#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 -1.36 0.00 0.00 7.99 -1.26 -5.03 117.00 117.35 1hf9 n LEU 2 Ca 0.00 -0.46 0.00 0.00 -0.01 0.00 0.00 56.01 55.54 1hf9 n LEU 2 Cb 0.00 -1.04 0.00 0.00 -0.11 0.00 0.00 43.42 42.27 1hf9 n LEU 2 CO 0.00 -3.75 0.00 0.29 -1.51 0.00 0.00 177.39 172.42 1hf9 n LYS 3 N -4.30 0.00 -1.92 3.23 4.01 -1.26 -4.89 118.16 113.03 1hf9 n LYS 3 Ca 0.06 0.00 -0.11 0.00 -0.51 0.00 0.00 58.31 57.76 1hf9 n LYS 3 Cb 0.55 -0.22 -0.02 0.00 -0.51 0.00 0.00 35.03 34.83 1hf9 n LYS 3 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1hf9 n LYS 4 N -0.50 -1.83 -0.08 1.97 4.76 -1.26 -4.75 118.16 116.48 1hf9 n LYS 4 Ca 0.00 0.56 -0.08 0.00 -2.87 0.00 0.00 58.31 55.92 1hf9 n LYS 4 Cb 0.00 -4.97 -0.13 0.00 -1.84 0.00 0.00 35.03 28.10 1hf9 n LYS 4 CO 0.00 0.00 0.00 -2.39 -1.37 0.00 0.00 177.40 173.64 1hf9 n HIS 5 N -2.54 0.00 0.02 2.13 1.44 -1.26 -4.28 115.22 110.73 1hf9 n HIS 5 Ca -0.12 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.45 1hf9 n HIS 5 Cb 0.48 -0.79 -0.03 0.00 0.12 0.00 0.00 29.99 29.77 1hf9 n HIS 5 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1hf9 h HIS 6 N 0.00 0.81 -0.29 -1.40 3.86 -1.99 -2.78 115.15 113.36 1hf9 h HIS 6 Ca -0.44 -0.38 -0.03 0.00 -1.16 0.00 0.00 60.37 58.37 1hf9 h HIS 6 Cb 1.98 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 30.31 1hf9 h HIS 6 CO 0.00 1.18 0.05 1.49 0.86 0.00 0.00 177.93 181.52 1hf9 h GLU 7 N 0.38 0.42 0.33 2.45 4.22 -1.96 0.00 114.58 120.42 1hf9 h GLU 7 Ca -0.06 -0.06 -0.02 0.00 0.08 0.00 0.00 59.36 59.30 1hf9 h GLU 7 Cb 1.42 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1hf9 h GLU 7 CO 0.15 0.40 -0.16 -0.91 -2.18 0.00 0.00 179.01 176.32 1hf9 h ASN 8 N 0.41 -0.38 -0.00 1.04 4.21 -1.73 -2.65 115.58 116.48 1hf9 h ASN 8 Ca 0.10 -0.16 0.00 0.00 1.21 0.00 0.00 56.30 57.45 1hf9 h ASN 8 Cb 0.19 0.10 -0.00 0.00 -1.12 0.00 0.00 38.32 37.49 1hf9 h ASN 8 CO -0.00 0.07 0.08 -0.33 -1.29 0.00 0.00 177.43 175.96 1hf9 h GLU 9 N -0.95 0.00 0.10 0.81 3.07 -1.35 -1.89 114.58 114.37 1hf9 h GLU 9 Ca -0.05 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1hf9 h GLU 9 Cb 0.52 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1hf9 h GLU 9 CO 0.07 0.00 -0.05 0.97 -1.40 0.00 0.00 179.01 178.61 1hf9 h ILE 10 N 0.00 1.13 0.00 3.13 6.09 -0.81 -1.99 117.51 125.06 1hf9 h ILE 10 Ca 0.00 -1.15 -0.02 0.00 -1.37 0.00 0.00 64.86 62.32 1hf9 h ILE 10 Cb 0.16 1.83 -0.00 0.00 0.47 0.00 0.00 36.82 39.28 1hf9 h ILE 10 CO -0.00 0.27 -0.11 0.77 -3.07 0.00 0.00 178.15 176.01 1hf9 h SER 11 N -0.69 0.00 0.05 2.19 4.64 -1.01 -2.19 113.55 116.55 1hf9 h SER 11 Ca -0.01 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.09 1hf9 h SER 11 Cb 0.54 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.65 1hf9 h SER 11 CO 0.02 0.11 -0.88 -0.74 -0.87 0.00 0.00 176.83 174.47 1hf9 h HIS 12 N 0.00 0.79 0.00 4.77 -0.00 -1.40 -2.80 115.15 116.51 1hf9 h HIS 12 Ca -0.00 -0.47 -0.04 0.00 -0.00 0.00 0.00 60.37 59.86 1hf9 h HIS 12 Cb 0.33 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.66 1hf9 h HIS 12 CO 0.00 1.31 -0.19 0.45 -0.00 0.00 0.00 177.93 179.49 1hf9 h HIS 13 N 0.05 0.00 0.25 5.26 3.86 -1.02 -0.37 115.15 123.19 1hf9 h HIS 13 Ca -0.12 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.07 1hf9 h HIS 13 Cb 1.59 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.06 1hf9 h HIS 13 CO 0.14 0.19 -0.12 0.00 0.86 0.00 0.00 177.93 179.00 1hf9 h ALA 14 N 1.81 -0.34 0.00 2.45 0.00 -1.39 -1.48 119.26 120.30 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 0.51 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1hf9 h ALA 14 CO 0.02 -0.43 0.00 1.63 0.00 0.00 0.00 179.25 180.47 1hf9 n LYS 15 N -5.03 0.11 0.09 0.00 4.76 -1.06 -2.32 118.16 114.71 1hf9 n LYS 15 Ca -0.08 0.38 -0.22 0.00 -2.87 0.00 0.00 58.31 55.53 1hf9 n LYS 15 Cb 0.26 -1.73 -0.15 0.00 -1.84 0.00 0.00 35.03 31.57 1hf9 n LYS 15 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1hf9 h GLU 16 N 0.00 0.39 -0.04 1.97 3.07 -0.89 -1.71 114.58 117.37 1hf9 h GLU 16 Ca 0.00 -0.67 -0.19 0.00 -0.50 0.00 0.00 59.36 57.99 1hf9 h GLU 16 Cb 0.27 0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1hf9 h GLU 16 CO 0.00 1.30 -0.79 0.97 -1.40 0.00 0.00 179.01 179.09 1hf9 h ILE 17 N 0.11 1.41 0.02 3.13 2.10 -0.95 -0.28 117.51 123.05 1hf9 h ILE 17 Ca -0.28 -2.30 -0.23 0.00 1.08 0.00 0.00 64.86 63.13 1hf9 h ILE 17 Cb 2.09 2.24 0.02 0.00 -1.09 0.00 0.00 36.82 40.09 1hf9 h ILE 17 CO 0.20 0.68 -0.91 -0.33 -1.08 0.00 0.00 178.15 176.71 1hf9 h GLU 18 N 0.21 0.58 0.00 2.19 5.08 -1.58 -2.59 114.58 118.47 1hf9 h GLU 18 Ca -0.04 -0.65 -0.07 0.00 -1.00 0.00 0.00 59.36 57.60 1hf9 h GLU 18 Cb 1.38 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.82 1hf9 h GLU 18 CO 0.13 1.26 -0.33 0.00 -1.00 0.00 0.00 179.01 179.07 1hf9 h ARG 19 N 0.18 0.00 -0.13 2.33 2.47 -1.34 -2.80 114.38 115.08 1hf9 h ARG 19 Ca -0.12 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.37 1hf9 h ARG 19 Cb 1.60 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.93 1hf9 h ARG 19 CO 0.18 0.33 -0.82 -0.07 0.56 0.00 0.00 179.97 180.15 1hf9 h LEU 20 N 0.00 0.92 -0.01 3.04 -0.00 -1.05 -1.88 115.31 116.33 1hf9 h LEU 20 Ca -0.00 -0.62 -0.00 0.00 -0.00 0.00 0.00 57.88 57.25 1hf9 h LEU 20 Cb 0.91 -0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 41.30 1hf9 h LEU 20 CO 0.04 1.42 0.00 1.56 -0.00 0.00 0.00 178.44 181.47 1hf9 h GLN 21 N 0.51 0.01 0.00 1.13 4.20 -1.35 -1.42 115.11 118.20 1hf9 h GLN 21 Ca -0.06 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 1hf9 h GLN 21 Cb 1.45 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.22 1hf9 h GLN 21 CO 0.17 0.14 -0.17 0.87 -0.67 0.00 0.00 178.83 179.17 1hf9 h LYS 22 N -0.12 0.00 -0.26 1.46 1.79 -1.55 -2.05 116.57 115.84 1hf9 h LYS 22 Ca 0.00 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.34 1hf9 h LYS 22 Cb 0.13 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.77 1hf9 h LYS 22 CO -0.00 0.17 -0.38 0.93 -1.08 0.00 0.00 179.45 179.09 1hf9 h GLU 23 N 0.00 0.60 -0.49 3.15 3.07 -0.85 -2.65 114.58 117.40 1hf9 h GLU 23 Ca -0.00 -0.29 -0.09 0.00 -0.50 0.00 0.00 59.36 58.48 1hf9 h GLU 23 Cb 0.30 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 1hf9 h GLU 23 CO 0.02 0.88 -0.03 -0.84 -1.40 0.00 0.00 179.01 177.64 1hf9 h ILE 24 N 0.50 1.27 -0.64 3.13 -0.00 -0.56 -2.73 117.51 118.47 1hf9 h ILE 24 Ca 0.05 -1.12 0.03 0.00 -0.00 0.00 0.00 64.86 63.81 1hf9 h ILE 24 Cb 0.88 1.00 -0.04 0.00 -0.00 0.00 0.00 36.82 38.66 1hf9 h ILE 24 CO 0.08 0.39 0.40 -0.08 -0.00 0.00 0.00 178.15 178.94 1hf9 h GLU 25 N 0.75 0.77 -0.34 0.16 4.81 -1.37 -1.26 114.58 118.09 1hf9 h GLU 25 Ca 0.14 -0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.37 1hf9 h GLU 25 Cb 0.56 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1hf9 h GLU 25 CO 0.03 0.51 0.07 -0.09 -0.73 0.00 0.00 179.01 178.80 1hf9 h ARG 26 N 0.79 0.19 0.00 1.92 9.65 -1.29 0.38 114.38 126.02 1hf9 h ARG 26 Ca 0.26 -0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 59.10 1hf9 h ARG 26 Cb 0.01 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.54 1hf9 h ARG 26 CO -0.10 0.12 -0.10 0.45 2.80 0.00 0.00 179.97 183.15 1hf9 h HIS 27 N 0.19 0.00 -0.13 2.20 3.86 -1.14 -1.89 115.15 118.26 1hf9 h HIS 27 Ca 0.16 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.20 1hf9 h HIS 27 Cb 0.17 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 1hf9 h HIS 27 CO -0.18 0.10 -0.64 -0.22 0.86 0.00 0.00 177.93 177.85 1hf9 h LYS 28 N 0.00 0.48 -0.02 2.45 3.11 0.21 -2.35 116.57 120.45 1hf9 h LYS 28 Ca -0.00 -0.34 -0.15 0.00 -2.81 0.00 0.00 60.65 57.34 1hf9 h LYS 28 Cb 0.26 0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 31.53 1hf9 h LYS 28 CO 0.01 0.96 -0.69 0.37 -2.81 0.00 0.00 179.45 177.30 1hf9 h GLN 29 N 0.35 0.12 -0.10 1.90 5.75 -0.49 -2.45 115.11 120.19 1hf9 h GLN 29 Ca -0.01 -0.10 -0.20 0.00 -0.15 0.00 0.00 58.65 58.19 1hf9 h GLN 29 Cb 1.20 0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.77 1hf9 h GLN 29 CO 0.12 0.76 -0.75 1.03 -2.65 0.00 0.00 178.83 177.34 1hf9 h SER 30 N 0.09 0.64 0.11 -0.69 0.87 -1.39 -1.66 113.55 111.52 1hf9 h SER 30 Ca -0.01 -0.42 -0.15 0.00 -1.23 0.00 0.00 61.79 59.97 1hf9 h SER 30 Cb 1.22 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 1hf9 h SER 30 CO 0.10 1.18 -0.54 -0.29 -0.53 0.00 0.00 176.83 176.75 1hf9 h ILE 31 N 0.37 1.33 0.01 2.23 6.09 -1.39 -1.15 117.51 125.01 1hf9 h ILE 31 Ca -0.04 -1.80 -0.22 0.00 -1.37 0.00 0.00 64.86 61.43 1hf9 h ILE 31 Cb 1.34 1.80 -0.00 0.00 0.47 0.00 0.00 36.82 40.43 1hf9 h ILE 31 CO 0.14 0.55 -0.94 0.11 -3.07 0.00 0.00 178.15 174.94 1hf9 h LYS 32 N 0.35 0.28 0.00 2.19 1.79 -1.44 -2.66 116.57 117.09 1hf9 h LYS 32 Ca 0.01 -0.32 -0.13 0.00 -2.18 0.00 0.00 60.65 58.02 1hf9 h LYS 32 Cb 1.06 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.79 1hf9 h LYS 32 CO 0.10 1.04 -0.64 0.87 -1.08 0.00 0.00 179.45 179.73 1hf9 h LYS 33 N 0.15 0.00 -0.14 3.15 1.57 -1.24 -2.55 116.57 117.51 1hf9 h LYS 33 Ca -0.07 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.57 1hf9 h LYS 33 Cb 1.58 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.89 1hf9 h LYS 33 CO 0.15 0.64 -0.49 1.25 -0.57 0.00 0.00 179.45 180.43 1hf9 h LEU 34 N 0.00 0.68 -0.77 2.94 7.12 -1.19 -1.50 115.31 122.59 1hf9 h LEU 34 Ca -0.01 -0.61 -0.09 0.00 0.13 0.00 0.00 57.88 57.30 1hf9 h LEU 34 Cb 1.24 -0.20 -0.02 0.00 -0.53 0.00 0.00 40.66 41.15 1hf9 h LEU 34 CO 0.08 1.17 -0.06 0.50 -0.13 0.00 0.00 178.44 180.00 1hf9 h LYS 35 N 0.22 0.87 0.00 1.25 3.11 -1.48 -1.81 116.57 118.74 1hf9 h LYS 35 Ca -0.02 -0.28 -0.08 0.00 -2.81 0.00 0.00 60.65 57.46 1hf9 h LYS 35 Cb 1.12 -0.08 -0.01 0.00 -1.00 0.00 0.00 32.23 32.26 1hf9 h LYS 35 CO 0.10 0.91 -0.36 0.37 -2.81 0.00 0.00 179.45 177.66 1hf9 h GLN 36 N 0.79 0.00 0.02 1.90 5.75 -1.47 -3.08 115.11 119.02 1hf9 h GLN 36 Ca 0.14 0.00 -0.23 0.00 -0.15 0.00 0.00 58.65 58.40 1hf9 h GLN 36 Cb 0.56 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.12 1hf9 h GLN 36 CO 0.03 0.36 -0.99 1.03 -2.65 0.00 0.00 178.83 176.62 1hf9 h SER 37 N 0.00 0.54 0.64 -0.69 0.87 -0.85 -3.16 113.55 110.90 1hf9 h SER 37 Ca -0.00 -0.45 -0.05 0.00 -1.23 0.00 0.00 61.79 60.05 1hf9 h SER 37 Cb 0.98 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.77 1hf9 h SER 37 CO 0.05 1.26 -0.25 -0.08 -0.53 0.00 0.00 176.83 177.27 1hf9 h GLU 38 N 0.22 0.00 0.00 2.24 4.81 -1.28 -2.50 114.58 118.07 1hf9 h GLU 38 Ca -0.09 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.06 1hf9 h GLU 38 Cb 1.63 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.00 1hf9 h GLU 38 CO 0.17 0.25 -0.38 0.22 -0.73 0.00 0.00 179.01 178.55 1hf9 h ASP 39 N 0.00 0.00 -3.72 1.04 1.82 -1.51 -3.50 116.42 110.56 1hf9 h ASP 39 Ca -0.00 0.00 0.19 0.00 -0.39 0.00 0.00 57.03 56.82 1hf9 h ASP 39 Cb 0.64 0.00 -0.07 0.00 0.68 0.00 0.00 39.33 40.58 1hf9 h ASP 39 CO 0.03 0.38 -0.43 0.47 -1.61 0.00 0.00 179.24 178.07 1hf9 n ASP 40 N -3.44 -4.34 -0.73 2.28 8.00 -0.94 -5.13 116.55 112.25 1hf9 n ASP 40 Ca 0.00 0.49 0.09 0.00 0.71 0.00 0.00 54.79 56.09 1hf9 n ASP 40 Cb 0.54 -2.32 0.08 0.00 -0.02 0.00 0.00 41.12 39.40 1hf9 n ASP 40 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28