#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 2.89 3.32 5.00 0.00 -1.26 -4.79 105.19 110.35 2ajj n GLY 2 Ca 0.00 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.12 2ajj n GLY 2 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ajj s ASN 3 N 0.00 0.03 0.06 1.61 0.01 -1.26 -5.03 114.94 110.35 2ajj s ASN 3 Ca 0.00 -0.77 -0.24 0.00 -0.71 0.00 0.00 52.86 51.14 2ajj s ASN 3 Cb 0.00 0.42 -0.17 0.00 0.41 0.00 0.00 41.25 41.92 2ajj s ASN 3 CO 0.00 -0.86 1.60 0.22 -1.51 0.00 0.00 177.10 176.54 2ajj h TYR 4 N 2.56 -0.02 -0.77 2.20 3.20 -1.99 -1.91 116.97 120.23 2ajj h TYR 4 Ca -0.32 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.53 2ajj h TYR 4 Cb 1.22 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.47 2ajj h TYR 4 CO 0.40 0.13 0.42 -0.39 -1.64 0.00 0.00 178.16 177.07 2ajj h VAL 5 N -0.17 1.23 -0.82 1.81 -1.51 -1.98 -0.96 116.25 113.85 2ajj h VAL 5 Ca -0.00 -0.58 0.02 0.00 -1.23 0.00 0.00 66.70 64.91 2ajj h VAL 5 Cb 0.16 0.19 -0.05 0.00 -2.13 0.00 0.00 31.29 29.46 2ajj h VAL 5 CO 0.00 0.26 0.54 0.25 -1.23 0.00 0.00 177.57 177.39 2ajj h LEU 6 N 1.08 0.91 -0.94 4.19 6.46 -1.88 0.49 115.31 125.62 2ajj h LEU 6 Ca 0.27 -0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.93 2ajj h LEU 6 Cb 0.03 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 39.73 2ajj h LEU 6 CO -0.04 0.64 -0.23 0.44 -0.62 0.00 0.00 178.44 178.63 2ajj h ASP 7 N 1.07 0.50 0.69 1.25 5.19 -0.61 -2.90 116.42 121.62 2ajj h ASP 7 Ca 0.32 -0.17 -0.19 0.00 -0.62 0.00 0.00 57.03 56.37 2ajj h ASP 7 Cb -0.06 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.30 2ajj h ASP 7 CO -0.09 0.74 -0.85 -0.07 -3.12 0.00 0.00 179.24 175.84 2ajj h LEU 8 N 0.45 0.14 -1.87 1.55 4.07 0.08 -3.17 115.31 116.56 2ajj h LEU 8 Ca 0.07 -0.12 0.21 0.00 0.08 0.00 0.00 57.88 58.12 2ajj h LEU 8 Cb 0.65 -0.04 -0.03 0.00 1.08 0.00 0.00 40.66 42.32 2ajj h LEU 8 CO 0.05 0.93 0.65 0.40 -1.08 0.00 0.00 178.44 179.38 2ajj h ILE 9 N 0.06 0.37 -0.96 1.22 1.08 0.14 0.27 117.51 119.69 2ajj h ILE 9 Ca -0.03 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.53 2ajj h ILE 9 Cb 1.48 0.51 -0.07 0.00 -3.07 0.00 0.00 36.82 35.68 2ajj h ILE 9 CO 0.12 0.00 0.62 0.10 -0.69 0.00 0.00 178.15 178.30 2ajj h TYR 10 N 0.00 1.10 0.00 1.37 -0.00 -1.65 0.65 116.97 118.44 2ajj h TYR 10 Ca 0.34 0.03 -0.10 0.00 -0.00 0.00 0.00 58.73 59.00 2ajj h TYR 10 Cb 1.64 -0.36 -0.01 0.00 -0.00 0.00 0.00 36.73 37.99 2ajj h TYR 10 CO 0.00 0.52 -0.49 1.03 -0.00 0.00 0.00 178.16 179.22 2ajj h SER 11 N 1.04 0.00 1.02 0.10 0.87 -0.69 -1.91 113.55 113.97 2ajj h SER 11 Ca 0.43 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.80 2ajj h SER 11 Cb 0.31 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.24 2ajj h SER 11 CO -0.19 0.49 -1.00 -0.07 -0.53 0.00 0.00 176.83 175.53 2ajj h LEU 12 N 0.00 0.00 0.21 2.23 3.38 -0.84 -3.33 115.31 116.96 2ajj h LEU 12 Ca -0.00 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.63 2ajj h LEU 12 Cb 1.22 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.99 2ajj h LEU 12 CO 0.06 0.88 -1.55 -0.74 0.09 0.00 0.00 178.44 177.19 2ajj h HIS 13 N 0.00 0.81 -0.32 1.13 2.76 0.26 -3.30 115.15 116.49 2ajj h HIS 13 Ca -0.05 -0.59 0.09 0.00 -2.20 0.00 0.00 60.37 57.62 2ajj h HIS 13 Cb 1.71 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 30.63 2ajj h HIS 13 CO 0.00 1.55 0.27 1.57 -1.30 0.00 0.00 177.93 180.02 2ajj h LYS 14 N 0.12 0.00 -0.58 5.26 5.09 -1.46 -0.42 116.57 124.58 2ajj h LYS 14 Ca -0.27 0.00 -0.05 0.00 0.09 0.00 0.00 60.65 60.42 2ajj h LYS 14 Cb 2.12 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 34.42 2ajj h LYS 14 CO 0.23 0.00 0.15 0.37 -2.09 0.00 0.00 179.45 178.11 2ajj h GLN 15 N 0.00 0.92 -0.50 0.07 5.75 -1.67 0.40 115.11 120.08 2ajj h GLN 15 Ca 0.15 -0.21 -0.12 0.00 -0.15 0.00 0.00 58.65 58.32 2ajj h GLN 15 Cb 0.69 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 29.10 2ajj h GLN 15 CO -0.00 0.84 -0.16 0.82 -2.65 0.00 0.00 178.83 177.68 2ajj h ILE 16 N 0.83 1.27 -0.38 2.39 2.04 -1.25 -2.98 117.51 119.42 2ajj h ILE 16 Ca 0.18 -1.31 -0.12 0.00 1.00 0.00 0.00 64.86 64.62 2ajj h ILE 16 Cb 0.33 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 2ajj h ILE 16 CO -0.00 0.46 -0.22 -1.13 0.00 0.00 0.00 178.15 177.26 2ajj h ASN 17 N 0.85 0.85 -0.92 1.72 -0.73 -1.07 -0.45 115.58 115.82 2ajj h ASN 17 Ca 0.12 -0.42 0.15 0.00 1.87 0.00 0.00 56.30 58.03 2ajj h ASN 17 Cb 0.72 -0.24 -0.10 0.00 0.27 0.00 0.00 38.32 38.98 2ajj h ASN 17 CO 0.06 1.08 0.52 -0.09 -0.37 0.00 0.00 177.43 178.63 2ajj h ARG 18 N 0.62 0.71 0.16 6.67 2.43 -0.08 0.41 114.38 125.30 2ajj h ARG 18 Ca 0.08 -0.04 -0.31 0.00 -0.81 0.00 0.00 59.98 58.90 2ajj h ARG 18 Cb 0.78 -0.16 0.01 0.00 -0.42 0.00 0.00 29.97 30.17 2ajj h ARG 18 CO 0.06 0.47 -1.46 0.78 -1.51 0.00 0.00 179.97 178.32 2ajj h GLY 19 N 0.74 0.39 0.97 2.80 0.00 -1.44 -3.08 103.07 103.45 2ajj h GLY 19 Ca 0.50 -0.99 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 2ajj h GLY 19 CO -0.35 0.87 0.18 -2.00 0.00 0.00 0.00 176.54 175.25 2ajj h LEU 20 N 0.09 0.37 -1.39 3.11 5.85 0.03 -2.14 115.31 121.24 2ajj h LEU 20 Ca -0.22 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 2ajj h LEU 20 Cb 2.05 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.98 2ajj h LEU 20 CO 0.20 0.32 -0.26 0.07 -0.34 0.00 0.00 178.44 178.44 2ajj h LYS 21 N 0.39 0.00 -0.14 1.25 5.09 -0.35 -2.59 116.57 120.23 2ajj h LYS 21 Ca 0.11 0.00 -0.14 0.00 0.09 0.00 0.00 60.65 60.71 2ajj h LYS 21 Cb 0.02 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.34 2ajj h LYS 21 CO -0.02 0.26 -0.52 -0.22 -2.09 0.00 0.00 179.45 176.86 2ajj h LYS 22 N 0.00 0.38 -0.26 0.07 3.11 -1.31 0.62 116.57 119.19 2ajj h LYS 22 Ca -0.00 -0.23 -0.18 0.00 -2.81 0.00 0.00 60.65 57.42 2ajj h LYS 22 Cb 0.62 0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.87 2ajj h LYS 22 CO 0.03 0.81 -0.57 0.82 -2.81 0.00 0.00 179.45 177.73 2ajj h ILE 23 N 0.30 1.28 -0.01 2.00 2.04 -1.03 0.36 117.51 122.45 2ajj h ILE 23 Ca 0.01 -1.77 -0.17 0.00 1.00 0.00 0.00 64.86 63.93 2ajj h ILE 23 Cb 1.01 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 2ajj h ILE 23 CO 0.09 0.57 -0.78 0.58 0.00 0.00 0.00 178.15 178.61 2ajj h VAL 24 N 0.61 1.51 0.14 1.67 2.07 -1.37 -0.40 116.25 120.48 2ajj h VAL 24 Ca 0.01 -2.52 -0.23 0.00 0.82 0.00 0.00 66.70 64.77 2ajj h VAL 24 Cb 1.17 2.37 0.01 0.00 -1.52 0.00 0.00 31.29 33.32 2ajj h VAL 24 CO 0.12 0.73 -1.10 0.25 0.02 0.00 0.00 177.57 177.59 2ajj h LEU 25 N 0.06 0.45 0.00 2.57 5.85 -0.80 -3.40 115.31 120.04 2ajj h LEU 25 Ca -0.02 -0.91 -0.00 0.00 0.84 0.00 0.00 57.88 57.79 2ajj h LEU 25 Cb 1.36 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 2ajj h LEU 25 CO 0.11 1.50 -0.01 1.23 -0.34 0.00 0.00 178.44 180.93 2ajj h GLY 26 N -0.17 0.00 -5.06 3.75 0.00 -0.37 -3.44 103.07 97.78 2ajj h GLY 26 Ca -0.22 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.54 2ajj h GLY 26 CO 0.12 0.00 0.79 0.86 0.00 0.00 0.00 176.54 178.31 2ajj s TRP 27 N -1.65 3.33 0.00 5.60 -0.00 -0.16 -5.05 118.94 121.01 2ajj s TRP 27 Ca -0.03 1.46 0.00 0.00 -0.00 0.00 0.00 56.10 57.53 2ajj s TRP 27 Cb -0.00 -3.28 0.00 0.00 -0.00 0.00 0.00 33.47 30.19 2ajj s TRP 27 CO 0.09 -0.52 0.00 0.00 -0.00 0.00 0.00 176.95 176.52