#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hly s VAL 2 N 0.00 -0.03 0.00 2.28 1.01 -1.26 -1.26 120.40 121.14 1hly s VAL 2 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1hly s VAL 2 Cb 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 36.38 36.11 1hly s VAL 2 CO 0.00 0.05 0.00 -0.38 0.00 0.00 0.00 175.10 174.77 1hly n ILE 3 N 3.79 0.00 -2.68 2.22 5.41 -1.26 -5.03 119.36 121.81 1hly n ILE 3 Ca -0.21 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.46 1hly n ILE 3 Cb 0.54 0.00 0.03 0.00 -0.71 0.00 0.00 39.64 39.51 1hly n ILE 3 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1hly n ASP 4 N 0.00 1.58 -4.62 4.38 2.03 -1.26 -4.87 116.55 113.79 1hly n ASP 4 Ca 0.00 -2.63 -0.42 0.00 0.52 0.00 0.00 54.79 52.27 1hly n ASP 4 Cb 0.00 -0.52 -0.05 0.00 -0.72 0.00 0.00 41.12 39.83 1hly n ASP 4 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1hly s VAL 5 N -3.32 4.83 -0.01 5.18 1.01 -1.26 -5.03 120.40 121.80 1hly s VAL 5 Ca 0.28 1.24 -0.10 0.00 0.00 0.00 0.00 61.98 63.39 1hly s VAL 5 Cb 0.43 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 1hly s VAL 5 CO 0.02 -0.18 0.32 -0.54 0.00 0.00 0.00 175.10 174.72 1hly s LYS 6 N 2.87 3.71 0.21 2.72 3.01 -1.26 -1.58 119.74 129.43 1hly s LYS 6 Ca 0.32 0.15 -0.19 0.00 -1.01 0.00 0.00 55.97 55.23 1hly s LYS 6 Cb -0.14 -3.14 0.03 0.00 -1.01 0.00 0.00 37.83 33.57 1hly s LYS 6 CO 0.11 0.68 0.59 0.00 0.51 0.00 0.00 175.35 177.24 1hly n THR 8 N -0.38 1.02 -4.01 0.00 5.66 -1.26 -4.50 114.28 110.81 1hly n THR 8 Ca -0.09 -0.56 -0.27 0.00 -3.05 0.00 0.00 64.05 60.07 1hly n THR 8 Cb 0.62 -0.77 -0.05 0.00 -1.55 0.00 0.00 70.33 68.59 1hly n THR 8 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1hly s SER 9 N -5.08 5.92 0.40 1.09 0.15 -1.26 -4.72 113.70 110.20 1hly s SER 9 Ca -0.12 0.04 0.10 0.00 0.70 0.00 0.00 55.95 56.67 1hly s SER 9 Cb 0.05 -1.68 0.84 0.00 -1.71 0.00 0.00 66.02 63.52 1hly s SER 9 CO 0.55 0.09 1.95 1.55 1.20 0.00 0.00 173.24 178.57 1hly h PRO 10 N 2.48 0.21 -0.65 5.44 0.13 -1.91 -3.34 132.00 134.38 1hly h PRO 10 Ca -0.48 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 64.58 1hly h PRO 10 Cb 1.19 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 1hly h PRO 10 CO 0.67 0.33 0.28 0.87 -0.23 0.00 0.00 178.00 179.92 1hly h LYS 11 N 0.21 0.94 -0.22 0.86 1.57 -1.94 -1.11 116.57 116.87 1hly h LYS 11 Ca 0.04 -0.14 0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1hly h LYS 11 Cb 0.32 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1hly h LYS 11 CO 0.02 0.75 0.19 1.96 -0.57 0.00 0.00 179.45 181.79 1hly h GLN 12 N 0.93 0.00 0.00 3.15 4.20 -1.97 -1.51 115.11 119.90 1hly h GLN 12 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 1hly h GLN 12 Cb 0.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1hly h GLN 12 CO -0.02 0.00 -1.13 0.00 -0.67 0.00 0.00 178.83 177.00 1hly h LEU 14 N 0.00 0.34 -0.20 0.00 7.12 -0.87 -1.21 115.31 120.48 1hly h LEU 14 Ca 0.00 -0.27 0.02 0.00 0.13 0.00 0.00 57.88 57.76 1hly h LEU 14 Cb 0.69 -0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.71 1hly h LEU 14 CO 0.00 0.53 0.06 -0.65 -0.13 0.00 0.00 178.44 178.25 1hly h PRO 15 N 0.14 0.15 -0.36 5.25 0.11 -1.84 -0.63 132.00 134.82 1hly h PRO 15 Ca 0.06 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.03 1hly h PRO 15 Cb 0.34 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 1hly h PRO 15 CO 0.01 0.10 -0.32 -1.00 -0.21 0.00 0.00 178.00 176.58 1hly h PRO 16 N 0.15 0.78 -0.75 1.05 0.13 -1.87 -2.83 132.00 128.66 1hly h PRO 16 Ca 0.09 -0.37 0.02 0.00 -0.87 0.00 0.00 66.00 64.87 1hly h PRO 16 Cb 0.07 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 31.15 1hly h PRO 16 CO -0.10 0.99 0.50 0.00 -0.23 0.00 0.00 178.00 179.16 1hly h LYS 18 N 0.97 0.00 0.11 0.00 1.63 -1.06 -2.35 116.57 115.88 1hly h LYS 18 Ca 0.29 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.08 1hly h LYS 18 Cb -0.04 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 1hly h LYS 18 CO -0.07 0.33 -0.05 0.00 -3.45 0.00 0.00 179.45 176.21 1hly h ALA 19 N 1.67 -0.45 0.15 5.00 0.00 -0.95 -3.32 119.26 121.35 1hly h ALA 19 Ca -0.00 -0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.55 1hly h ALA 19 Cb 0.78 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1hly h ALA 19 CO 0.04 -0.44 -1.63 1.96 0.00 0.00 0.00 179.25 179.19 1hly h GLN 20 N -0.31 0.31 0.00 0.00 4.20 -1.56 -3.41 115.11 114.34 1hly h GLN 20 Ca -0.02 -0.53 0.00 0.00 0.06 0.00 0.00 58.65 58.17 1hly h GLN 20 Cb 0.11 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1hly h GLN 20 CO 0.03 1.19 -0.60 1.19 -0.67 0.00 0.00 178.83 179.97 1hly n PHE 21 N -3.50 0.00 0.00 2.96 3.72 -1.03 -5.06 117.46 114.55 1hly n PHE 21 Ca -0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 1hly n PHE 21 Cb 1.06 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.56 1hly n PHE 21 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1hly n GLY 22 N 1.38 4.07 0.25 1.37 0.00 -0.91 -4.49 105.19 106.86 1hly n GLY 22 Ca 0.01 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 45.08 1hly n GLY 22 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1hly h ILE 23 N 4.64 1.28 0.00 -0.61 2.10 -1.89 -2.94 117.51 120.09 1hly h ILE 23 Ca 0.00 -1.61 -0.06 0.00 1.08 0.00 0.00 64.86 64.28 1hly h ILE 23 Cb 0.00 1.51 -0.01 0.00 -1.09 0.00 0.00 36.82 37.23 1hly h ILE 23 CO 0.00 0.53 -0.62 -0.09 -1.08 0.00 0.00 178.15 176.89 1hly h ARG 24 N 0.67 0.00 -6.68 2.19 1.12 -1.92 -3.49 114.38 106.27 1hly h ARG 24 Ca 0.04 0.00 -0.54 0.00 -1.11 0.00 0.00 59.98 58.37 1hly h ARG 24 Cb 1.03 0.00 0.21 0.00 -0.01 0.00 0.00 29.97 31.20 1hly h ARG 24 CO 0.10 0.19 -0.70 0.00 -3.11 0.00 0.00 179.97 176.45 1hly n ALA 25 N -2.21 -2.81 -2.54 2.80 0.00 -1.11 -4.92 120.51 109.73 1hly n ALA 25 Ca 0.00 -0.57 -0.24 0.00 0.00 0.00 0.00 53.44 52.63 1hly n ALA 25 Cb 0.65 -1.73 -0.08 0.00 0.00 0.00 0.00 19.45 18.29 1hly n ALA 25 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1hly s GLY 26 N -1.83 2.02 -0.10 0.00 0.00 -0.47 -4.87 107.32 102.06 1hly s GLY 26 Ca 0.56 -1.92 -0.06 0.00 0.00 0.00 0.00 44.72 43.30 1hly s GLY 26 CO 0.68 -1.86 0.24 0.00 0.00 0.00 0.00 173.10 172.16 1hly s ALA 27 N -2.49 -0.57 0.04 3.20 0.00 -1.26 -0.18 121.76 120.50 1hly s ALA 27 Ca 0.35 0.89 -0.11 0.00 0.00 0.00 0.00 51.96 53.09 1hly s ALA 27 Cb -0.01 -0.55 0.01 0.00 0.00 0.00 0.00 23.12 22.57 1hly s ALA 27 CO 0.20 -0.17 0.24 0.21 0.00 0.00 0.00 175.76 176.24 1hly s LYS 28 N 0.88 0.73 -0.02 0.00 2.36 -0.30 -4.65 119.74 118.74 1hly s LYS 28 Ca -0.06 -0.55 -0.06 0.00 -2.55 0.00 0.00 55.97 52.76 1hly s LYS 28 Cb -0.07 0.31 -0.04 0.00 -1.05 0.00 0.00 37.83 36.97 1hly s LYS 28 CO -0.06 -0.22 0.22 0.00 1.55 0.00 0.00 175.35 176.85 1hly s MET 30 N -1.69 0.78 -1.45 0.00 0.00 -0.08 -4.92 119.30 111.95 1hly s MET 30 Ca 0.25 0.59 -0.06 0.00 0.00 0.00 0.00 55.69 56.47 1hly s MET 30 Cb -0.13 0.38 0.01 0.00 0.00 0.00 0.00 34.83 35.09 1hly s MET 30 CO 0.15 -0.16 0.82 -1.71 0.00 0.00 0.00 175.02 174.12 1hly n ASN 31 N 1.82 -6.17 0.00 1.11 5.15 -1.26 -1.66 115.26 114.26 1hly n ASN 31 Ca -0.14 -0.38 0.00 0.00 -0.60 0.00 0.00 54.58 53.46 1hly n ASN 31 Cb 0.56 -4.91 0.00 0.00 -0.53 0.00 0.00 39.78 34.90 1hly n ASN 31 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1hly n GLY 32 N -1.70 2.79 3.41 8.20 0.00 -1.26 -4.98 105.19 111.64 1hly n GLY 32 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 1hly n GLY 32 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hly s LYS 33 N -0.00 1.35 0.90 1.61 -2.85 -0.66 -1.04 119.74 119.05 1hly s LYS 33 Ca 0.00 -1.36 -0.11 0.00 -1.00 0.00 0.00 55.97 53.50 1hly s LYS 33 Cb 0.00 0.38 0.14 0.00 -2.06 0.00 0.00 37.83 36.29 1hly s LYS 33 CO 0.00 -0.51 1.10 0.00 0.10 0.00 0.00 175.35 176.04 1hly s LYS 35 N -4.77 0.63 0.09 0.00 -0.14 0.12 -4.61 119.74 111.07 1hly s LYS 35 Ca 0.65 -1.01 -0.30 0.00 -1.36 0.00 0.00 55.97 53.94 1hly s LYS 35 Cb -0.20 -0.87 -0.05 0.00 -1.68 0.00 0.00 37.83 35.03 1hly s LYS 35 CO 0.58 -1.21 1.04 0.00 -0.76 0.00 0.00 175.35 175.01 1hly s TYR 37 N 0.40 3.49 -1.44 0.00 1.51 0.75 -0.04 117.35 122.02 1hly s TYR 37 Ca 0.51 -2.16 -0.14 0.00 -1.01 0.00 0.00 57.07 54.26 1hly s TYR 37 Cb -0.25 -3.42 0.03 0.00 -0.11 0.00 0.00 41.96 38.21 1hly s TYR 37 CO 0.30 -0.96 2.22 -0.35 -1.11 0.00 0.00 175.55 175.66 1hly n PRO 38 N 4.47 2.81 0.00 -1.71 -0.04 -1.26 -1.37 135.00 137.89 1hly n PRO 38 Ca -0.02 -2.57 0.00 0.00 -0.04 0.00 0.00 63.50 60.87 1hly n PRO 38 Cb 0.41 -3.27 0.00 0.00 -0.04 0.00 0.00 33.50 30.59 1hly n PRO 38 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04