#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ajj s GLY 2 N 0.00 2.67 -0.06 0.23 0.00 -1.26 -4.76 107.32 104.14 2ajj s GLY 2 Ca 0.00 -3.38 -0.07 0.00 0.00 0.00 0.00 44.72 41.27 2ajj s GLY 2 CO 0.00 1.51 -0.15 0.70 0.00 0.00 0.00 173.10 175.16 2ajj n ASN 3 N 4.26 1.20 -0.97 1.64 3.02 -1.26 -4.99 115.26 118.16 2ajj n ASN 3 Ca 0.21 0.19 -0.13 0.00 -0.03 0.00 0.00 54.58 54.82 2ajj n ASN 3 Cb 0.45 -0.44 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 2ajj n ASN 3 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ajj n TYR 4 N -3.74 0.00 -0.09 3.10 9.36 -1.26 -4.79 117.16 119.73 2ajj n TYR 4 Ca -0.13 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 60.97 2ajj n TYR 4 Cb 0.40 -2.86 -0.09 0.00 -0.63 0.00 0.00 39.34 36.16 2ajj n TYR 4 CO 0.00 0.00 0.00 1.33 0.22 0.00 0.00 176.86 178.41 2ajj n VAL 5 N -2.26 1.03 -0.33 2.97 0.24 -1.26 -3.90 118.33 114.82 2ajj n VAL 5 Ca -0.13 -0.42 -0.04 0.00 -2.04 0.00 0.00 64.34 61.71 2ajj n VAL 5 Cb 0.60 -1.08 0.09 0.00 -1.47 0.00 0.00 33.84 31.97 2ajj n VAL 5 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 2ajj h LEU 6 N 0.00 1.13 -1.14 1.34 6.46 -2.00 0.38 115.31 121.48 2ajj h LEU 6 Ca -0.40 -0.11 -0.08 0.00 -0.12 0.00 0.00 57.88 57.17 2ajj h LEU 6 Cb 1.65 -0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 41.28 2ajj h LEU 6 CO -0.05 0.91 -0.29 0.44 -0.62 0.00 0.00 178.44 178.83 2ajj h ASP 7 N 1.26 0.24 0.90 1.25 3.32 -1.97 -2.79 116.42 118.63 2ajj h ASP 7 Ca 0.31 -0.08 -0.20 0.00 0.02 0.00 0.00 57.03 57.08 2ajj h ASP 7 Cb 0.04 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 2ajj h ASP 7 CO -0.05 0.53 -0.96 -0.07 -1.72 0.00 0.00 179.24 176.97 2ajj h LEU 8 N 0.21 0.04 -1.97 1.55 4.07 -1.33 -3.23 115.31 114.66 2ajj h LEU 8 Ca 0.03 -0.04 0.27 0.00 0.08 0.00 0.00 57.88 58.22 2ajj h LEU 8 Cb 0.63 -0.01 -0.04 0.00 1.08 0.00 0.00 40.66 42.32 2ajj h LEU 8 CO 0.05 0.98 0.71 0.40 -1.08 0.00 0.00 178.44 179.49 2ajj h ILE 9 N 0.01 0.47 -0.98 1.22 1.08 -0.00 0.21 117.51 119.51 2ajj h ILE 9 Ca -0.02 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.57 2ajj h ILE 9 Cb 1.68 0.50 -0.08 0.00 -3.07 0.00 0.00 36.82 35.85 2ajj h ILE 9 CO 0.13 0.00 0.62 0.10 -0.69 0.00 0.00 178.15 178.31 2ajj h TYR 10 N 0.00 1.10 -0.05 1.37 -0.00 -1.66 0.54 116.97 118.27 2ajj h TYR 10 Ca 0.45 0.03 -0.23 0.00 -0.00 0.00 0.00 58.73 58.98 2ajj h TYR 10 Cb 1.86 -0.35 0.01 0.00 -0.00 0.00 0.00 36.73 38.25 2ajj h TYR 10 CO 0.00 0.44 -0.91 1.03 -0.00 0.00 0.00 178.16 178.72 2ajj h SER 11 N 0.96 0.76 0.09 0.10 0.87 -0.81 -2.33 113.55 113.18 2ajj h SER 11 Ca 0.49 -0.56 -0.08 0.00 -1.23 0.00 0.00 61.79 60.40 2ajj h SER 11 Cb 0.51 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 2ajj h SER 11 CO -0.25 1.35 -0.27 0.25 -0.53 0.00 0.00 176.83 177.39 2ajj h LEU 12 N 0.37 0.29 -0.15 2.23 7.12 -1.02 -2.52 115.31 121.62 2ajj h LEU 12 Ca -0.08 -0.09 -0.04 0.00 0.13 0.00 0.00 57.88 57.80 2ajj h LEU 12 Cb 1.54 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 41.59 2ajj h LEU 12 CO 0.17 0.56 -0.18 -0.74 -0.13 0.00 0.00 178.44 178.13 2ajj h HIS 13 N 0.26 0.00 -0.46 1.25 2.76 0.08 -3.26 115.15 115.77 2ajj h HIS 13 Ca 0.04 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.18 2ajj h HIS 13 Cb 0.62 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.55 2ajj h HIS 13 CO 0.01 0.18 0.16 -0.22 -1.30 0.00 0.00 177.93 176.76 2ajj h LYS 14 N 0.00 0.66 0.00 5.26 3.11 -0.95 -1.22 116.57 123.43 2ajj h LYS 14 Ca -0.00 -0.10 -0.01 0.00 -2.81 0.00 0.00 60.65 57.73 2ajj h LYS 14 Cb 1.08 -0.12 -0.00 0.00 -1.00 0.00 0.00 32.23 32.19 2ajj h LYS 14 CO 0.02 0.56 -0.06 -0.56 -2.81 0.00 0.00 179.45 176.61 2ajj h GLN 15 N 0.65 0.00 0.07 1.90 3.07 -1.63 -0.55 115.11 118.63 2ajj h GLN 15 Ca 0.16 0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.56 2ajj h GLN 15 Cb 0.17 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.70 2ajj h GLN 15 CO -0.01 0.06 -1.86 -0.89 0.09 0.00 0.00 178.83 176.21 2ajj n ILE 16 N -3.35 1.72 -0.09 1.86 5.41 -0.62 -3.88 119.36 120.40 2ajj n ILE 16 Ca -0.01 -0.72 -0.12 0.00 1.00 0.00 0.00 62.75 62.90 2ajj n ILE 16 Cb 0.22 -1.45 -0.04 0.00 -0.71 0.00 0.00 39.64 37.66 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 0.04 0.53 -0.87 4.38 -1.24 -0.84 0.14 115.58 117.73 2ajj h ASN 17 Ca -0.36 -0.38 0.09 0.00 0.71 0.00 0.00 56.30 56.37 2ajj h ASN 17 Cb 2.03 -0.15 -0.06 0.00 0.73 0.00 0.00 38.32 40.87 2ajj h ASN 17 CO 0.09 0.78 0.56 0.08 -1.29 0.00 0.00 177.43 177.66 2ajj h ARG 18 N 0.27 0.84 0.24 6.67 0.11 -1.28 0.44 114.38 121.67 2ajj h ARG 18 Ca 0.07 -0.05 -0.32 0.00 0.10 0.00 0.00 59.98 59.77 2ajj h ARG 18 Cb 0.56 -0.19 0.04 0.00 1.11 0.00 0.00 29.97 31.49 2ajj h ARG 18 CO 0.03 0.55 -1.42 0.78 0.10 0.00 0.00 179.97 180.01 2ajj h GLY 19 N 0.86 0.59 1.22 0.08 0.00 -1.64 -3.12 103.07 101.06 2ajj h GLY 19 Ca 0.40 -1.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.21 2ajj h GLY 19 CO -0.16 1.32 0.43 -2.00 0.00 0.00 0.00 176.54 176.12 2ajj h LEU 20 N 0.09 0.92 -0.61 3.11 5.85 0.06 -2.33 115.31 122.39 2ajj h LEU 20 Ca -0.25 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.35 2ajj h LEU 20 Cb 2.11 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.89 2ajj h LEU 20 CO 0.26 0.73 0.15 0.50 -0.34 0.00 0.00 178.44 179.74 2ajj h LYS 21 N 1.04 0.97 0.00 1.25 3.64 -0.22 -2.42 116.57 120.84 2ajj h LYS 21 Ca 0.27 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2ajj h LYS 21 Cb -0.00 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2ajj h LYS 21 CO -0.05 0.89 -0.20 1.57 -2.27 0.00 0.00 179.45 179.39 2ajj h LYS 22 N 0.89 0.00 -0.07 1.90 5.09 -1.39 0.14 116.57 123.12 2ajj h LYS 22 Ca 0.19 0.00 -0.16 0.00 0.09 0.00 0.00 60.65 60.77 2ajj h LYS 22 Cb 0.35 0.00 0.01 0.00 0.10 0.00 0.00 32.23 32.69 2ajj h LYS 22 CO 0.00 0.20 -0.58 0.82 -2.09 0.00 0.00 179.45 177.80 2ajj h ILE 23 N 0.00 1.37 0.00 0.07 1.08 -1.01 -2.60 117.51 116.43 2ajj h ILE 23 Ca -0.00 -1.94 -0.17 0.00 -0.39 0.00 0.00 64.86 62.36 2ajj h ILE 23 Cb 0.63 2.32 -0.02 0.00 -3.07 0.00 0.00 36.82 36.67 2ajj h ILE 23 CO 0.03 0.58 -0.81 0.58 -0.69 0.00 0.00 178.15 177.84 2ajj h VAL 24 N 0.09 1.56 -0.63 1.67 2.07 -1.29 -3.15 116.25 116.57 2ajj h VAL 24 Ca -0.05 -2.80 -0.06 0.00 0.82 0.00 0.00 66.70 64.60 2ajj h VAL 24 Cb 1.25 2.52 -0.03 0.00 -1.52 0.00 0.00 31.29 33.51 2ajj h VAL 24 CO 0.12 0.79 0.15 0.25 0.02 0.00 0.00 177.57 178.90 2ajj h LEU 25 N 0.00 0.95 -0.16 2.57 5.85 -0.73 -3.11 115.31 120.68 2ajj h LEU 25 Ca -0.01 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 2ajj h LEU 25 Cb 1.46 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 2ajj h LEU 25 CO 0.11 0.94 0.01 1.23 -0.34 0.00 0.00 178.44 180.39 2ajj h GLY 26 N 0.92 0.30 -7.14 3.75 0.00 -1.48 -3.39 103.07 96.03 2ajj h GLY 26 Ca 0.20 -0.22 -0.58 0.00 0.00 0.00 0.00 47.33 46.73 2ajj h GLY 26 CO 0.00 0.20 0.80 -0.98 0.00 0.00 0.00 176.54 176.57 2ajj s TRP 27 N -5.03 2.60 0.00 5.60 0.51 -1.17 -5.14 118.94 116.31 2ajj s TRP 27 Ca -0.14 0.03 0.00 0.00 -2.12 0.00 0.00 56.10 53.87 2ajj s TRP 27 Cb 0.06 -4.37 0.00 0.00 -0.81 0.00 0.00 33.47 28.35 2ajj s TRP 27 CO 0.72 -1.64 0.00 0.00 -0.51 0.00 0.00 176.95 175.52