#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ajj n GLY 2 N 0.00 0.81 0.10 0.46 0.00 -1.26 -5.04 105.19 100.27 2ajj n GLY 2 Ca 0.00 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 2ajj n GLY 2 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2ajj h ASN 3 N 0.00 0.23 0.10 1.61 -1.07 -2.06 -3.20 115.58 111.18 2ajj h ASN 3 Ca 0.00 -0.41 -0.00 0.00 0.07 0.00 0.00 56.30 55.96 2ajj h ASN 3 Cb 0.00 -0.07 -0.00 0.00 -2.07 0.00 0.00 38.32 36.17 2ajj h ASN 3 CO 0.00 1.36 -0.06 0.22 0.07 0.00 0.00 177.43 179.02 2ajj h TYR 4 N 0.04 -0.16 -0.48 4.14 3.20 -2.00 -1.84 116.97 119.88 2ajj h TYR 4 Ca -0.29 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.51 2ajj h TYR 4 Cb 2.01 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 40.31 2ajj h TYR 4 CO 0.04 -0.10 0.02 -0.24 -1.64 0.00 0.00 178.16 176.24 2ajj h VAL 5 N -0.16 1.24 -0.74 1.81 3.04 -1.99 -2.09 116.25 117.36 2ajj h VAL 5 Ca -0.01 -0.95 0.04 0.00 -1.01 0.00 0.00 66.70 64.77 2ajj h VAL 5 Cb 0.13 0.85 -0.05 0.00 -2.01 0.00 0.00 31.29 30.21 2ajj h VAL 5 CO 0.01 0.34 0.46 0.25 -1.01 0.00 0.00 177.57 177.61 2ajj h LEU 6 N 0.73 0.74 -0.75 3.16 7.12 -1.47 0.15 115.31 124.99 2ajj h LEU 6 Ca 0.15 0.01 -0.10 0.00 0.13 0.00 0.00 57.88 58.06 2ajj h LEU 6 Cb 0.42 -0.15 -0.02 0.00 -0.53 0.00 0.00 40.66 40.38 2ajj h LEU 6 CO 0.02 0.50 -0.15 -0.78 -0.13 0.00 0.00 178.44 177.89 2ajj h ASP 7 N 0.88 0.78 0.44 1.25 1.82 -1.01 -2.78 116.42 117.80 2ajj h ASP 7 Ca 0.31 -0.25 -0.09 0.00 -0.39 0.00 0.00 57.03 56.60 2ajj h ASP 7 Cb 0.07 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 39.85 2ajj h ASP 7 CO -0.13 0.94 -0.45 -0.07 -1.61 0.00 0.00 179.24 177.92 2ajj h LEU 8 N 0.70 0.01 -1.97 2.28 4.07 -0.56 -2.80 115.31 117.04 2ajj h LEU 8 Ca 0.11 -0.00 0.22 0.00 0.08 0.00 0.00 57.88 58.29 2ajj h LEU 8 Cb 0.65 -0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.36 2ajj h LEU 8 CO 0.05 0.45 0.60 0.40 -1.08 0.00 0.00 178.44 178.85 2ajj h ILE 9 N 0.01 0.52 -0.93 1.22 2.04 -0.46 0.22 117.51 120.13 2ajj h ILE 9 Ca -0.00 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.98 2ajj h ILE 9 Cb 0.79 0.57 -0.08 0.00 -0.74 0.00 0.00 36.82 37.36 2ajj h ILE 9 CO 0.06 0.00 0.56 0.10 0.00 0.00 0.00 178.15 178.86 2ajj h TYR 10 N 0.00 1.00 -0.17 1.37 -0.00 -1.62 0.28 116.97 117.83 2ajj h TYR 10 Ca 0.37 0.03 -0.20 0.00 0.00 0.00 0.00 58.73 58.93 2ajj h TYR 10 Cb 1.55 -0.31 0.00 0.00 0.00 0.00 0.00 36.73 37.98 2ajj h TYR 10 CO 0.00 0.37 -0.69 1.03 -0.00 0.00 0.00 178.16 178.87 2ajj h SER 11 N 0.87 0.80 -0.61 0.10 0.87 -0.77 -2.86 113.55 111.96 2ajj h SER 11 Ca 0.47 -0.49 -0.02 0.00 -1.23 0.00 0.00 61.79 60.52 2ajj h SER 11 Cb 0.50 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.19 2ajj h SER 11 CO -0.28 1.26 0.33 -0.07 -0.53 0.00 0.00 176.83 177.54 2ajj h LEU 12 N 0.49 0.78 -1.35 2.23 3.38 -0.89 -1.46 115.31 118.49 2ajj h LEU 12 Ca -0.03 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 2ajj h LEU 12 Cb 1.29 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2ajj h LEU 12 CO 0.14 0.65 -0.29 -0.74 0.09 0.00 0.00 178.44 178.28 2ajj h HIS 13 N 0.88 0.00 -0.35 1.13 2.76 -0.39 -2.75 115.15 116.43 2ajj h HIS 13 Ca 0.22 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.38 2ajj h HIS 13 Cb 0.05 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 28.99 2ajj h HIS 13 CO 0.01 0.29 0.15 0.87 -1.30 0.00 0.00 177.93 177.95 2ajj h LYS 14 N 0.00 0.48 -0.62 5.26 1.79 -1.04 -1.44 116.57 121.01 2ajj h LYS 14 Ca -0.00 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.37 2ajj h LYS 14 Cb 0.64 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.16 2ajj h LYS 14 CO 0.04 0.39 0.22 1.96 -1.08 0.00 0.00 179.45 180.98 2ajj h GLN 15 N 0.49 0.95 -0.56 3.15 4.20 -1.51 0.19 115.11 122.01 2ajj h GLN 15 Ca 0.12 -0.19 -0.07 0.00 0.06 0.00 0.00 58.65 58.57 2ajj h GLN 15 Cb 0.08 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 2ajj h GLN 15 CO -0.02 0.82 0.06 0.82 -0.67 0.00 0.00 178.83 179.85 2ajj h ILE 16 N 0.88 1.26 -0.52 2.54 2.04 -1.43 -2.78 117.51 119.50 2ajj h ILE 16 Ca 0.20 -1.02 -0.12 0.00 1.00 0.00 0.00 64.86 64.91 2ajj h ILE 16 Cb 0.25 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2ajj h ILE 16 CO -0.01 0.37 -0.16 -1.13 0.00 0.00 0.00 178.15 177.22 2ajj h ASN 17 N 0.83 1.04 -0.21 1.72 -0.73 -0.96 -1.01 115.58 116.27 2ajj h ASN 17 Ca 0.17 -0.37 0.05 0.00 1.87 0.00 0.00 56.30 58.01 2ajj h ASN 17 Cb 0.46 -0.29 -0.05 0.00 0.27 0.00 0.00 38.32 38.72 2ajj h ASN 17 CO 0.02 1.18 -0.08 -0.09 -0.37 0.00 0.00 177.43 178.08 2ajj h ARG 18 N 0.90 -0.05 -0.52 6.67 9.65 -0.44 0.32 114.38 130.92 2ajj h ARG 18 Ca 0.13 0.00 -0.10 0.00 -1.10 0.00 0.00 59.98 58.91 2ajj h ARG 18 Cb 0.74 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.31 2ajj h ARG 18 CO 0.06 -0.03 -0.07 0.78 2.80 0.00 0.00 179.97 183.50 2ajj h GLY 19 N -0.05 1.04 0.76 2.80 0.00 -1.44 -2.36 103.07 103.82 2ajj h GLY 19 Ca 0.11 -0.82 0.06 0.00 0.00 0.00 0.00 47.33 46.67 2ajj h GLY 19 CO -0.24 0.76 0.65 -2.00 0.00 0.00 0.00 176.54 175.70 2ajj h LEU 20 N 0.83 1.05 -0.49 3.11 5.85 -0.35 -1.90 115.31 123.40 2ajj h LEU 20 Ca 0.14 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.74 2ajj h LEU 20 Cb 0.63 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2ajj h LEU 20 CO 0.04 0.68 -0.19 0.11 -0.34 0.00 0.00 178.44 178.74 2ajj h LYS 21 N 1.19 1.00 -0.64 1.25 6.56 -0.13 -2.70 116.57 123.10 2ajj h LYS 21 Ca 0.43 -0.41 -0.03 0.00 -1.06 0.00 0.00 60.65 59.57 2ajj h LYS 21 Cb 0.14 -0.04 -0.03 0.00 -0.57 0.00 0.00 32.23 31.73 2ajj h LYS 21 CO -0.16 1.09 0.29 -0.22 -2.06 0.00 0.00 179.45 178.39 2ajj h LYS 22 N 0.86 0.92 -0.53 3.15 3.11 -0.85 0.59 116.57 123.82 2ajj h LYS 22 Ca 0.12 -0.13 -0.10 0.00 -2.81 0.00 0.00 60.65 57.72 2ajj h LYS 22 Cb 0.77 -0.17 -0.02 0.00 -1.00 0.00 0.00 32.23 31.81 2ajj h LYS 22 CO 0.06 0.72 -0.08 0.82 -2.81 0.00 0.00 179.45 178.17 2ajj h ILE 23 N 0.91 1.27 0.02 2.00 2.04 -1.23 -0.58 117.51 121.94 2ajj h ILE 23 Ca 0.22 -1.22 -0.21 0.00 1.00 0.00 0.00 64.86 64.65 2ajj h ILE 23 Cb 0.12 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2ajj h ILE 23 CO -0.03 0.43 -0.94 0.58 0.00 0.00 0.00 178.15 178.20 2ajj h VAL 24 N 0.86 1.54 -0.22 1.67 2.07 -1.13 -3.01 116.25 118.03 2ajj h VAL 24 Ca 0.14 -2.83 -0.12 0.00 0.82 0.00 0.00 66.70 64.71 2ajj h VAL 24 Cb 0.64 2.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.99 2ajj h VAL 24 CO 0.04 0.82 -0.38 0.25 0.02 0.00 0.00 177.57 178.32 2ajj h LEU 25 N 0.07 0.51 0.00 2.57 5.85 0.35 -3.37 115.31 121.29 2ajj h LEU 25 Ca -0.05 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.46 2ajj h LEU 25 Cb 1.60 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.49 2ajj h LEU 25 CO 0.14 0.84 0.00 0.61 -0.34 0.00 0.00 178.44 179.69 2ajj n GLY 26 N -0.11 0.49 2.05 3.75 0.00 -0.24 -5.01 105.19 106.12 2ajj n GLY 26 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2ajj n GLY 26 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2ajj n TRP 27 N -0.39 -2.98 -1.87 1.61 -0.00 -1.17 -5.11 117.44 107.53 2ajj n TRP 27 Ca 0.00 0.69 0.00 0.00 -0.00 0.00 0.00 57.50 58.19 2ajj n TRP 27 Cb 0.00 1.31 0.00 0.00 -0.00 0.00 0.00 31.31 32.62 2ajj n TRP 27 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69