#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 0.14 2.28 1.01 -1.26 -2.56 120.40 119.98 1hly s VAL 2 Ca 0.00 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.15 1hly s VAL 2 Cb 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.18 1hly s VAL 2 CO 0.00 0.04 -0.15 0.27 0.00 0.00 0.00 175.10 175.26 1hly s ILE 3 N 0.62 1.48 -0.49 2.22 -4.36 -1.25 -5.01 121.20 114.40 1hly s ILE 3 Ca -0.05 -1.78 -0.03 0.00 -0.26 0.00 0.00 60.65 58.54 1hly s ILE 3 Cb -0.07 -1.63 0.19 0.00 1.25 0.00 0.00 42.46 42.20 1hly s ILE 3 CO -0.03 -0.38 2.37 -0.67 0.24 0.00 0.00 174.94 176.47 1hly n ASP 4 N 0.46 6.77 -4.60 4.36 -0.08 -1.26 -3.58 116.55 118.61 1hly n ASP 4 Ca -0.15 -3.32 -0.43 0.00 -1.51 0.00 0.00 54.79 49.39 1hly n ASP 4 Cb 0.57 -1.13 -0.04 0.00 2.34 0.00 0.00 41.12 42.86 1hly n ASP 4 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1hly s VAL 5 N -2.95 4.57 0.06 5.18 1.01 -1.26 -4.97 120.40 122.04 1hly s VAL 5 Ca 0.51 1.14 -0.13 0.00 0.00 0.00 0.00 61.98 63.50 1hly s VAL 5 Cb 0.37 -4.35 -0.06 0.00 0.00 0.00 0.00 36.38 32.34 1hly s VAL 5 CO -0.16 -0.58 0.43 -0.54 0.00 0.00 0.00 175.10 174.26 1hly s LYS 6 N 3.52 3.87 0.05 2.72 1.02 -1.26 -0.44 119.74 129.21 1hly s LYS 6 Ca 0.38 0.33 -0.02 0.00 0.02 0.00 0.00 55.97 56.68 1hly s LYS 6 Cb -0.12 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.09 1hly s LYS 6 CO 0.20 0.60 0.00 0.00 -0.92 0.00 0.00 175.35 175.23 1hly n THR 8 N 0.34 0.00 -4.08 0.00 -2.24 -1.26 -4.52 114.28 102.52 1hly n THR 8 Ca -0.16 -0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.26 1hly n THR 8 Cb 0.60 0.52 -0.11 0.00 -2.10 0.00 0.00 70.33 69.24 1hly n THR 8 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1hly s SER 9 N -2.66 0.93 0.59 3.42 0.15 -1.26 -5.02 113.70 109.85 1hly s SER 9 Ca -0.01 -0.61 0.36 0.00 0.70 0.00 0.00 55.95 56.39 1hly s SER 9 Cb 0.06 0.04 1.79 0.00 -1.71 0.00 0.00 66.02 66.20 1hly s SER 9 CO 0.37 -0.23 2.15 1.55 1.20 0.00 0.00 173.24 178.29 1hly h PRO 10 N 4.30 0.00 -0.16 5.44 0.13 -1.91 -3.30 132.00 136.49 1hly h PRO 10 Ca -0.36 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.80 1hly h PRO 10 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1hly h PRO 10 CO 0.44 0.03 -0.00 -0.22 -0.23 0.00 0.00 178.00 178.02 1hly h LYS 11 N 0.00 0.05 0.00 0.86 1.63 -1.95 -1.28 116.57 115.88 1hly h LYS 11 Ca -0.00 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1hly h LYS 11 Cb 0.27 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.89 1hly h LYS 11 CO 0.00 0.03 0.00 0.00 -3.45 0.00 0.00 179.45 176.04 1hly n GLN 12 N -5.13 0.03 0.06 1.90 10.64 -1.24 -1.51 117.38 122.13 1hly n GLN 12 Ca -0.03 0.27 -0.00 0.00 -1.83 0.00 0.00 57.00 55.41 1hly n GLN 12 Cb 0.09 -1.56 -0.06 0.00 -0.86 0.00 0.00 30.24 27.86 1hly n GLN 12 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1hly h LEU 14 N 0.00 0.04 -0.80 0.00 5.85 -0.68 -1.56 115.31 118.16 1hly h LEU 14 Ca -0.12 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.28 1hly h LEU 14 Cb 1.56 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.55 1hly h LEU 14 CO 0.06 0.31 0.31 1.55 -0.34 0.00 0.00 178.44 180.33 1hly h PRO 15 N -0.23 1.20 -0.28 5.25 0.13 -1.81 -0.73 132.00 135.53 1hly h PRO 15 Ca 0.01 -0.22 -0.12 0.00 -0.87 0.00 0.00 66.00 64.80 1hly h PRO 15 Cb 0.29 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.21 1hly h PRO 15 CO 0.00 0.97 -0.32 -1.00 -0.23 0.00 0.00 178.00 177.42 1hly h PRO 16 N 1.17 0.59 -0.72 1.56 0.13 -1.83 -3.10 132.00 129.79 1hly h PRO 16 Ca 0.27 -0.26 0.04 0.00 -0.87 0.00 0.00 66.00 65.17 1hly h PRO 16 Cb 0.23 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 31.30 1hly h PRO 16 CO -0.02 0.84 0.44 0.00 -0.23 0.00 0.00 178.00 179.02 1hly n LYS 18 N -4.68 0.07 0.05 0.00 4.76 -0.31 -2.35 118.16 115.70 1hly n LYS 18 Ca 0.08 0.29 -0.02 0.00 -2.87 0.00 0.00 58.31 55.79 1hly n LYS 18 Cb 0.12 -1.62 -0.01 0.00 -1.84 0.00 0.00 35.03 31.67 1hly n LYS 18 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hly h ALA 19 N 2.45 -0.46 0.00 7.82 0.00 -1.18 -3.37 119.26 124.52 1hly h ALA 19 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1hly h ALA 19 Cb 0.31 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1hly h ALA 19 CO 0.00 -0.45 -1.58 0.00 0.00 0.00 0.00 179.25 177.22 1hly n GLN 20 N -2.84 2.05 0.03 0.00 10.64 -1.22 -4.61 117.38 121.43 1hly n GLN 20 Ca -0.02 -0.02 0.11 0.00 -1.83 0.00 0.00 57.00 55.23 1hly n GLN 20 Cb 0.06 -1.23 -0.10 0.00 -0.86 0.00 0.00 30.24 28.11 1hly n GLN 20 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1hly n PHE 21 N -2.22 0.39 0.00 2.61 3.72 -0.99 -5.03 117.46 115.93 1hly n PHE 21 Ca -0.12 0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1hly n PHE 21 Cb 0.67 -0.69 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 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 1.24 4.11 0.23 1.37 0.00 -1.03 -4.45 105.19 106.67 1hly n GLY 22 Ca -0.03 -0.86 -0.10 0.00 0.00 0.00 0.00 46.02 45.04 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 4.87 1.30 0.00 -0.61 2.10 -1.88 -2.79 117.51 120.50 1hly h ILE 23 Ca 0.00 -1.63 -0.09 0.00 1.08 0.00 0.00 64.86 64.22 1hly h ILE 23 Cb 0.00 1.57 -0.01 0.00 -1.09 0.00 0.00 36.82 37.28 1hly h ILE 23 CO 0.00 0.52 -0.57 -0.09 -1.08 0.00 0.00 178.15 176.93 1hly h ARG 24 N 0.54 0.00 -6.85 2.19 2.43 -1.93 -3.49 114.38 107.27 1hly h ARG 24 Ca 0.04 0.00 -0.52 0.00 -0.81 0.00 0.00 59.98 58.69 1hly h ARG 24 Cb 0.98 0.00 0.22 0.00 -0.42 0.00 0.00 29.97 30.75 1hly h ARG 24 CO 0.09 0.36 -0.52 0.00 -1.51 0.00 0.00 179.97 178.40 1hly n ALA 25 N -2.22 -2.60 -2.44 2.80 0.00 -1.05 -4.92 120.51 110.08 1hly n ALA 25 Ca 0.01 -0.72 -0.23 0.00 0.00 0.00 0.00 53.44 52.49 1hly n ALA 25 Cb 0.71 -1.82 -0.06 0.00 0.00 0.00 0.00 19.45 18.27 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 -2.09 2.10 -0.15 0.00 0.00 -0.44 -4.90 107.32 101.85 1hly s GLY 26 Ca 0.59 -1.93 -0.10 0.00 0.00 0.00 0.00 44.72 43.28 1hly s GLY 26 CO 0.66 -1.79 0.37 0.00 0.00 0.00 0.00 173.10 172.33 1hly s ALA 27 N -2.49 -0.91 0.16 3.20 0.00 -1.26 -0.20 121.76 120.26 1hly s ALA 27 Ca 0.41 1.25 0.07 0.00 0.00 0.00 0.00 51.96 53.68 1hly s ALA 27 Cb -0.01 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1hly s ALA 27 CO 0.24 -0.22 -0.15 0.15 0.00 0.00 0.00 175.76 175.78 1hly s LYS 28 N 0.89 1.20 -0.20 0.00 3.01 0.06 -4.93 119.74 119.77 1hly s LYS 28 Ca -0.06 -1.41 -0.11 0.00 -1.01 0.00 0.00 55.97 53.38 1hly s LYS 28 Cb -0.06 -1.08 -0.05 0.00 -1.01 0.00 0.00 37.83 35.62 1hly s LYS 28 CO -0.07 0.20 0.18 0.00 0.51 0.00 0.00 175.35 176.17 1hly s MET 30 N 0.51 0.71 -1.44 0.00 0.00 0.40 -4.91 119.30 114.58 1hly s MET 30 Ca 0.10 1.06 -0.11 0.00 0.00 0.00 0.00 55.69 56.74 1hly s MET 30 Cb -0.12 0.23 0.05 0.00 0.00 0.00 0.00 34.83 34.99 1hly s MET 30 CO 0.00 -0.13 1.07 -1.71 0.00 0.00 0.00 175.02 174.26 1hly n ASN 31 N 3.59 -5.31 -0.66 1.11 5.15 -1.26 -1.53 115.26 116.35 1hly n ASN 31 Ca -0.18 -0.67 -0.09 0.00 -0.60 0.00 0.00 54.58 53.05 1hly n ASN 31 Cb 0.57 -4.45 -0.04 0.00 -0.53 0.00 0.00 39.78 35.33 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 -1.82 0.90 3.10 8.20 0.00 -1.26 -4.97 105.19 109.33 1hly n GLY 32 Ca 0.00 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 1hly n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hly s LYS 33 N -2.54 0.63 0.68 1.61 1.02 -0.58 -0.71 119.74 119.84 1hly s LYS 33 Ca 0.00 -1.14 -0.16 0.00 0.02 0.00 0.00 55.97 54.70 1hly s LYS 33 Cb 0.00 0.04 0.01 0.00 -0.52 0.00 0.00 37.83 37.36 1hly s LYS 33 CO 0.00 -0.06 1.17 0.00 -0.92 0.00 0.00 175.35 175.54 1hly n LYS 35 N -2.38 0.47 -2.43 0.00 3.00 0.10 -3.91 118.16 113.01 1hly n LYS 35 Ca 0.12 -2.42 -0.41 0.00 -0.00 0.00 0.00 58.31 55.61 1hly n LYS 35 Cb 0.51 -1.51 -0.04 0.00 0.00 0.00 0.00 35.03 33.99 1hly n LYS 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1hly s TYR 37 N -0.78 3.50 -1.37 0.00 1.51 0.72 -0.05 117.35 120.88 1hly s TYR 37 Ca 0.47 -2.06 -0.15 0.00 -1.01 0.00 0.00 57.07 54.32 1hly s TYR 37 Cb -0.32 -3.54 0.01 0.00 -0.11 0.00 0.00 41.96 38.00 1hly s TYR 37 CO 0.40 -0.96 2.18 -0.35 -1.11 0.00 0.00 175.55 175.71 1hly n PRO 38 N 4.35 2.68 0.00 -1.71 -0.04 -1.26 -1.32 135.00 137.70 1hly n PRO 38 Ca 0.01 -2.51 0.00 0.00 -0.04 0.00 0.00 63.50 60.96 1hly n PRO 38 Cb 0.42 -3.25 0.00 0.00 -0.04 0.00 0.00 33.50 30.63 1hly n PRO 38 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04