#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bb1 h LYS 2 N 0.00 0.99 -0.64 3.49 1.57 -2.05 0.17 116.57 120.10 1bb1 h LYS 2 Ca 0.00 -0.24 -0.08 0.00 -1.87 0.00 0.00 60.65 58.46 1bb1 h LYS 2 Cb 0.00 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 1bb1 h LYS 2 CO 0.00 0.90 0.08 0.82 -0.57 0.00 0.00 179.45 180.68 1bb1 h ILE 3 N 0.94 1.26 -0.50 1.86 2.04 -2.05 -0.85 117.51 120.21 1bb1 h ILE 3 Ca 0.20 -1.05 -0.10 0.00 1.00 0.00 0.00 64.86 64.90 1bb1 h ILE 3 Cb 0.38 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1bb1 h ILE 3 CO 0.01 0.39 -0.10 0.00 0.00 0.00 0.00 178.15 178.45 1bb1 h ALA 4 N 1.08 0.87 -0.70 1.87 0.00 -1.84 -0.77 119.26 119.77 1bb1 h ALA 4 Ca 0.19 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1bb1 h ALA 4 Cb 0.46 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1bb1 h ALA 4 CO 0.02 0.64 0.16 0.00 0.00 0.00 0.00 179.25 180.07 1bb1 h ALA 5 N 1.05 0.95 -0.32 0.00 0.00 -0.23 -0.17 119.26 120.54 1bb1 h ALA 5 Ca 0.14 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1bb1 h ALA 5 Cb 0.63 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1bb1 h ALA 5 CO 0.04 0.67 -0.02 0.82 0.00 0.00 0.00 179.25 180.76 1bb1 h ILE 6 N 1.07 1.27 -0.60 0.00 2.04 -0.92 -1.94 117.51 118.42 1bb1 h ILE 6 Ca 0.22 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.06 1bb1 h ILE 6 Cb 0.39 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 1bb1 h ILE 6 CO 0.00 0.33 0.31 0.50 0.00 0.00 0.00 178.15 179.30 1bb1 h LYS 7 N 0.37 0.83 -0.37 2.37 3.64 -0.84 -0.57 116.57 121.99 1bb1 h LYS 7 Ca 0.09 -0.09 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 1bb1 h LYS 7 Cb 0.48 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1bb1 h LYS 7 CO 0.02 0.62 -0.13 1.49 -2.27 0.00 0.00 179.45 179.18 1bb1 h GLU 8 N 0.83 0.75 -0.18 1.90 4.81 -0.87 -2.78 114.58 119.04 1bb1 h GLU 8 Ca 0.21 -0.31 -0.06 0.00 -0.13 0.00 0.00 59.36 59.08 1bb1 h GLU 8 Cb 0.04 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1bb1 h GLU 8 CO -0.03 0.91 -0.15 1.49 -0.73 0.00 0.00 179.01 180.50 1bb1 h GLU 9 N 0.54 0.29 -0.12 1.92 4.57 -0.72 -2.41 114.58 118.66 1bb1 h GLU 9 Ca 0.09 -0.08 -0.11 0.00 -1.18 0.00 0.00 59.36 58.08 1bb1 h GLU 9 Cb 0.66 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.21 1bb1 h GLU 9 CO 0.05 0.45 -0.43 1.96 -1.18 0.00 0.00 179.01 179.86 1bb1 h GLN 10 N 0.27 0.27 -0.22 1.92 4.20 -0.95 -0.19 115.11 120.41 1bb1 h GLN 10 Ca 0.05 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 1bb1 h GLN 10 Cb 0.44 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 1bb1 h GLN 10 CO 0.03 0.65 0.07 0.00 -0.67 0.00 0.00 178.83 178.91 1bb1 h ALA 11 N 1.34 0.28 -0.48 3.87 0.00 -1.17 0.76 119.26 123.87 1bb1 h ALA 11 Ca 0.02 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1bb1 h ALA 11 Cb 0.85 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1bb1 h ALA 11 CO 0.07 -0.10 0.19 0.00 0.00 0.00 0.00 179.25 179.41 1bb1 h ALA 12 N 0.90 0.62 -0.46 0.00 0.00 -1.28 -1.30 119.26 117.73 1bb1 h ALA 12 Ca 0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1bb1 h ALA 12 Cb 0.22 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1bb1 h ALA 12 CO -0.00 0.22 0.23 0.82 0.00 0.00 0.00 179.25 180.52 1bb1 h ILE 13 N 0.63 1.18 -0.26 0.00 2.04 -0.87 -1.10 117.51 119.13 1bb1 h ILE 13 Ca 0.16 -0.49 -0.05 0.00 1.00 0.00 0.00 64.86 65.48 1bb1 h ILE 13 Cb 0.19 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1bb1 h ILE 13 CO -0.01 0.19 -0.06 -0.33 0.00 0.00 0.00 178.15 177.94 1bb1 h GLU 14 N 0.60 0.40 -0.51 2.37 4.39 -0.68 -0.01 114.58 121.14 1bb1 h GLU 14 Ca 0.16 -0.09 -0.08 0.00 0.34 0.00 0.00 59.36 59.69 1bb1 h GLU 14 Cb 0.09 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 1bb1 h GLU 14 CO -0.02 0.48 -0.01 0.93 -1.16 0.00 0.00 179.01 179.23 1bb1 h GLU 15 N 0.38 0.91 -0.61 2.33 4.39 -0.68 -1.71 114.58 119.59 1bb1 h GLU 15 Ca 0.08 -0.29 -0.08 0.00 0.34 0.00 0.00 59.36 59.41 1bb1 h GLU 15 Cb 0.36 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 1bb1 h GLU 15 CO 0.02 0.94 0.08 0.93 -1.16 0.00 0.00 179.01 179.81 1bb1 h GLU 16 N 0.77 1.03 -0.71 2.33 5.08 -0.52 -2.57 114.58 119.98 1bb1 h GLU 16 Ca 0.14 -0.29 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 1bb1 h GLU 16 Cb 0.53 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1bb1 h GLU 16 CO 0.03 0.97 0.21 0.82 -1.00 0.00 0.00 179.01 180.04 1bb1 h ILE 17 N 0.93 1.26 -0.37 3.13 2.04 -0.83 0.71 117.51 124.37 1bb1 h ILE 17 Ca 0.18 -0.90 -0.09 0.00 1.00 0.00 0.00 64.86 65.05 1bb1 h ILE 17 Cb 0.46 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1bb1 h ILE 17 CO 0.02 0.35 -0.16 1.56 0.00 0.00 0.00 178.15 179.92 1bb1 h GLN 18 N 1.06 0.69 -0.34 2.37 1.08 -1.18 0.39 115.11 119.17 1bb1 h GLN 18 Ca 0.23 -0.24 -0.13 0.00 -1.45 0.00 0.00 58.65 57.06 1bb1 h GLN 18 Cb 0.31 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 1bb1 h GLN 18 CO -0.01 0.81 -0.33 0.00 -0.95 0.00 0.00 178.83 178.36 1bb1 h ALA 19 N 1.21 0.78 -0.46 3.87 0.00 -1.04 -2.84 119.26 120.79 1bb1 h ALA 19 Ca 0.10 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 1bb1 h ALA 19 Cb 0.62 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1bb1 h ALA 19 CO 0.04 0.65 -0.15 0.82 0.00 0.00 0.00 179.25 180.61 1bb1 h ILE 20 N 0.63 1.27 -0.88 0.00 2.04 -0.45 -1.99 117.51 118.13 1bb1 h ILE 20 Ca 0.07 -1.27 0.07 0.00 1.00 0.00 0.00 64.86 64.73 1bb1 h ILE 20 Cb 0.86 1.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.95 1bb1 h ILE 20 CO 0.07 0.44 0.54 0.11 0.00 0.00 0.00 178.15 179.31 1bb1 h LYS 21 N 0.77 0.94 -0.10 2.37 1.57 -0.72 0.21 116.57 121.61 1bb1 h LYS 21 Ca 0.12 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.69 1bb1 h LYS 21 Cb 0.68 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1bb1 h LYS 21 CO 0.05 0.62 -0.60 0.93 -0.57 0.00 0.00 179.45 179.88 1bb1 h GLU 22 N 0.97 0.35 -0.52 3.15 5.08 -1.27 -2.38 114.58 119.95 1bb1 h GLU 22 Ca 0.39 -0.24 -0.12 0.00 -1.00 0.00 0.00 59.36 58.39 1bb1 h GLU 22 Cb 0.21 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1bb1 h GLU 22 CO -0.19 0.85 -0.15 0.93 -1.00 0.00 0.00 179.01 179.45 1bb1 h GLU 23 N 0.26 1.01 -0.46 2.33 5.08 -0.52 -0.73 114.58 121.55 1bb1 h GLU 23 Ca -0.01 -0.40 -0.05 0.00 -1.00 0.00 0.00 59.36 57.90 1bb1 h GLU 23 Cb 1.13 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 1bb1 h GLU 23 CO 0.10 1.09 0.10 0.82 -1.00 0.00 0.00 179.01 180.11 1bb1 h ILE 24 N 0.88 1.24 -0.75 3.13 1.08 -0.93 -0.61 117.51 121.55 1bb1 h ILE 24 Ca 0.13 -0.86 -0.02 0.00 -0.39 0.00 0.00 64.86 63.72 1bb1 h ILE 24 Cb 0.73 0.92 -0.03 0.00 -3.07 0.00 0.00 36.82 35.36 1bb1 h ILE 24 CO 0.06 0.30 0.37 0.00 -0.69 0.00 0.00 178.15 178.19 1bb1 h ALA 25 N 0.96 0.96 -0.68 1.87 0.00 -1.29 -1.62 119.26 119.47 1bb1 h ALA 25 Ca 0.14 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1bb1 h ALA 25 Cb 0.35 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1bb1 h ALA 25 CO 0.00 0.51 0.23 0.00 0.00 0.00 0.00 179.25 179.99 1bb1 h ALA 26 N 1.19 0.89 -0.52 0.00 0.00 -0.84 -1.25 119.26 118.72 1bb1 h ALA 26 Ca 0.26 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1bb1 h ALA 26 Cb 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1bb1 h ALA 26 CO -0.04 0.55 0.31 0.82 0.00 0.00 0.00 179.25 180.89 1bb1 h ILE 27 N 0.98 1.16 -0.55 0.00 2.04 -0.64 -0.75 117.51 119.75 1bb1 h ILE 27 Ca 0.22 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.64 1bb1 h ILE 27 Cb 0.27 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 1bb1 h ILE 27 CO -0.01 0.16 0.01 0.11 0.00 0.00 0.00 178.15 178.42 1bb1 h LYS 28 N 0.69 0.94 -0.10 2.37 1.57 -1.05 -0.27 116.57 120.72 1bb1 h LYS 28 Ca 0.19 -0.27 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1bb1 h LYS 28 Cb -0.01 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 1bb1 h LYS 28 CO -0.03 0.92 0.05 -0.92 -0.57 0.00 0.00 179.45 178.90 1bb1 h TYR 29 N 0.87 0.14 -0.67 -1.35 3.20 -0.87 -1.77 116.97 116.51 1bb1 h TYR 29 Ca 0.16 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 1bb1 h TYR 29 Cb 0.50 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 1bb1 h TYR 29 CO 0.03 0.21 0.26 -0.07 -1.64 0.00 0.00 178.16 176.95 1bb1 h LEU 30 N 0.03 0.94 -0.80 2.82 3.38 -0.95 -1.02 115.31 119.71 1bb1 h LEU 30 Ca 0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1bb1 h LEU 30 Cb 0.12 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1bb1 h LEU 30 CO -0.00 0.87 0.40 0.40 0.09 0.00 0.00 178.44 180.20 1bb1 h ILE 31 N 0.96 1.25 -0.47 1.22 1.08 -0.95 -1.71 117.51 118.89 1bb1 h ILE 31 Ca 0.22 -0.67 -0.13 0.00 -0.39 0.00 0.00 64.86 63.89 1bb1 h ILE 31 Cb 0.23 0.21 -0.01 0.00 -3.07 0.00 0.00 36.82 34.18 1bb1 h ILE 31 CO -0.02 0.29 -0.22 0.00 -0.69 0.00 0.00 178.15 177.51 1bb1 h ALA 32 N 1.21 0.66 0.79 1.87 0.00 -1.03 -3.30 119.26 119.46 1bb1 h ALA 32 Ca 0.28 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1bb1 h ALA 32 Cb 0.09 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1bb1 h ALA 32 CO -0.04 0.66 -0.38 1.96 0.00 0.00 0.00 179.25 181.45 1bb1 h GLN 33 N 0.84 -1.02 0.00 0.00 1.08 -0.86 -3.51 115.11 111.64 1bb1 h GLN 33 Ca 0.11 0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 1bb1 h GLN 33 Cb 0.80 0.23 0.00 0.00 -0.05 0.00 0.00 27.48 28.47 1bb1 h GLN 33 CO 0.07 -0.68 0.00 -0.89 -0.95 0.00 0.00 178.83 176.38