#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 -0.66 7.00 0.23 0.00 -1.26 -4.83 105.19 105.67 2ajj n GLY 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.31 -1.27 -0.02 1.61 5.15 -1.26 -4.02 115.26 114.14 2ajj n ASN 3 Ca 0.00 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 53.96 2ajj n ASN 3 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 2ajj n ASN 3 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ajj n TYR 4 N 0.00 0.00 -0.06 1.20 4.11 -1.26 -4.63 117.16 116.52 2ajj n TYR 4 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.90 57.84 2ajj n TYR 4 Cb 0.00 -0.13 0.13 0.00 -0.00 0.00 0.00 39.34 39.34 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 1.27 -0.91 -3.48 3.04 -1.98 -2.07 116.25 112.11 2ajj h VAL 5 Ca -0.07 -1.29 0.01 0.00 -1.01 0.00 0.00 66.70 64.34 2ajj h VAL 5 Cb 1.14 1.22 -0.05 0.00 -2.01 0.00 0.00 31.29 31.60 2ajj h VAL 5 CO -0.00 0.43 0.60 0.25 -1.01 0.00 0.00 177.57 177.83 2ajj h LEU 6 N 0.61 1.03 -0.45 3.16 7.12 -1.84 0.53 115.31 125.46 2ajj h LEU 6 Ca 0.09 -0.02 -0.12 0.00 0.13 0.00 0.00 57.88 57.95 2ajj h LEU 6 Cb 0.69 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.55 2ajj h LEU 6 CO 0.05 0.74 -0.20 -0.78 -0.13 0.00 0.00 178.44 178.12 2ajj h ASP 7 N 1.22 0.96 0.22 1.25 1.82 -1.70 -2.86 116.42 117.32 2ajj h ASP 7 Ca 0.34 -0.40 -0.05 0.00 -0.39 0.00 0.00 57.03 56.54 2ajj h ASP 7 Cb -0.11 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 39.63 2ajj h ASP 7 CO -0.08 1.14 -0.22 -0.07 -1.61 0.00 0.00 179.24 178.40 2ajj h LEU 8 N 0.77 0.00 -1.98 2.28 4.07 -0.62 -2.37 115.31 117.47 2ajj h LEU 8 Ca 0.10 0.00 0.24 0.00 0.08 0.00 0.00 57.88 58.30 2ajj h LEU 8 Cb 0.77 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.48 2ajj h LEU 8 CO 0.06 0.22 0.61 0.40 -1.08 0.00 0.00 178.44 178.65 2ajj h ILE 9 N 0.00 0.53 -0.47 1.22 2.04 -0.68 0.75 117.51 120.89 2ajj h ILE 9 Ca -0.00 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.93 2ajj h ILE 9 Cb 0.39 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 2ajj h ILE 9 CO 0.03 0.00 0.14 0.10 0.00 0.00 0.00 178.15 178.42 2ajj h TYR 10 N 0.00 0.24 -0.51 1.37 -0.00 -1.55 0.59 116.97 117.10 2ajj h TYR 10 Ca 0.39 0.03 -0.11 0.00 0.00 0.00 0.00 58.73 59.03 2ajj h TYR 10 Cb 1.60 -0.04 -0.02 0.00 0.00 0.00 0.00 36.73 38.28 2ajj h TYR 10 CO 0.00 0.06 -0.13 1.03 -0.00 0.00 0.00 178.16 179.12 2ajj h SER 11 N 0.29 1.00 -0.84 0.10 0.87 -1.05 -0.52 113.55 113.41 2ajj h SER 11 Ca 0.23 -0.36 -0.01 0.00 -1.23 0.00 0.00 61.79 60.42 2ajj h SER 11 Cb 0.27 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 61.91 2ajj h SER 11 CO -0.26 1.13 0.48 0.25 -0.53 0.00 0.00 176.83 177.90 2ajj h LEU 12 N 0.86 1.03 -0.63 2.23 5.85 -0.98 -2.33 115.31 121.34 2ajj h LEU 12 Ca 0.13 -0.09 -0.15 0.00 0.84 0.00 0.00 57.88 58.62 2ajj h LEU 12 Cb 0.69 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2ajj h LEU 12 CO 0.05 0.82 -0.54 -0.74 -0.34 0.00 0.00 178.44 177.69 2ajj h HIS 13 N 1.16 0.50 -0.31 1.25 2.76 0.41 -2.87 115.15 118.06 2ajj h HIS 13 Ca 0.30 -0.17 0.02 0.00 -2.20 0.00 0.00 60.37 58.31 2ajj h HIS 13 Cb 0.00 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 28.85 2ajj h HIS 13 CO 0.00 0.85 0.20 0.87 -1.30 0.00 0.00 177.93 178.56 2ajj h LYS 14 N 0.31 0.32 0.00 5.26 6.56 -0.55 0.73 116.57 129.20 2ajj h LYS 14 Ca 0.01 -0.02 -0.08 0.00 -1.06 0.00 0.00 60.65 59.50 2ajj h LYS 14 Cb 1.05 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 32.63 2ajj h LYS 14 CO 0.09 0.21 -0.38 0.37 -2.06 0.00 0.00 179.45 177.69 2ajj h GLN 15 N 0.33 0.00 0.09 3.15 4.15 -1.26 -1.42 115.11 120.16 2ajj h GLN 15 Ca 0.12 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.22 2ajj h GLN 15 Cb 0.08 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 2ajj h GLN 15 CO -0.03 0.38 -1.75 0.82 -1.93 0.00 0.00 178.83 176.32 2ajj h ILE 16 N 0.00 0.87 -0.56 2.39 2.04 -0.78 -3.36 117.51 118.11 2ajj h ILE 16 Ca -0.00 -2.60 -0.09 0.00 1.00 0.00 0.00 64.86 63.17 2ajj h ILE 16 Cb 0.77 2.58 -0.02 0.00 -0.74 0.00 0.00 36.82 39.40 2ajj h ILE 16 CO 0.05 0.76 -0.01 0.78 0.00 0.00 0.00 178.15 179.72 2ajj h ASN 17 N 0.05 0.94 -0.77 1.72 4.21 0.50 0.88 115.58 123.12 2ajj h ASN 17 Ca -0.32 -0.26 0.08 0.00 1.21 0.00 0.00 56.30 57.01 2ajj h ASN 17 Cb 2.02 -0.25 -0.05 0.00 -1.12 0.00 0.00 38.32 38.92 2ajj h ASN 17 CO 0.11 1.01 0.50 0.08 -1.29 0.00 0.00 177.43 177.85 2ajj h ARG 18 N 0.89 0.72 0.18 0.81 0.11 -1.41 0.33 114.38 116.00 2ajj h ARG 18 Ca 0.16 -0.04 -0.34 0.00 0.10 0.00 0.00 59.98 59.86 2ajj h ARG 18 Cb 0.54 -0.16 0.01 0.00 1.11 0.00 0.00 29.97 31.47 2ajj h ARG 18 CO 0.03 0.47 -1.69 0.78 0.10 0.00 0.00 179.97 179.66 2ajj h GLY 19 N 0.74 0.43 0.89 0.08 0.00 -1.66 -3.29 103.07 100.25 2ajj h GLY 19 Ca 0.35 -1.10 0.04 0.00 0.00 0.00 0.00 47.33 46.63 2ajj h GLY 19 CO -0.13 0.96 0.63 -2.00 0.00 0.00 0.00 176.54 176.00 2ajj h LEU 20 N 0.04 1.03 -0.30 3.11 5.85 -0.27 -2.21 115.31 122.56 2ajj h LEU 20 Ca -0.34 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.38 2ajj h LEU 20 Cb 2.04 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.83 2ajj h LEU 20 CO 0.16 0.69 0.20 0.11 -0.34 0.00 0.00 178.44 179.26 2ajj h LYS 21 N 1.18 0.39 -0.43 1.25 1.57 -0.48 -1.94 116.57 118.11 2ajj h LYS 21 Ca 0.39 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2ajj h LYS 21 Cb 0.06 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 2ajj h LYS 21 CO -0.13 0.26 0.28 -0.22 -0.57 0.00 0.00 179.45 179.07 2ajj h LYS 22 N 0.40 0.57 -0.30 3.15 3.11 -1.48 0.39 116.57 122.40 2ajj h LYS 22 Ca 0.11 -0.04 -0.07 0.00 -2.81 0.00 0.00 60.65 57.85 2ajj h LYS 22 Cb -0.04 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.06 2ajj h LYS 22 CO -0.03 0.38 -0.09 0.82 -2.81 0.00 0.00 179.45 177.72 2ajj h ILE 23 N 0.59 1.28 -0.18 2.00 1.08 -0.90 0.47 117.51 121.85 2ajj h ILE 23 Ca 0.16 -1.14 -0.17 0.00 -0.39 0.00 0.00 64.86 63.32 2ajj h ILE 23 Cb -0.06 1.41 -0.01 0.00 -3.07 0.00 0.00 36.82 35.10 2ajj h ILE 23 CO -0.03 0.37 -0.57 0.58 -0.69 0.00 0.00 178.15 177.80 2ajj h VAL 24 N 0.35 1.32 -0.32 1.67 2.07 -0.82 -2.53 116.25 117.98 2ajj h VAL 24 Ca 0.07 -1.82 -0.16 0.00 0.82 0.00 0.00 66.70 65.61 2ajj h VAL 24 Cb 0.58 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 2ajj h VAL 24 CO 0.03 0.57 -0.44 0.25 0.02 0.00 0.00 177.57 178.00 2ajj h LEU 25 N 0.43 0.90 0.00 2.57 5.85 -0.11 -3.44 115.31 121.50 2ajj h LEU 25 Ca 0.00 -0.43 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2ajj h LEU 25 Cb 1.12 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.89 2ajj h LEU 25 CO 0.11 1.20 0.00 0.61 -0.34 0.00 0.00 178.44 180.02 2ajj n GLY 26 N 0.17 -1.44 3.97 3.75 0.00 0.16 -5.06 105.19 106.74 2ajj n GLY 26 Ca -0.03 0.98 -0.21 0.00 0.00 0.00 0.00 46.02 46.76 2ajj n GLY 26 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2ajj s TRP 27 N 0.00 3.44 0.00 1.61 1.48 -0.96 -4.56 118.94 119.95 2ajj s TRP 27 Ca 0.00 -0.01 0.00 0.00 -1.06 0.00 0.00 56.10 55.03 2ajj s TRP 27 Cb 0.00 -1.57 0.00 0.00 -1.16 0.00 0.00 33.47 30.74 2ajj s TRP 27 CO 0.00 0.45 0.00 0.00 -4.06 0.00 0.00 176.95 173.34