#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ag7 s SER 3 N -1.38 6.00 0.40 0.00 0.15 -0.96 -4.73 113.70 113.18 1ag7 s SER 3 Ca 0.45 0.34 0.01 0.00 0.70 0.00 0.00 55.95 57.45 1ag7 s SER 3 Cb -0.00 -1.70 -0.00 0.00 -1.71 0.00 0.00 66.02 62.60 1ag7 s SER 3 CO 0.67 -0.55 0.02 0.61 1.20 0.00 0.00 173.24 175.18 1ag7 n GLY 4 N -1.97 3.65 3.56 9.45 0.00 -1.26 -0.88 105.19 117.74 1ag7 n GLY 4 Ca -0.01 -2.30 -0.39 0.00 0.00 0.00 0.00 46.02 43.33 1ag7 n GLY 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ag7 s ARG 5 N -3.43 2.53 0.00 1.61 0.52 -1.26 -1.72 118.95 117.20 1ag7 s ARG 5 Ca 0.03 1.28 0.00 0.00 -0.52 0.00 0.00 55.73 56.52 1ag7 s ARG 5 Cb 0.00 -4.46 0.00 0.00 0.52 0.00 0.00 34.95 31.01 1ag7 s ARG 5 CO 0.02 -2.80 0.00 0.41 0.02 0.00 0.00 175.30 172.95 1ag7 n GLY 6 N 5.82 0.84 3.13 -3.53 0.00 -1.13 -5.03 105.19 105.29 1ag7 n GLY 6 Ca 0.30 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.10 1ag7 n GLY 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ag7 s SER 7 N -0.85 1.72 1.01 1.61 1.04 -0.70 -4.78 113.70 112.75 1ag7 s SER 7 Ca 0.00 -0.35 -0.02 0.00 0.48 0.00 0.00 55.95 56.06 1ag7 s SER 7 Cb 0.00 -0.16 0.03 0.00 0.10 0.00 0.00 66.02 65.99 1ag7 s SER 7 CO 0.00 0.12 0.14 -2.11 0.98 0.00 0.00 173.24 172.37 1ag7 n ARG 8 N 2.36 -0.56 -4.50 4.02 0.00 -1.26 -0.92 116.66 115.81 1ag7 n ARG 8 Ca -0.16 -0.21 -0.24 0.00 -0.00 0.00 0.00 57.85 57.24 1ag7 n ARG 8 Cb 0.55 -0.16 -0.10 0.00 -0.00 0.00 0.00 32.46 32.74 1ag7 n ARG 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ag7 s GLN 12 N -3.63 3.55 0.24 0.00 -0.21 -1.26 -5.09 119.66 113.27 1ag7 s GLN 12 Ca 0.31 -0.55 -0.30 0.00 0.02 0.00 0.00 55.36 54.84 1ag7 s GLN 12 Cb 0.02 -3.04 -0.15 0.00 1.00 0.00 0.00 33.01 30.84 1ag7 s GLN 12 CO 0.15 -0.02 1.12 0.00 -2.12 0.00 0.00 175.29 174.42 1ag7 n MET 15 N -2.92 2.28 0.00 0.00 1.56 -1.26 -1.28 117.12 115.51 1ag7 n MET 15 Ca 0.01 0.83 0.00 0.00 -0.27 0.00 0.00 57.70 58.27 1ag7 n MET 15 Cb 0.60 -2.64 0.00 0.00 2.15 0.00 0.00 33.22 33.33 1ag7 n MET 15 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1ag7 n GLY 16 N 3.80 2.21 3.96 -5.12 0.00 -1.26 -5.06 105.19 103.72 1ag7 n GLY 16 Ca 0.18 -0.09 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1ag7 n GLY 16 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ag7 s LEU 17 N 0.00 3.47 0.01 0.99 1.02 -0.40 -0.97 118.68 122.80 1ag7 s LEU 17 Ca 0.00 0.23 -0.03 0.00 0.02 0.00 0.00 54.13 54.35 1ag7 s LEU 17 Cb 0.00 -3.10 -0.01 0.00 0.02 0.00 0.00 46.19 43.10 1ag7 s LEU 17 CO 0.00 -0.89 0.04 0.00 0.02 0.00 0.00 176.35 175.51 1ag7 s ARG 18 N -4.67 0.34 -0.77 1.70 1.70 0.03 -4.70 118.95 112.58 1ag7 s ARG 18 Ca 0.52 -0.46 -0.26 0.00 -0.47 0.00 0.00 55.73 55.06 1ag7 s ARG 18 Cb -0.10 0.13 0.01 0.00 -0.57 0.00 0.00 34.95 34.42 1ag7 s ARG 18 CO 0.39 -0.07 1.59 0.00 -1.08 0.00 0.00 175.30 176.13 1ag7 s GLY 20 N 5.94 0.90 0.73 0.00 0.00 -0.50 -4.93 107.32 109.46 1ag7 s GLY 20 Ca 0.52 -0.30 -0.14 0.00 0.00 0.00 0.00 44.72 44.80 1ag7 s GLY 20 CO 0.11 2.91 1.16 -1.60 0.00 0.00 0.00 173.10 175.68 1ag7 s ARG 21 N 5.42 2.22 0.00 2.90 6.06 -1.26 -1.69 118.95 132.60 1ag7 s ARG 21 Ca 0.62 1.56 0.00 0.00 -2.50 0.00 0.00 55.73 55.41 1ag7 s ARG 21 Cb -0.14 -1.86 0.00 0.00 0.06 0.00 0.00 34.95 33.01 1ag7 s ARG 21 CO 0.29 -1.73 0.00 0.41 -2.50 0.00 0.00 175.30 171.78 1ag7 n GLY 22 N -0.07 0.03 2.80 8.12 0.00 -1.26 -4.79 105.19 110.01 1ag7 n GLY 22 Ca 0.12 -1.51 -0.17 0.00 0.00 0.00 0.00 46.02 44.45 1ag7 n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ag7 s ASN 23 N -4.00 1.12 0.27 1.61 4.22 -1.26 -2.68 114.94 114.22 1ag7 s ASN 23 Ca 0.00 -0.02 -0.29 0.00 -2.14 0.00 0.00 52.86 50.40 1ag7 s ASN 23 Cb 0.00 0.43 -0.09 0.00 1.28 0.00 0.00 41.25 42.87 1ag7 s ASN 23 CO 0.00 -0.30 1.19 -2.16 -2.04 0.00 0.00 177.10 173.79 1ag7 s PRO 24 N 2.34 4.51 0.82 3.55 0.04 -1.26 -5.12 135.00 139.88 1ag7 s PRO 24 Ca 0.06 1.95 -0.14 0.00 0.04 0.00 0.00 61.00 62.91 1ag7 s PRO 24 Cb -0.15 -3.17 0.06 0.00 0.04 0.00 0.00 34.50 31.29 1ag7 s PRO 24 CO -0.11 0.01 1.01 1.04 0.04 0.00 0.00 177.00 178.99 1ag7 n GLN 25 N 1.46 0.12 -3.64 4.56 6.02 -1.09 -5.04 117.38 119.77 1ag7 n GLN 25 Ca 0.01 0.11 -0.10 0.00 -0.01 0.00 0.00 57.00 57.01 1ag7 n GLN 25 Cb 0.44 -2.28 -0.07 0.00 1.02 0.00 0.00 30.24 29.35 1ag7 n GLN 25 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1ag7 s LYS 26 N -3.87 0.75 0.40 -1.09 1.02 -0.68 -4.00 119.74 112.27 1ag7 s LYS 26 Ca 0.70 1.09 -0.22 0.00 0.02 0.00 0.00 55.97 57.55 1ag7 s LYS 26 Cb -0.29 0.26 -0.10 0.00 -0.52 0.00 0.00 37.83 37.18 1ag7 s LYS 26 CO 0.54 -0.12 0.96 0.00 -0.92 0.00 0.00 175.35 175.81 1ag7 n ILE 28 N -0.30 0.00 -3.88 0.00 -0.00 -0.32 -2.82 119.36 112.04 1ag7 n ILE 28 Ca 0.06 -0.89 -0.37 0.00 -0.00 0.00 0.00 62.75 61.55 1ag7 n ILE 28 Cb 0.53 0.38 -0.06 0.00 -0.00 0.00 0.00 39.64 40.48 1ag7 n ILE 28 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 1ag7 s GLY 29 N -1.90 2.16 -0.12 3.28 0.00 -1.26 -0.79 107.32 108.69 1ag7 s GLY 29 Ca 0.11 -0.65 -0.23 0.00 0.00 0.00 0.00 44.72 43.94 1ag7 s GLY 29 CO 0.08 -0.41 0.67 0.00 0.00 0.00 0.00 173.10 173.44 1ag7 h ALA 30 N 4.86 0.05 -1.86 3.20 0.00 -1.34 -3.46 119.26 120.73 1ag7 h ALA 30 Ca -0.54 -0.78 -0.64 0.00 0.00 0.00 0.00 54.91 52.94 1ag7 h ALA 30 Cb 1.23 0.24 -0.15 0.00 0.00 0.00 0.00 17.79 19.10 1ag7 h ALA 30 CO 0.59 0.37 0.37 -1.58 0.00 0.00 0.00 179.25 179.00 1ag7 s HIS 31 N -2.35 2.85 -0.26 0.00 2.46 -1.24 -4.26 115.29 112.49 1ag7 s HIS 31 Ca -0.19 -0.39 0.09 0.00 0.47 0.00 0.00 55.06 55.03 1ag7 s HIS 31 Cb 0.01 -3.97 0.45 0.00 -0.13 0.00 0.00 32.58 28.93 1ag7 s HIS 31 CO 0.73 -1.33 1.21 -3.47 -2.47 0.00 0.00 174.74 169.40 1ag7 n ASP 33 N 7.06 3.68 -0.81 9.88 2.03 -1.26 -5.14 116.55 131.98 1ag7 n ASP 33 Ca -0.03 -3.81 0.10 0.00 0.52 0.00 0.00 54.79 51.57 1ag7 n ASP 33 Cb 0.46 -0.42 0.08 0.00 -0.72 0.00 0.00 41.12 40.52 1ag7 n ASP 33 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80