#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 2.69 6.42 0.23 0.00 -1.26 -5.13 105.19 108.14 2ajj n GLY 2 Ca 0.00 -0.39 0.02 0.00 0.00 0.00 0.00 46.02 45.65 2ajj n GLY 2 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ajj n ASN 3 N 0.00 -4.76 -0.08 1.61 2.85 -1.26 -2.73 115.26 110.89 2ajj n ASN 3 Ca 0.00 0.12 -0.14 0.00 -0.11 0.00 0.00 54.58 54.45 2ajj n ASN 3 Cb 0.00 -0.33 -0.05 0.00 1.24 0.00 0.00 39.78 40.64 2ajj n ASN 3 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ajj n TYR 4 N -1.72 0.00 -0.17 1.20 4.19 -1.26 -4.10 117.16 115.30 2ajj n TYR 4 Ca 0.00 0.00 -0.10 0.00 3.31 0.00 0.00 57.90 61.11 2ajj n TYR 4 Cb 0.05 -0.56 0.00 0.00 0.49 0.00 0.00 39.34 39.32 2ajj n TYR 4 CO 0.00 0.00 0.00 -0.39 0.91 0.00 0.00 176.86 177.38 2ajj h VAL 5 N -0.79 1.27 -0.67 2.97 -1.51 -1.99 -1.45 116.25 114.09 2ajj h VAL 5 Ca -0.24 -1.19 -0.01 0.00 -1.23 0.00 0.00 66.70 64.03 2ajj h VAL 5 Cb 1.08 1.02 -0.03 0.00 -2.13 0.00 0.00 31.29 31.24 2ajj h VAL 5 CO -0.14 0.42 0.38 0.25 -1.23 0.00 0.00 177.57 177.24 2ajj h LEU 6 N 0.79 0.82 -1.36 4.19 6.46 -1.83 0.21 115.31 124.59 2ajj h LEU 6 Ca 0.13 -0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 57.76 2ajj h LEU 6 Cb 0.62 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.33 2ajj h LEU 6 CO 0.04 0.67 -0.12 0.44 -0.62 0.00 0.00 178.44 178.85 2ajj h ASP 7 N 0.91 0.26 0.76 1.25 5.19 -1.35 -2.45 116.42 120.99 2ajj h ASP 7 Ca 0.24 -0.05 -0.18 0.00 -0.62 0.00 0.00 57.03 56.41 2ajj h ASP 7 Cb 0.02 -0.07 -0.02 0.00 0.18 0.00 0.00 39.33 39.44 2ajj h ASP 7 CO -0.04 0.41 -0.85 -0.07 -3.12 0.00 0.00 179.24 175.57 2ajj h LEU 8 N 0.26 0.08 -1.87 1.55 4.07 -0.13 -3.18 115.31 116.08 2ajj h LEU 8 Ca 0.05 -0.07 0.20 0.00 0.08 0.00 0.00 57.88 58.14 2ajj h LEU 8 Cb 0.38 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 42.07 2ajj h LEU 8 CO 0.02 0.89 0.63 0.40 -1.08 0.00 0.00 178.44 179.30 2ajj h ILE 9 N 0.03 0.37 -0.91 1.22 1.08 -0.11 0.17 117.51 119.36 2ajj h ILE 9 Ca -0.02 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.52 2ajj h ILE 9 Cb 1.49 0.52 -0.07 0.00 -3.07 0.00 0.00 36.82 35.70 2ajj h ILE 9 CO 0.12 0.00 0.57 0.10 -0.69 0.00 0.00 178.15 178.24 2ajj h TYR 10 N 0.00 1.05 0.00 1.37 -0.00 -1.65 0.81 116.97 118.55 2ajj h TYR 10 Ca 0.32 0.03 -0.13 0.00 -0.00 0.00 0.00 58.73 58.96 2ajj h TYR 10 Cb 1.57 -0.34 -0.02 0.00 -0.00 0.00 0.00 36.73 37.95 2ajj h TYR 10 CO 0.00 0.51 -0.60 1.03 -0.00 0.00 0.00 178.16 179.10 2ajj h SER 11 N 1.01 0.00 0.63 0.10 0.87 -0.89 -2.69 113.55 112.58 2ajj h SER 11 Ca 0.40 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.72 2ajj h SER 11 Cb 0.22 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2ajj h SER 11 CO -0.19 0.60 -1.08 0.25 -0.53 0.00 0.00 176.83 175.88 2ajj h LEU 12 N 0.00 0.34 -0.33 2.23 5.85 -0.92 -3.31 115.31 119.17 2ajj h LEU 12 Ca -0.01 -0.33 -0.19 0.00 0.84 0.00 0.00 57.88 58.19 2ajj h LEU 12 Cb 1.29 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.21 2ajj h LEU 12 CO 0.08 1.21 -0.70 -0.74 -0.34 0.00 0.00 178.44 177.95 2ajj h HIS 13 N 0.09 0.80 -0.06 1.25 2.76 0.60 -3.09 115.15 117.51 2ajj h HIS 13 Ca -0.09 -0.34 0.02 0.00 -2.20 0.00 0.00 60.37 57.76 2ajj h HIS 13 Cb 1.78 -0.13 -0.00 0.00 1.55 0.00 0.00 27.41 30.61 2ajj h HIS 13 CO 0.05 1.12 0.07 1.57 -1.30 0.00 0.00 177.93 179.44 2ajj h LYS 14 N 0.43 0.00 -0.25 5.26 5.09 -1.56 -1.05 116.57 124.49 2ajj h LYS 14 Ca -0.03 0.00 -0.10 0.00 0.09 0.00 0.00 60.65 60.61 2ajj h LYS 14 Cb 1.29 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.62 2ajj h LYS 14 CO 0.13 0.00 -0.24 1.96 -2.09 0.00 0.00 179.45 179.22 2ajj h GLN 15 N 0.00 0.60 -0.13 0.07 4.20 -1.65 -2.34 115.11 115.86 2ajj h GLN 15 Ca 0.03 -0.31 -0.10 0.00 0.06 0.00 0.00 58.65 58.33 2ajj h GLN 15 Cb 0.17 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2ajj h GLN 15 CO -0.00 0.91 -0.34 0.82 -0.67 0.00 0.00 178.83 179.54 2ajj h ILE 16 N 0.31 1.28 -0.70 2.54 2.04 -1.32 -2.87 117.51 118.80 2ajj h ILE 16 Ca 0.04 -1.36 -0.07 0.00 1.00 0.00 0.00 64.86 64.47 2ajj h ILE 16 Cb 0.79 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 2ajj h ILE 16 CO 0.06 0.41 0.15 -1.13 0.00 0.00 0.00 178.15 177.64 2ajj h ASN 17 N 0.23 1.08 -0.65 1.72 -0.73 -1.09 0.14 115.58 116.27 2ajj h ASN 17 Ca 0.03 -0.24 0.11 0.00 1.87 0.00 0.00 56.30 58.07 2ajj h ASN 17 Cb 0.72 -0.28 -0.08 0.00 0.27 0.00 0.00 38.32 38.94 2ajj h ASN 17 CO 0.05 1.04 0.22 0.03 -0.37 0.00 0.00 177.43 178.41 2ajj h ARG 18 N 1.06 0.37 0.18 6.67 3.08 -1.18 0.43 114.38 124.99 2ajj h ARG 18 Ca 0.22 -0.02 -0.30 0.00 0.07 0.00 0.00 59.98 59.94 2ajj h ARG 18 Cb 0.40 -0.08 0.02 0.00 0.08 0.00 0.00 29.97 30.39 2ajj h ARG 18 CO 0.01 0.24 -1.33 0.78 -1.07 0.00 0.00 179.97 178.60 2ajj h GLY 19 N 0.38 0.47 0.92 0.04 0.00 -1.56 -3.04 103.07 100.27 2ajj h GLY 19 Ca 0.34 -1.16 0.02 0.00 0.00 0.00 0.00 47.33 46.53 2ajj h GLY 19 CO -0.36 1.02 0.53 -2.00 0.00 0.00 0.00 176.54 175.73 2ajj h LEU 20 N 0.12 0.89 -0.75 3.11 5.85 0.20 -1.62 115.31 123.11 2ajj h LEU 20 Ca -0.19 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.40 2ajj h LEU 20 Cb 2.04 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.84 2ajj h LEU 20 CO 0.24 0.62 -0.57 0.07 -0.34 0.00 0.00 178.44 178.45 2ajj h LYS 21 N 1.05 0.00 -0.28 1.25 2.10 -0.26 -3.04 116.57 117.38 2ajj h LYS 21 Ca 0.32 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.79 2ajj h LYS 21 Cb -0.04 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.29 2ajj h LYS 21 CO -0.10 0.57 -0.52 -0.22 -2.00 0.00 0.00 179.45 177.18 2ajj h LYS 22 N 0.00 0.82 -0.24 0.07 3.11 -1.26 0.98 116.57 120.04 2ajj h LYS 22 Ca -0.01 -0.51 -0.01 0.00 -2.81 0.00 0.00 60.65 57.32 2ajj h LYS 22 Cb 1.09 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 32.36 2ajj h LYS 22 CO 0.07 1.14 0.11 0.82 -2.81 0.00 0.00 179.45 178.78 2ajj h ILE 23 N 0.64 1.15 -0.28 2.00 2.04 -1.29 0.93 117.51 122.71 2ajj h ILE 23 Ca 0.02 -0.46 -0.14 0.00 1.00 0.00 0.00 64.86 65.29 2ajj h ILE 23 Cb 1.12 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 2ajj h ILE 23 CO 0.11 0.16 -0.40 0.58 0.00 0.00 0.00 178.15 178.60 2ajj h VAL 24 N 0.26 1.29 -0.18 1.67 2.07 -1.52 0.22 116.25 120.06 2ajj h VAL 24 Ca 0.08 -1.57 -0.07 0.00 0.82 0.00 0.00 66.70 65.97 2ajj h VAL 24 Cb 0.14 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 2ajj h VAL 24 CO -0.01 0.50 -0.19 0.25 0.02 0.00 0.00 177.57 178.14 2ajj h LEU 25 N 0.54 0.29 0.08 2.57 5.85 -0.50 -3.20 115.31 120.93 2ajj h LEU 25 Ca 0.05 -0.08 -0.20 0.00 0.84 0.00 0.00 57.88 58.49 2ajj h LEU 25 Cb 0.92 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.87 2ajj h LEU 25 CO 0.08 0.50 -0.99 1.23 -0.34 0.00 0.00 178.44 178.92 2ajj h GLY 26 N 0.90 0.18 -5.49 3.75 0.00 -0.59 -3.47 103.07 98.34 2ajj h GLY 26 Ca 0.05 -0.46 -0.44 0.00 0.00 0.00 0.00 47.33 46.48 2ajj h GLY 26 CO 0.03 0.41 -0.79 -0.98 0.00 0.00 0.00 176.54 175.21 2ajj s TRP 27 N -2.40 1.02 0.00 5.60 0.51 0.05 -5.10 118.94 118.62 2ajj s TRP 27 Ca -0.20 -0.25 0.00 0.00 -2.12 0.00 0.00 56.10 53.52 2ajj s TRP 27 Cb 0.03 -0.72 0.00 0.00 -0.81 0.00 0.00 33.47 31.97 2ajj s TRP 27 CO 0.73 -0.10 0.00 0.00 -0.51 0.00 0.00 176.95 177.07