00 0.00 3.45 4.22 -1.22 -2.99 114.58 118.05 1hf9 h GLU 38 Ca -0.01 0.00 -0.08 0.00 0.08 0.00 0.00 59.36 59.36 1hf9 h GLU 38 Cb 1.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.54 1hf9 h GLU 38 CO 0.07 0.46 -0.37 -0.44 -2.18 0.00 0.00 179.01 176.55 1hf9 h ASP 39 N 0.00 0.00 -3.59 1.04 3.32 -1.52 -3.49 116.42 112.18 1hf9 h ASP 39 Ca -0.00 0.00 0.23 0.00 0.02 0.00 0.00 57.03 57.27 1hf9 h ASP 39 Cb 1.05 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.47 1hf9 h ASP 39 CO 0.06 0.37 -1.16 0.47 -1.72 0.00 0.00 179.24 177.27 1hf9 n ASP 40 N -3.69 -7.88 0.00 6.45 9.92 -1.13 -5.15 116.55 115.07 1hf9 n ASP 40 Ca -0.01 1.58 0.00 0.00 -0.53 0.00 0.00 54.79 55.83 1hf9 n ASP 40 Cb 0.47 -5.00 0.00 0.00 -0.64 0.00 0.00 41.12 35.95 1hf9 n ASP 40 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80