#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1piq h MET 2 N 0.00 0.61 -0.74 -0.14 2.86 -2.05 -2.41 114.93 113.06 1piq h MET 2 Ca 0.00 -0.27 -0.06 0.00 -2.06 0.00 0.00 59.70 57.32 1piq h MET 2 Cb 0.00 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 1piq h MET 2 CO 0.00 0.84 0.24 -0.22 1.06 0.00 0.00 176.91 178.84 1piq h LYS 3 N 0.52 1.13 -0.56 1.72 3.64 -2.05 -0.25 116.57 120.73 1piq h LYS 3 Ca 0.06 -0.23 -0.05 0.00 -1.27 0.00 0.00 60.65 59.16 1piq h LYS 3 Cb 0.79 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.42 1piq h LYS 3 CO 0.06 0.95 0.13 1.96 -2.27 0.00 0.00 179.45 180.29 1piq h GLN 4 N 1.09 0.86 -0.18 1.90 4.20 -1.94 0.81 115.11 121.84 1piq h GLN 4 Ca 0.24 -0.18 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 1piq h GLN 4 Cb 0.29 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1piq h GLN 4 CO -0.01 0.77 0.00 0.82 -0.67 0.00 0.00 178.83 179.75 1piq h ILE 5 N 0.82 1.25 -0.67 2.54 2.04 -0.96 -1.92 117.51 120.62 1piq h ILE 5 Ca 0.18 -0.84 -0.03 0.00 1.00 0.00 0.00 64.86 65.17 1piq h ILE 5 Cb 0.30 1.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 1piq h ILE 5 CO -0.00 0.25 0.28 -0.33 0.00 0.00 0.00 178.15 178.35 1piq h GLU 6 N 0.08 0.97 -0.67 2.37 5.08 -0.64 -0.43 114.58 121.34 1piq h GLU 6 Ca 0.05 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 1piq h GLU 6 Cb 0.38 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1piq h GLU 6 CO 0.01 0.78 0.10 -0.44 -1.00 0.00 0.00 179.01 178.46 1piq h ASP 7 N 0.96 1.07 -0.63 1.42 3.32 -0.76 -0.75 116.42 121.05 1piq h ASP 7 Ca 0.23 -0.26 -0.09 0.00 0.02 0.00 0.00 57.03 56.93 1piq h ASP 7 Cb 0.17 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 1piq h ASP 7 CO -0.02 1.06 0.05 0.50 -1.72 0.00 0.00 179.24 179.11 1piq h LYS 8 N 1.04 1.07 -0.73 3.56 1.63 -0.68 -1.90 116.57 120.57 1piq h LYS 8 Ca 0.20 -0.32 -0.01 0.00 -0.85 0.00 0.00 60.65 59.67 1piq h LYS 8 Cb 0.45 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.94 1piq h LYS 8 CO 0.01 1.02 0.40 0.82 -3.45 0.00 0.00 179.45 178.26 1piq h ILE 9 N 0.98 1.22 -0.57 2.00 2.04 -0.77 -0.72 117.51 121.69 1piq h ILE 9 Ca 0.18 -0.53 0.02 0.00 1.00 0.00 0.00 64.86 65.53 1piq h ILE 9 Cb 0.50 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 1piq h ILE 9 CO 0.02 0.24 0.37 -0.33 0.00 0.00 0.00 178.15 178.45 1piq h GLU 10 N 1.01 0.71 -0.78 2.37 5.08 -0.55 0.28 114.58 122.70 1piq h GLU 10 Ca 0.26 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.52 1piq h GLU 10 Cb 0.02 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 1piq h GLU 10 CO -0.04 0.47 0.28 0.93 -1.00 0.00 0.00 179.01 179.65 1piq h GLU 11 N 0.73 1.19 -0.46 2.33 5.08 -0.64 -1.56 114.58 121.25 1piq h GLU 11 Ca 0.22 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1piq h GLU 11 Cb -0.04 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.01 1piq h GLU 11 CO -0.07 0.98 0.08 0.82 -1.00 0.00 0.00 179.01 179.82 1piq h ILE 12 N 1.15 1.24 -0.67 3.13 2.04 -0.67 -1.67 117.51 122.07 1piq h ILE 12 Ca 0.26 -0.89 -0.06 0.00 1.00 0.00 0.00 64.86 65.16 1piq h ILE 12 Cb 0.26 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 1piq h ILE 12 CO -0.01 0.32 0.18 -0.07 0.00 0.00 0.00 178.15 178.56 1piq h LEU 13 N 0.63 0.99 -0.66 1.44 3.38 -0.71 -0.12 115.31 120.26 1piq h LEU 13 Ca 0.14 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1piq h LEU 13 Cb 0.38 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1piq h LEU 13 CO 0.01 0.95 0.20 0.28 0.09 0.00 0.00 178.44 179.97 1piq h SER 14 N 0.98 0.98 -0.31 -0.43 0.02 -1.14 -1.41 113.55 112.24 1piq h SER 14 Ca 0.21 -0.21 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 1piq h SER 14 Cb 0.33 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1piq h SER 14 CO -0.00 0.93 -0.24 0.50 -1.14 0.00 0.00 176.83 176.88 1piq h LYS 15 N 0.97 0.80 -0.86 3.45 1.63 -0.97 -2.01 116.57 119.58 1piq h LYS 15 Ca 0.21 -0.34 -0.02 0.00 -0.85 0.00 0.00 60.65 59.66 1piq h LYS 15 Cb 0.31 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 31.87 1piq h LYS 15 CO -0.00 0.96 0.48 0.37 -3.45 0.00 0.00 179.45 177.80 1piq h GLN 16 N 0.70 1.20 -0.60 1.90 4.15 -0.63 0.49 115.11 122.31 1piq h GLN 16 Ca 0.09 -0.13 -0.07 0.00 0.77 0.00 0.00 58.65 59.30 1piq h GLN 16 Cb 0.76 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 28.19 1piq h GLN 16 CO 0.06 0.87 0.09 -0.92 -1.93 0.00 0.00 178.83 177.00 1piq h TYR 17 N 1.20 1.06 -0.39 3.99 3.20 -1.01 -0.86 116.97 124.17 1piq h TYR 17 Ca 0.30 -0.15 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 1piq h TYR 17 Cb 0.02 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 37.98 1piq h TYR 17 CO 0.01 0.92 0.18 1.25 -1.64 0.00 0.00 178.16 178.88 1piq h HIS 18 N 0.90 0.57 -0.63 -3.82 2.76 -0.88 -1.11 115.15 112.94 1piq h HIS 18 Ca 0.18 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1piq h HIS 18 Cb 0.44 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.19 1piq h HIS 18 CO 0.03 0.48 0.41 0.82 -1.30 0.00 0.00 177.93 178.37 1piq h ILE 19 N 0.49 1.17 -0.63 6.26 2.04 -0.65 -0.37 117.51 125.82 1piq h ILE 19 Ca 0.13 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 1piq h ILE 19 Cb 0.13 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 1piq h ILE 19 CO -0.02 0.16 0.25 -0.33 0.00 0.00 0.00 178.15 178.22 1piq h GLU 20 N 0.85 0.91 -0.33 2.37 5.08 -0.80 -0.17 114.58 122.49 1piq h GLU 20 Ca 0.23 -0.15 -0.14 0.00 -1.00 0.00 0.00 59.36 58.30 1piq h GLU 20 Cb -0.09 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 1piq h GLU 20 CO -0.05 0.75 -0.36 -0.91 -1.00 0.00 0.00 179.01 177.44 1piq h ASN 21 N 0.90 0.81 -0.56 1.42 2.35 -0.70 -1.00 115.58 118.80 1piq h ASN 21 Ca 0.21 -0.35 -0.00 0.00 -0.55 0.00 0.00 56.30 55.61 1piq h ASN 21 Cb 0.17 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 1piq h ASN 21 CO -0.02 1.08 0.34 -0.33 -1.65 0.00 0.00 177.43 176.85 1piq h GLU 22 N 0.64 0.76 -0.77 0.81 5.08 -0.35 -1.66 114.58 119.09 1piq h GLU 22 Ca 0.06 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1piq h GLU 22 Cb 0.90 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 1piq h GLU 22 CO 0.08 0.54 0.35 0.82 -1.00 0.00 0.00 179.01 179.80 1piq h ILE 23 N 0.75 1.25 -0.75 3.13 2.04 -0.88 -1.29 117.51 121.77 1piq h ILE 23 Ca 0.20 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 1piq h ILE 23 Cb -0.03 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.32 1piq h ILE 23 CO -0.04 0.30 0.45 0.00 0.00 0.00 0.00 178.15 178.86 1piq h ALA 24 N 1.18 1.37 -0.49 1.87 0.00 -0.78 0.14 119.26 122.55 1piq h ALA 24 Ca 0.26 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 1piq h ALA 24 Cb 0.14 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1piq h ALA 24 CO -0.03 0.54 -0.19 0.00 0.00 0.00 0.00 179.25 179.57 1piq h ARG 25 N 1.04 0.98 -0.41 0.00 3.08 -0.80 -1.18 114.38 117.10 1piq h ARG 25 Ca 0.27 -0.40 -0.05 0.00 0.07 0.00 0.00 59.98 59.87 1piq h ARG 25 Cb -0.04 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1piq h ARG 25 CO -0.05 1.08 0.04 0.82 -1.07 0.00 0.00 179.97 180.79 1piq h ILE 26 N 0.86 1.25 -0.57 2.04 2.04 -0.76 -0.24 117.51 122.13 1piq h ILE 26 Ca 0.12 -0.93 -0.03 0.00 1.00 0.00 0.00 64.86 65.02 1piq h ILE 26 Cb 0.76 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 1piq h ILE 26 CO 0.06 0.32 0.22 0.11 0.00 0.00 0.00 178.15 178.85 1piq h LYS 27 N 0.54 0.82 -0.45 2.37 1.57 -0.85 -1.83 116.57 118.75 1piq h LYS 27 Ca 0.12 -0.13 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 1piq h LYS 27 Cb 0.41 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1piq h LYS 27 CO 0.01 0.69 -0.07 -0.22 -0.57 0.00 0.00 179.45 179.28 1piq h LYS 28 N 0.81 0.84 -0.80 3.15 3.64 -0.90 -1.25 116.57 122.07 1piq h LYS 28 Ca 0.19 -0.31 -0.03 0.00 -1.27 0.00 0.00 60.65 59.23 1piq h LYS 28 Cb 0.18 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 1piq h LYS 28 CO -0.02 0.94 0.37 1.25 -2.27 0.00 0.00 179.45 179.72 1piq h LEU 29 N 0.68 1.05 -1.24 5.20 5.85 -0.55 -1.91 115.31 124.40 1piq h LEU 29 Ca 0.12 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1piq h LEU 29 Cb 0.60 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1piq h LEU 29 CO 0.04 0.90 0.00 2.30 -0.34 0.00 0.00 178.44 181.33 1piq n ILE 30 N -4.30 0.16 1.69 4.05 -5.35 -0.73 -5.10 119.36 109.77 1piq n ILE 30 Ca 0.08 -0.37 0.15 0.00 -0.27 0.00 0.00 62.75 62.34 1piq n ILE 30 Cb 0.15 0.55 0.69 0.00 -1.74 0.00 0.00 39.64 39.28 1piq n ILE 30 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40