#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 2.39 3.83 0.46 0.00 -1.26 -4.83 105.19 105.78 2ajj n GLY 2 Ca 0.00 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.78 4.43 -0.11 1.61 -0.87 -1.26 -5.07 114.94 109.90 2ajj s ASN 3 Ca 0.00 -1.35 0.07 0.00 -1.57 0.00 0.00 52.86 50.01 2ajj s ASN 3 Cb 0.00 0.30 -0.11 0.00 -0.02 0.00 0.00 41.25 41.41 2ajj s ASN 3 CO 0.00 -0.93 -0.00 0.00 -2.57 0.00 0.00 177.10 173.60 2ajj n TYR 4 N -1.51 0.00 -0.10 2.20 4.11 -1.26 -4.51 117.16 116.08 2ajj n TYR 4 Ca -0.07 0.00 -0.06 0.00 -0.00 0.00 0.00 57.90 57.77 2ajj n TYR 4 Cb 0.65 -0.49 0.13 0.00 -0.00 0.00 0.00 39.34 39.63 2ajj n TYR 4 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.86 176.62 2ajj h VAL 5 N 0.00 1.25 -0.70 -3.48 3.04 -1.98 -2.04 116.25 112.34 2ajj h VAL 5 Ca -0.27 -1.13 0.00 0.00 -1.01 0.00 0.00 66.70 64.29 2ajj h VAL 5 Cb 1.57 1.00 -0.03 0.00 -2.01 0.00 0.00 31.29 31.81 2ajj h VAL 5 CO 0.00 0.39 0.45 -0.07 -1.01 0.00 0.00 177.57 177.33 2ajj h LEU 6 N 0.72 0.81 -1.05 3.16 -0.00 -1.97 0.13 115.31 117.11 2ajj h LEU 6 Ca 0.13 -0.03 -0.08 0.00 -0.00 0.00 0.00 57.88 57.89 2ajj h LEU 6 Cb 0.55 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 41.00 2ajj h LEU 6 CO 0.03 0.60 -0.20 -0.78 -0.00 0.00 0.00 178.44 178.09 2ajj h ASP 7 N 0.95 0.43 0.67 -0.43 1.82 -1.74 -2.71 116.42 115.40 2ajj h ASP 7 Ca 0.25 -0.13 -0.14 0.00 -0.39 0.00 0.00 57.03 56.63 2ajj h ASP 7 Cb -0.09 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 39.78 2ajj h ASP 7 CO -0.05 0.65 -0.66 -0.07 -1.61 0.00 0.00 179.24 177.49 2ajj h LEU 8 N 0.39 0.00 -1.96 2.28 4.07 -0.54 -3.05 115.31 116.49 2ajj h LEU 8 Ca 0.07 0.00 0.21 0.00 0.08 0.00 0.00 57.88 58.23 2ajj h LEU 8 Cb 0.58 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.29 2ajj h LEU 8 CO 0.04 0.66 0.58 0.40 -1.08 0.00 0.00 178.44 179.03 2ajj h ILE 9 N 0.00 0.50 -0.98 1.22 1.08 -0.44 0.11 117.51 118.99 2ajj h ILE 9 Ca -0.01 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.57 2ajj h ILE 9 Cb 1.17 0.58 -0.08 0.00 -3.07 0.00 0.00 36.82 35.42 2ajj h ILE 9 CO 0.09 0.00 0.61 0.10 -0.69 0.00 0.00 178.15 178.26 2ajj h TYR 10 N 0.00 1.12 -0.23 1.37 -0.00 -1.65 0.44 116.97 118.02 2ajj h TYR 10 Ca 0.34 0.03 -0.17 0.00 -0.00 0.00 0.00 58.73 58.93 2ajj h TYR 10 Cb 1.49 -0.35 0.00 0.00 -0.00 0.00 0.00 36.73 37.87 2ajj h TYR 10 CO 0.00 0.46 -0.52 1.03 -0.00 0.00 0.00 178.16 179.13 2ajj h SER 11 N 0.99 0.85 -0.61 0.10 0.87 -1.00 -1.24 113.55 113.52 2ajj h SER 11 Ca 0.48 -0.56 -0.04 0.00 -1.23 0.00 0.00 61.79 60.44 2ajj h SER 11 Cb 0.43 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.12 2ajj h SER 11 CO -0.25 1.26 0.24 0.25 -0.53 0.00 0.00 176.83 177.79 2ajj h LEU 12 N 0.49 0.85 -0.86 2.23 7.12 -1.18 -2.52 115.31 121.44 2ajj h LEU 12 Ca -0.00 -0.18 -0.10 0.00 0.13 0.00 0.00 57.88 57.74 2ajj h LEU 12 Cb 1.13 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 41.03 2ajj h LEU 12 CO 0.11 0.80 -0.20 -0.74 -0.13 0.00 0.00 178.44 178.28 2ajj h HIS 13 N 0.86 0.69 -0.19 1.25 2.76 -0.12 -2.47 115.15 117.93 2ajj h HIS 13 Ca 0.20 -0.14 0.03 0.00 -2.20 0.00 0.00 60.37 58.26 2ajj h HIS 13 Cb 0.21 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 2ajj h HIS 13 CO 0.01 0.78 0.13 -0.22 -1.30 0.00 0.00 177.93 177.33 2ajj h LYS 14 N 0.55 0.14 0.00 5.26 1.63 -0.79 0.75 116.57 124.11 2ajj h LYS 14 Ca 0.08 -0.01 -0.06 0.00 -0.85 0.00 0.00 60.65 59.82 2ajj h LYS 14 Cb 0.65 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.25 2ajj h LYS 14 CO 0.05 0.09 -0.26 1.96 -3.45 0.00 0.00 179.45 177.83 2ajj h GLN 15 N 0.14 0.00 0.04 1.90 4.20 -1.20 -0.65 115.11 119.54 2ajj h GLN 15 Ca 0.08 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.44 2ajj h GLN 15 Cb 0.16 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.89 2ajj h GLN 15 CO -0.01 0.26 -2.12 -0.89 -0.67 0.00 0.00 178.83 175.40 2ajj n ILE 16 N -3.34 1.60 0.07 2.54 5.41 0.24 -4.32 119.36 121.55 2ajj n ILE 16 Ca 0.01 -0.71 -0.12 0.00 1.00 0.00 0.00 62.75 62.93 2ajj n ILE 16 Cb 0.49 -1.26 -0.03 0.00 -0.71 0.00 0.00 39.64 38.14 2ajj n ILE 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 176.55 175.42 2ajj h ASN 17 N 0.02 0.43 -0.87 4.38 -0.73 0.37 -1.85 115.58 117.35 2ajj h ASN 17 Ca -0.45 -0.35 0.14 0.00 1.87 0.00 0.00 56.30 57.51 2ajj h ASN 17 Cb 2.04 -0.13 -0.07 0.00 0.27 0.00 0.00 38.32 40.43 2ajj h ASN 17 CO 0.03 1.15 0.56 0.08 -0.37 0.00 0.00 177.43 178.88 2ajj h ARG 18 N 0.19 0.63 0.06 6.67 0.11 -1.30 0.40 114.38 121.13 2ajj h ARG 18 Ca -0.07 -0.04 -0.32 0.00 0.10 0.00 0.00 59.98 59.66 2ajj h ARG 18 Cb 1.55 -0.14 -0.03 0.00 1.11 0.00 0.00 29.97 32.46 2ajj h ARG 18 CO 0.15 0.42 -1.78 0.78 0.10 0.00 0.00 179.97 179.64 2ajj h GLY 19 N 0.65 0.14 0.97 0.08 0.00 -1.75 -3.33 103.07 99.84 2ajj h GLY 19 Ca 0.43 -0.36 -0.04 0.00 0.00 0.00 0.00 47.33 47.36 2ajj h GLY 19 CO -0.19 0.31 0.14 -2.00 0.00 0.00 0.00 176.54 174.81 2ajj h LEU 20 N 0.03 0.73 -1.76 3.11 5.85 -0.43 -2.31 115.31 120.54 2ajj h LEU 20 Ca -0.33 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.16 2ajj h LEU 20 Cb 2.02 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 42.85 2ajj h LEU 20 CO 0.09 0.76 -0.07 0.07 -0.34 0.00 0.00 178.44 178.95 2ajj h LYS 21 N 0.67 0.06 -0.09 1.25 2.10 -0.41 -1.96 116.57 118.19 2ajj h LYS 21 Ca 0.16 -0.01 -0.20 0.00 -2.00 0.00 0.00 60.65 58.60 2ajj h LYS 21 Cb 0.29 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 2ajj h LYS 21 CO -0.00 0.14 -0.77 -0.22 -2.00 0.00 0.00 179.45 176.60 2ajj h LYS 22 N 0.06 0.51 -0.57 0.07 3.11 -1.58 0.41 116.57 118.58 2ajj h LYS 22 Ca 0.01 -0.43 -0.05 0.00 -2.81 0.00 0.00 60.65 57.37 2ajj h LYS 22 Cb 0.17 0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.47 2ajj h LYS 22 CO 0.01 1.06 0.15 0.82 -2.81 0.00 0.00 179.45 178.68 2ajj h ILE 23 N 0.34 1.25 0.05 2.00 2.04 -0.83 -0.61 117.51 121.74 2ajj h ILE 23 Ca -0.04 -0.86 -0.24 0.00 1.00 0.00 0.00 64.86 64.71 2ajj h ILE 23 Cb 1.36 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2ajj h ILE 23 CO 0.14 0.32 -1.04 0.58 0.00 0.00 0.00 178.15 178.15 2ajj h VAL 24 N 0.82 1.44 -0.56 1.67 2.07 -1.43 -2.07 116.25 118.19 2ajj h VAL 24 Ca 0.18 -2.67 -0.05 0.00 0.82 0.00 0.00 66.70 64.98 2ajj h VAL 24 Cb 0.32 2.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 2ajj h VAL 24 CO -0.00 0.79 0.17 0.25 0.02 0.00 0.00 177.57 178.80 2ajj h LEU 25 N 0.16 0.82 0.00 2.57 5.85 -0.73 -3.40 115.31 120.58 2ajj h LEU 25 Ca -0.10 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.41 2ajj h LEU 25 Cb 1.71 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.53 2ajj h LEU 25 CO 0.18 0.81 0.00 0.61 -0.34 0.00 0.00 178.44 179.69 2ajj n GLY 26 N -0.70 0.29 1.67 3.75 0.00 -0.25 -5.07 105.19 104.88 2ajj n GLY 26 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.84 -2.37 -1.50 1.61 -0.00 -0.79 -5.06 117.44 108.50 2ajj n TRP 27 Ca 0.00 0.18 0.00 0.00 -0.00 0.00 0.00 57.50 57.68 2ajj n TRP 27 Cb 0.00 0.82 0.00 0.00 -0.00 0.00 0.00 31.31 32.13 2ajj n TRP 27 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69