#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 -0.27 6.41 5.00 0.00 -1.26 -5.10 105.19 109.96 2ajj n GLY 2 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 2ajj n GLY 2 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ajj n ASN 3 N -2.02 -6.14 0.12 1.61 4.13 -1.26 -4.93 115.26 106.77 2ajj n ASN 3 Ca 0.00 0.16 0.00 0.00 1.68 0.00 0.00 54.58 56.42 2ajj n ASN 3 Cb 0.00 -0.46 0.00 0.00 -1.54 0.00 0.00 39.78 37.78 2ajj n ASN 3 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ajj n TYR 4 N -2.19 -3.42 -0.11 3.10 9.36 -1.26 -4.94 117.16 117.70 2ajj n TYR 4 Ca 0.00 0.80 -0.03 0.00 3.32 0.00 0.00 57.90 61.99 2ajj n TYR 4 Cb 0.07 2.20 0.20 0.00 -0.63 0.00 0.00 39.34 41.18 2ajj n TYR 4 CO 0.00 0.00 0.00 -0.24 0.22 0.00 0.00 176.86 176.84 2ajj h VAL 5 N 0.00 1.22 -0.68 2.97 3.04 -1.98 -1.62 116.25 119.20 2ajj h VAL 5 Ca 0.00 -0.81 0.00 0.00 -1.01 0.00 0.00 66.70 64.88 2ajj h VAL 5 Cb 0.00 0.71 -0.03 0.00 -2.01 0.00 0.00 31.29 29.96 2ajj h VAL 5 CO 0.00 0.30 0.44 -0.07 -1.01 0.00 0.00 177.57 177.23 2ajj h LEU 6 N 0.76 0.80 -1.06 3.16 -0.00 -1.95 0.31 115.31 117.33 2ajj h LEU 6 Ca 0.17 -0.04 -0.09 0.00 -0.00 0.00 0.00 57.88 57.92 2ajj h LEU 6 Cb 0.30 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 40.75 2ajj h LEU 6 CO 0.00 0.60 -0.35 0.44 -0.00 0.00 0.00 178.44 179.13 2ajj h ASP 7 N 0.93 0.22 0.80 -0.43 3.32 -1.83 -2.90 116.42 116.53 2ajj h ASP 7 Ca 0.25 -0.08 -0.19 0.00 0.02 0.00 0.00 57.03 57.03 2ajj h ASP 7 Cb -0.07 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2ajj h ASP 7 CO -0.05 0.57 -0.89 -0.07 -1.72 0.00 0.00 179.24 177.08 2ajj h LEU 8 N 0.19 0.07 -1.96 1.55 4.07 -0.31 -3.18 115.31 115.74 2ajj h LEU 8 Ca 0.02 -0.06 0.20 0.00 0.08 0.00 0.00 57.88 58.12 2ajj h LEU 8 Cb 0.71 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 42.40 2ajj h LEU 8 CO 0.05 0.92 0.57 0.40 -1.08 0.00 0.00 178.44 179.30 2ajj h ILE 9 N 0.03 0.50 -0.97 1.22 1.08 -0.20 0.19 117.51 119.36 2ajj h ILE 9 Ca -0.02 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.61 2ajj h ILE 9 Cb 1.55 0.59 -0.09 0.00 -3.07 0.00 0.00 36.82 35.80 2ajj h ILE 9 CO 0.12 0.00 0.61 0.10 -0.69 0.00 0.00 178.15 178.29 2ajj h TYR 10 N 0.00 0.96 -0.07 1.37 -0.00 -1.66 0.73 116.97 118.31 2ajj h TYR 10 Ca 0.33 0.03 -0.18 0.00 -0.00 0.00 0.00 58.73 58.91 2ajj h TYR 10 Cb 1.46 -0.30 0.01 0.00 -0.00 0.00 0.00 36.73 37.91 2ajj h TYR 10 CO 0.00 0.29 -0.66 1.03 -0.00 0.00 0.00 178.16 178.82 2ajj h SER 11 N 0.76 0.70 -0.86 0.10 0.87 -0.84 0.36 113.55 114.62 2ajj h SER 11 Ca 0.52 -0.69 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 2ajj h SER 11 Cb 0.81 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.51 2ajj h SER 11 CO -0.29 1.28 0.55 -0.07 -0.53 0.00 0.00 176.83 177.77 2ajj h LEU 12 N 0.17 1.01 -0.32 2.23 3.38 -0.93 -2.29 115.31 118.56 2ajj h LEU 12 Ca -0.06 -0.04 -0.20 0.00 0.09 0.00 0.00 57.88 57.67 2ajj h LEU 12 Cb 1.32 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2ajj h LEU 12 CO 0.13 0.75 -0.73 -0.74 0.09 0.00 0.00 178.44 177.95 2ajj h HIS 13 N 1.18 0.77 -0.62 1.13 2.76 0.39 -2.78 115.15 117.98 2ajj h HIS 13 Ca 0.31 -0.33 0.09 0.00 -2.20 0.00 0.00 60.37 58.25 2ajj h HIS 13 Cb -0.10 -0.12 -0.04 0.00 1.55 0.00 0.00 27.41 28.70 2ajj h HIS 13 CO -0.01 1.12 0.41 -0.22 -1.30 0.00 0.00 177.93 177.93 2ajj h LYS 14 N 0.39 0.44 -0.01 5.26 3.11 -0.38 0.75 116.57 126.13 2ajj h LYS 14 Ca -0.04 -0.03 -0.24 0.00 -2.81 0.00 0.00 60.65 57.54 2ajj h LYS 14 Cb 1.33 -0.10 0.02 0.00 -1.00 0.00 0.00 32.23 32.48 2ajj h LYS 14 CO 0.14 0.29 -0.92 1.96 -2.81 0.00 0.00 179.45 178.11 2ajj h GLN 15 N 0.45 0.64 -0.37 1.90 4.20 -1.34 -2.57 115.11 118.01 2ajj h GLN 15 Ca 0.28 -0.67 -0.12 0.00 0.06 0.00 0.00 58.65 58.20 2ajj h GLN 15 Cb 0.51 0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2ajj h GLN 15 CO -0.08 1.27 -0.24 0.82 -0.67 0.00 0.00 178.83 179.93 2ajj h ILE 16 N 0.27 1.27 -0.57 2.54 2.04 -0.93 -3.02 117.51 119.12 2ajj h ILE 16 Ca -0.11 -1.35 -0.05 0.00 1.00 0.00 0.00 64.86 64.35 2ajj h ILE 16 Cb 1.59 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.88 2ajj h ILE 16 CO 0.18 0.45 0.14 -1.13 0.00 0.00 0.00 178.15 177.79 2ajj h ASN 17 N 0.65 0.85 -0.15 1.72 -0.73 0.43 0.25 115.58 118.60 2ajj h ASN 17 Ca 0.09 -0.23 0.04 0.00 1.87 0.00 0.00 56.30 58.07 2ajj h ASN 17 Cb 0.74 -0.22 -0.04 0.00 0.27 0.00 0.00 38.32 39.06 2ajj h ASN 17 CO 0.06 0.86 -0.11 0.03 -0.37 0.00 0.00 177.43 177.90 2ajj h ARG 18 N 0.81 -0.11 -0.25 6.67 2.47 -1.33 0.25 114.38 122.88 2ajj h ARG 18 Ca 0.18 0.01 -0.12 0.00 -1.26 0.00 0.00 59.98 58.78 2ajj h ARG 18 Cb 0.33 0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.68 2ajj h ARG 18 CO 0.00 -0.08 -0.33 0.78 0.56 0.00 0.00 179.97 180.91 2ajj h GLY 19 N -0.12 0.73 0.42 0.04 0.00 -1.47 -2.80 103.07 99.87 2ajj h GLY 19 Ca 0.09 -0.79 0.10 0.00 0.00 0.00 0.00 47.33 46.74 2ajj h GLY 19 CO -0.22 0.71 0.38 -2.00 0.00 0.00 0.00 176.54 175.40 2ajj h LEU 20 N 0.39 0.49 -0.17 3.11 5.85 -0.04 -1.69 115.31 123.25 2ajj h LEU 20 Ca 0.03 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2ajj h LEU 20 Cb 0.91 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 2ajj h LEU 20 CO 0.08 0.26 0.06 0.11 -0.34 0.00 0.00 178.44 178.61 2ajj h LYS 21 N 0.62 0.25 -0.57 1.25 1.57 -0.45 -2.72 116.57 116.52 2ajj h LYS 21 Ca 0.38 -0.05 0.09 0.00 -1.87 0.00 0.00 60.65 59.20 2ajj h LYS 21 Cb 0.43 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 2ajj h LYS 21 CO -0.29 0.34 0.38 -0.22 -0.57 0.00 0.00 179.45 179.09 2ajj h LYS 22 N 0.11 0.39 -0.47 3.15 3.11 -1.10 0.80 116.57 122.56 2ajj h LYS 22 Ca 0.05 -0.02 -0.07 0.00 -2.81 0.00 0.00 60.65 57.80 2ajj h LYS 22 Cb 0.19 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.31 2ajj h LYS 22 CO -0.00 0.26 0.02 0.82 -2.81 0.00 0.00 179.45 177.73 2ajj h ILE 23 N 0.40 1.26 0.00 2.00 1.08 -1.02 0.34 117.51 121.57 2ajj h ILE 23 Ca 0.26 -1.03 -0.23 0.00 -0.39 0.00 0.00 64.86 63.47 2ajj h ILE 23 Cb 0.49 1.00 -0.04 0.00 -3.07 0.00 0.00 36.82 35.20 2ajj h ILE 23 CO -0.07 0.36 -1.25 0.58 -0.69 0.00 0.00 178.15 177.08 2ajj h VAL 24 N 0.68 1.24 -0.00 1.67 2.07 -1.19 -2.02 116.25 118.69 2ajj h VAL 24 Ca 0.14 -2.96 -0.26 0.00 0.82 0.00 0.00 66.70 64.43 2ajj h VAL 24 Cb 0.48 2.60 0.02 0.00 -1.52 0.00 0.00 31.29 32.87 2ajj h VAL 24 CO 0.02 0.71 -1.02 0.25 0.02 0.00 0.00 177.57 177.55 2ajj h LEU 25 N 0.00 0.83 0.00 2.57 5.85 0.67 -3.36 115.31 121.87 2ajj h LEU 25 Ca -0.12 -0.66 -0.04 0.00 0.84 0.00 0.00 57.88 57.89 2ajj h LEU 25 Cb 1.82 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 2ajj h LEU 25 CO 0.10 1.46 -0.25 1.23 -0.34 0.00 0.00 178.44 180.64 2ajj h GLY 26 N 0.60 0.00 -5.72 3.75 0.00 -0.44 -3.46 103.07 97.80 2ajj h GLY 26 Ca -0.12 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.56 2ajj h GLY 26 CO 0.19 0.00 -0.53 -0.98 0.00 0.00 0.00 176.54 175.23 2ajj s TRP 27 N -2.14 3.42 0.00 5.60 0.51 -0.76 -5.07 118.94 120.49 2ajj s TRP 27 Ca -0.18 0.35 0.00 0.00 -2.12 0.00 0.00 56.10 54.15 2ajj s TRP 27 Cb -0.01 -1.96 0.00 0.00 -0.81 0.00 0.00 33.47 30.70 2ajj s TRP 27 CO 0.54 0.52 0.06 0.00 -0.51 0.00 0.00 176.95 177.57