#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 4.57 0.08 0.46 0.00 -1.26 -5.01 105.19 104.03 2ajj n GLY 2 Ca 0.00 -1.73 -0.06 0.00 0.00 0.00 0.00 46.02 44.23 2ajj n GLY 2 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2ajj h ASN 3 N 0.00 0.00 0.43 1.61 -1.24 -2.05 -3.23 115.58 111.10 2ajj h ASN 3 Ca 0.00 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.99 2ajj h ASN 3 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2ajj h ASN 3 CO 0.00 0.92 -0.21 0.22 -1.29 0.00 0.00 177.43 177.07 2ajj h TYR 4 N 0.00 -0.54 -0.71 0.67 3.20 -1.99 -1.96 116.97 115.63 2ajj h TYR 4 Ca -0.12 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.70 2ajj h TYR 4 Cb 1.81 0.18 -0.03 0.00 1.54 0.00 0.00 36.73 40.22 2ajj h TYR 4 CO 0.00 -0.24 0.29 -0.39 -1.64 0.00 0.00 178.16 176.18 2ajj h VAL 5 N -0.79 1.25 -0.98 1.81 -1.51 -1.97 -1.68 116.25 112.38 2ajj h VAL 5 Ca -0.06 -0.76 0.06 0.00 -1.23 0.00 0.00 66.70 64.72 2ajj h VAL 5 Cb 0.54 0.41 -0.06 0.00 -2.13 0.00 0.00 31.29 30.05 2ajj h VAL 5 CO 0.10 0.31 0.63 -0.07 -1.23 0.00 0.00 177.57 177.31 2ajj h LEU 6 N 1.01 1.01 -0.61 4.19 4.07 -1.56 0.19 115.31 123.61 2ajj h LEU 6 Ca 0.24 0.01 -0.10 0.00 0.08 0.00 0.00 57.88 58.11 2ajj h LEU 6 Cb 0.20 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.71 2ajj h LEU 6 CO -0.02 0.64 -0.02 -0.78 -1.08 0.00 0.00 178.44 177.18 2ajj h ASP 7 N 1.14 1.06 0.35 -0.43 3.58 -0.85 -2.77 116.42 118.49 2ajj h ASP 7 Ca 0.42 -0.31 -0.09 0.00 0.42 0.00 0.00 57.03 57.47 2ajj h ASP 7 Cb 0.17 -0.29 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 2ajj h ASP 7 CO -0.16 1.12 -0.39 -0.07 -2.88 0.00 0.00 179.24 176.85 2ajj h LEU 8 N 0.98 0.06 -1.94 2.28 4.07 -0.18 -2.79 115.31 117.79 2ajj h LEU 8 Ca 0.17 -0.02 0.22 0.00 0.08 0.00 0.00 57.88 58.33 2ajj h LEU 8 Cb 0.58 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 42.28 2ajj h LEU 8 CO 0.03 0.45 0.62 0.40 -1.08 0.00 0.00 178.44 178.86 2ajj h ILE 9 N 0.05 0.46 -0.92 1.22 1.08 -0.40 0.14 117.51 119.14 2ajj h ILE 9 Ca 0.00 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.57 2ajj h ILE 9 Cb 0.71 0.55 -0.07 0.00 -3.07 0.00 0.00 36.82 34.95 2ajj h ILE 9 CO 0.05 0.00 0.59 0.10 -0.69 0.00 0.00 178.15 178.21 2ajj h TYR 10 N 0.00 1.01 -0.10 1.37 -0.00 -1.61 0.48 116.97 118.12 2ajj h TYR 10 Ca 0.36 0.03 -0.22 0.00 -0.00 0.00 0.00 58.73 58.89 2ajj h TYR 10 Cb 1.59 -0.33 0.01 0.00 -0.00 0.00 0.00 36.73 38.01 2ajj h TYR 10 CO 0.00 0.46 -0.81 1.03 -0.00 0.00 0.00 178.16 178.84 2ajj h SER 11 N 0.93 0.88 -0.56 0.10 0.87 -0.93 -2.12 113.55 112.72 2ajj h SER 11 Ca 0.43 -0.67 -0.05 0.00 -1.23 0.00 0.00 61.79 60.27 2ajj h SER 11 Cb 0.40 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 2ajj h SER 11 CO -0.19 1.42 0.14 0.25 -0.53 0.00 0.00 176.83 177.92 2ajj h LEU 12 N 0.41 0.84 -1.14 2.23 7.12 -1.22 -2.65 115.31 120.91 2ajj h LEU 12 Ca -0.07 -0.23 -0.08 0.00 0.13 0.00 0.00 57.88 57.63 2ajj h LEU 12 Cb 1.46 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 41.35 2ajj h LEU 12 CO 0.16 0.85 -0.27 -0.74 -0.13 0.00 0.00 178.44 178.32 2ajj h HIS 13 N 0.79 0.29 -0.32 1.25 2.76 -0.10 -2.62 115.15 117.20 2ajj h HIS 13 Ca 0.18 -0.06 0.03 0.00 -2.20 0.00 0.00 60.37 58.32 2ajj h HIS 13 Cb 0.34 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.21 2ajj h HIS 13 CO 0.02 0.52 0.22 -0.22 -1.30 0.00 0.00 177.93 177.17 2ajj h LYS 14 N 0.24 0.32 0.00 5.26 1.63 -1.01 0.66 116.57 123.67 2ajj h LYS 14 Ca 0.04 -0.02 -0.13 0.00 -0.85 0.00 0.00 60.65 59.69 2ajj h LYS 14 Cb 0.61 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.14 2ajj h LYS 14 CO 0.04 0.21 -0.62 0.37 -3.45 0.00 0.00 179.45 176.01 2ajj h GLN 15 N 0.33 0.00 0.18 1.90 4.15 -1.43 -1.93 115.11 118.31 2ajj h GLN 15 Ca 0.13 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.22 2ajj h GLN 15 Cb 0.11 0.00 0.01 0.00 0.21 0.00 0.00 27.48 27.82 2ajj h GLN 15 CO -0.03 0.62 -1.60 0.82 -1.93 0.00 0.00 178.83 176.70 2ajj h ILE 16 N 0.00 1.11 -0.21 2.39 2.04 -0.95 -3.26 117.51 118.63 2ajj h ILE 16 Ca -0.01 -2.67 -0.15 0.00 1.00 0.00 0.00 64.86 63.03 2ajj h ILE 16 Cb 1.44 2.83 0.00 0.00 -0.74 0.00 0.00 36.82 40.36 2ajj h ILE 16 CO 0.08 0.84 -0.46 -1.13 0.00 0.00 0.00 178.15 177.48 2ajj h ASN 17 N 0.10 0.76 -0.31 1.72 -0.00 0.19 -1.79 115.58 116.26 2ajj h ASN 17 Ca -0.28 -0.56 0.00 0.00 -0.00 0.00 0.00 56.30 55.46 2ajj h ASN 17 Cb 2.09 -0.22 -0.02 0.00 -0.00 0.00 0.00 38.32 40.17 2ajj h ASN 17 CO 0.20 1.18 0.20 0.08 -0.00 0.00 0.00 177.43 179.09 2ajj h ARG 18 N 0.38 0.42 0.13 6.67 -0.00 -1.49 -2.06 114.38 118.43 2ajj h ARG 18 Ca 0.00 -0.03 -0.28 0.00 -0.00 0.00 0.00 59.98 59.67 2ajj h ARG 18 Cb 1.07 -0.09 0.00 0.00 -0.00 0.00 0.00 29.97 30.95 2ajj h ARG 18 CO 0.10 0.29 -1.30 0.78 -0.00 0.00 0.00 179.97 179.84 2ajj h GLY 19 N 0.45 0.32 0.76 0.08 0.00 -1.58 -3.09 103.07 100.02 2ajj h GLY 19 Ca 0.12 -0.82 0.00 0.00 0.00 0.00 0.00 47.33 46.63 2ajj h GLY 19 CO -0.02 0.72 -0.19 -2.00 0.00 0.00 0.00 176.54 175.04 2ajj h LEU 20 N 0.08 -0.52 -1.61 3.11 7.12 -0.65 -1.46 115.31 121.37 2ajj h LEU 20 Ca -0.16 0.05 -0.04 0.00 0.13 0.00 0.00 57.88 57.86 2ajj h LEU 20 Cb 1.99 0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 42.29 2ajj h LEU 20 CO 0.20 -0.29 -0.21 0.07 -0.13 0.00 0.00 178.44 178.08 2ajj h LYS 21 N -0.42 0.00 -0.28 1.25 5.09 -1.54 -2.44 116.57 118.23 2ajj h LYS 21 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 60.65 60.62 2ajj h LYS 21 Cb 0.40 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.71 2ajj h LYS 21 CO -0.05 0.21 -0.33 -0.22 -2.09 0.00 0.00 179.45 176.97 2ajj h LYS 22 N 0.00 0.59 -0.49 0.07 3.11 -1.31 0.28 116.57 118.82 2ajj h LYS 22 Ca -0.00 -0.27 -0.05 0.00 -2.81 0.00 0.00 60.65 57.52 2ajj h LYS 22 Cb 0.38 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.58 2ajj h LYS 22 CO 0.03 0.84 0.10 0.82 -2.81 0.00 0.00 179.45 178.43 2ajj h ILE 23 N 0.50 1.24 0.01 2.00 2.04 -0.79 -0.96 117.51 121.55 2ajj h ILE 23 Ca 0.06 -0.88 -0.20 0.00 1.00 0.00 0.00 64.86 64.84 2ajj h ILE 23 Cb 0.81 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 2ajj h ILE 23 CO 0.07 0.31 -0.93 0.58 0.00 0.00 0.00 178.15 178.18 2ajj h VAL 24 N 0.68 1.64 -0.33 1.67 2.07 -1.41 -1.68 116.25 118.90 2ajj h VAL 24 Ca 0.15 -3.12 -0.05 0.00 0.82 0.00 0.00 66.70 64.51 2ajj h VAL 24 Cb 0.36 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.81 2ajj h VAL 24 CO 0.00 0.89 0.02 0.25 0.02 0.00 0.00 177.57 178.76 2ajj h LEU 25 N 0.01 0.54 0.00 2.57 5.85 -0.21 -3.41 115.31 120.67 2ajj h LEU 25 Ca -0.02 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.41 2ajj h LEU 25 Cb 1.64 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.52 2ajj h LEU 25 CO 0.12 0.70 0.00 0.61 -0.34 0.00 0.00 178.44 179.53 2ajj n GLY 26 N -0.39 -0.40 3.59 3.75 0.00 -0.38 -5.07 105.19 106.28 2ajj n GLY 26 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.27 -0.23 -0.79 1.61 1.48 -0.63 -5.05 118.94 115.05 2ajj s TRP 27 Ca 0.00 0.07 0.06 0.00 -1.06 0.00 0.00 56.10 55.17 2ajj s TRP 27 Cb 0.00 0.56 0.05 0.00 -1.16 0.00 0.00 33.47 32.92 2ajj s TRP 27 CO 0.00 -0.56 0.70 0.00 -4.06 0.00 0.00 176.95 173.03