#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 -0.00 0.12 2.28 1.01 -1.26 -4.78 120.40 117.77 1hly s VAL 2 Ca 0.00 0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.06 1hly s VAL 2 Cb 0.00 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 1hly s VAL 2 CO 0.00 0.00 -0.17 0.27 0.00 0.00 0.00 175.10 175.20 1hly s ILE 3 N 0.56 1.55 -0.82 2.22 -4.36 -1.22 -5.00 121.20 114.13 1hly s ILE 3 Ca -0.02 -1.66 -0.02 0.00 -0.26 0.00 0.00 60.65 58.69 1hly s ILE 3 Cb -0.05 -1.56 0.33 0.00 1.25 0.00 0.00 42.46 42.43 1hly s ILE 3 CO -0.03 -0.25 2.09 -0.67 0.24 0.00 0.00 174.94 176.32 1hly n ASP 4 N 0.75 7.45 -4.59 4.36 -0.08 -1.26 -3.35 116.55 119.83 1hly n ASP 4 Ca -0.17 -3.79 -0.41 0.00 -1.51 0.00 0.00 54.79 48.92 1hly n ASP 4 Cb 0.55 -1.08 -0.07 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 -4.84 4.99 0.15 5.18 1.01 -1.26 -4.98 120.40 120.65 1hly s VAL 5 Ca 0.52 0.72 -0.17 0.00 0.00 0.00 0.00 61.98 63.05 1hly s VAL 5 Cb 0.43 -3.95 -0.07 0.00 0.00 0.00 0.00 36.38 32.79 1hly s VAL 5 CO -0.40 -0.11 0.60 -0.54 0.00 0.00 0.00 175.10 174.65 1hly s LYS 6 N 2.49 4.11 0.03 2.72 3.01 -1.26 -0.98 119.74 129.85 1hly s LYS 6 Ca 0.22 0.65 -0.10 0.00 -1.01 0.00 0.00 55.97 55.74 1hly s LYS 6 Cb -0.15 -2.98 0.01 0.00 -1.01 0.00 0.00 37.83 33.69 1hly s LYS 6 CO 0.12 0.49 0.21 0.00 0.51 0.00 0.00 175.35 176.67 1hly n THR 8 N 0.85 1.65 -4.19 0.00 -1.04 -1.26 -4.49 114.28 105.80 1hly n THR 8 Ca -0.20 -0.55 -0.31 0.00 -2.04 0.00 0.00 64.05 60.96 1hly n THR 8 Cb 0.58 -1.68 -0.08 0.00 -1.82 0.00 0.00 70.33 67.33 1hly n THR 8 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1hly s SER 9 N -6.89 4.99 0.57 8.00 0.15 -1.26 -4.96 113.70 114.29 1hly s SER 9 Ca -0.28 -0.15 0.31 0.00 0.70 0.00 0.00 55.95 56.53 1hly s SER 9 Cb 0.08 -1.20 1.73 0.00 -1.71 0.00 0.00 66.02 64.92 1hly s SER 9 CO 0.68 0.21 2.18 1.55 1.20 0.00 0.00 173.24 179.05 1hly h PRO 10 N 3.72 0.00 -0.30 5.44 0.13 -1.91 -3.11 132.00 135.97 1hly h PRO 10 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 1hly h PRO 10 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 1hly h PRO 10 CO 0.58 0.05 -0.02 0.87 -0.23 0.00 0.00 178.00 179.26 1hly h LYS 11 N 0.00 0.47 0.00 0.86 1.79 -1.94 -1.34 116.57 116.41 1hly h LYS 11 Ca -0.00 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1hly h LYS 11 Cb 0.18 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 1hly h LYS 11 CO 0.01 0.51 0.00 1.96 -1.08 0.00 0.00 179.45 180.85 1hly h GLN 12 N 0.45 0.00 0.00 3.15 4.20 -1.94 -1.68 115.11 119.29 1hly h GLN 12 Ca 0.10 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 1hly h GLN 12 Cb 0.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1hly h GLN 12 CO 0.01 0.00 -1.03 0.00 -0.67 0.00 0.00 178.83 177.14 1hly h LEU 14 N 0.00 -0.25 -1.03 0.00 4.07 -1.27 -1.64 115.31 115.20 1hly h LEU 14 Ca -0.04 -0.17 -0.06 0.00 0.08 0.00 0.00 57.88 57.69 1hly h LEU 14 Cb 1.17 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.95 1hly h LEU 14 CO 0.01 0.03 0.07 1.55 -1.08 0.00 0.00 178.44 179.03 1hly h PRO 15 N -0.54 0.77 -0.37 1.13 0.13 -1.80 -0.64 132.00 130.68 1hly h PRO 15 Ca -0.03 -0.17 -0.16 0.00 -0.87 0.00 0.00 66.00 64.77 1hly h PRO 15 Cb 0.40 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.42 1hly h PRO 15 CO 0.05 0.73 -0.40 -1.00 -0.23 0.00 0.00 178.00 177.15 1hly h PRO 16 N 0.73 0.92 -0.16 1.56 0.13 -1.80 -2.28 132.00 131.09 1hly h PRO 16 Ca 0.16 -0.49 0.03 0.00 -0.87 0.00 0.00 66.00 64.83 1hly h PRO 16 Cb 0.35 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.47 1hly h PRO 16 CO 0.01 1.14 -0.02 0.00 -0.23 0.00 0.00 178.00 178.90 1hly n LYS 18 N -5.15 0.07 0.03 0.00 3.00 -0.26 -1.58 118.16 114.28 1hly n LYS 18 Ca -0.03 0.19 -0.01 0.00 -0.00 0.00 0.00 58.31 58.45 1hly n LYS 18 Cb 0.10 -1.50 -0.01 0.00 0.00 0.00 0.00 35.03 33.62 1hly n LYS 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1hly h ALA 19 N 2.65 -0.45 0.00 3.14 0.00 -0.62 -3.44 119.26 120.54 1hly h ALA 19 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.61 1hly h ALA 19 Cb 0.25 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1hly h ALA 19 CO 0.00 -0.45 -2.00 1.04 0.00 0.00 0.00 179.25 177.84 1hly n GLN 20 N -2.49 0.41 0.06 0.00 6.02 -1.20 -4.82 117.38 115.37 1hly n GLN 20 Ca -0.01 0.13 0.02 0.00 -0.01 0.00 0.00 57.00 57.13 1hly n GLN 20 Cb 0.04 -1.25 -0.05 0.00 1.02 0.00 0.00 30.24 30.00 1hly n GLN 20 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 1hly h PHE 21 N -0.31 0.00 -1.70 1.08 0.04 -1.58 -3.47 116.94 110.99 1hly h PHE 21 Ca -0.42 0.00 0.26 0.00 2.80 0.00 0.00 57.97 60.61 1hly h PHE 21 Cb 1.51 0.00 -0.13 0.00 2.20 0.00 0.00 35.95 39.53 1hly h PHE 21 CO -0.02 0.49 0.73 0.20 -0.60 0.00 0.00 178.31 179.11 1hly s GLY 22 N -4.67 -0.36 -0.03 -1.45 0.00 -0.61 -4.68 107.32 95.53 1hly s GLY 22 Ca -0.01 0.78 -0.15 0.00 0.00 0.00 0.00 44.72 45.34 1hly s GLY 22 CO 0.79 0.19 0.66 -2.22 0.00 0.00 0.00 173.10 172.53 1hly h ILE 23 N 2.00 0.00 -0.55 0.90 2.04 -1.90 -3.38 117.51 116.62 1hly h ILE 23 Ca -0.24 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1hly h ILE 23 Cb 1.20 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1hly h ILE 23 CO 0.27 0.00 0.00 -1.14 0.00 0.00 0.00 178.15 177.28 1hly n ARG 24 N -4.86 2.85 -1.73 2.37 0.63 -1.26 -5.01 116.66 109.66 1hly n ARG 24 Ca -0.07 -2.41 -0.39 0.00 -0.92 0.00 0.00 57.85 54.07 1hly n ARG 24 Cb 0.21 -1.46 0.04 0.00 0.45 0.00 0.00 32.46 31.71 1hly n ARG 24 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1hly n ALA 25 N 1.08 1.43 -2.29 5.13 0.00 -1.26 -4.92 120.51 119.68 1hly n ALA 25 Ca 0.19 0.13 -0.18 0.00 0.00 0.00 0.00 53.44 53.57 1hly n ALA 25 Cb 0.55 -2.33 -0.00 0.00 0.00 0.00 0.00 19.45 17.68 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 -0.91 1.77 -0.28 0.00 0.00 -0.01 -4.86 107.32 103.03 1hly s GLY 26 Ca 0.71 -1.58 -0.14 0.00 0.00 0.00 0.00 44.72 43.72 1hly s GLY 26 CO 0.50 -1.45 0.65 0.00 0.00 0.00 0.00 173.10 172.80 1hly s ALA 27 N -2.27 -1.85 0.29 3.20 0.00 -1.26 0.14 121.76 120.02 1hly s ALA 27 Ca 0.49 2.32 -0.10 0.00 0.00 0.00 0.00 51.96 54.67 1hly s ALA 27 Cb -0.09 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.55 1hly s ALA 27 CO 0.31 -0.53 0.50 -1.59 0.00 0.00 0.00 175.76 174.46 1hly s LYS 28 N 1.99 1.72 -0.11 0.00 0.00 -0.33 -4.84 119.74 118.17 1hly s LYS 28 Ca -0.09 -1.43 -0.06 0.00 0.00 0.00 0.00 55.97 54.40 1hly s LYS 28 Cb -0.07 0.48 -0.04 0.00 0.00 0.00 0.00 37.83 38.19 1hly s LYS 28 CO -0.19 -0.73 0.11 0.00 0.00 0.00 0.00 175.35 174.54 1hly s MET 30 N -0.99 0.74 -1.61 0.00 0.00 -0.30 -4.93 119.30 112.22 1hly s MET 30 Ca 0.15 0.43 0.00 0.00 0.00 0.00 0.00 55.69 56.27 1hly s MET 30 Cb -0.12 0.35 0.00 0.00 0.00 0.00 0.00 34.83 35.07 1hly s MET 30 CO 0.04 -0.18 0.00 -1.71 0.00 0.00 0.00 175.02 173.17 1hly n ASN 31 N 1.47 -5.24 -0.66 1.11 2.85 -1.26 -1.55 115.26 111.97 1hly n ASN 31 Ca -0.14 0.07 -0.09 0.00 -0.11 0.00 0.00 54.58 54.31 1hly n ASN 31 Cb 0.57 -4.32 -0.04 0.00 1.24 0.00 0.00 39.78 37.23 1hly n ASN 31 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1hly n GLY 32 N -0.97 0.94 3.33 8.20 0.00 -1.26 -4.98 105.19 110.46 1hly n GLY 32 Ca -0.21 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.49 1.10 0.66 1.61 -2.85 -0.60 -0.65 119.74 116.53 1hly s LYS 33 Ca 0.00 -0.98 -0.17 0.00 -1.00 0.00 0.00 55.97 53.82 1hly s LYS 33 Cb 0.00 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.18 1hly s LYS 33 CO 0.00 -0.41 1.20 0.00 0.10 0.00 0.00 175.35 176.24 1hly s LYS 35 N -3.67 0.72 -0.05 0.00 -0.14 0.10 -3.39 119.74 113.31 1hly s LYS 35 Ca 0.75 -1.49 -0.29 0.00 -1.36 0.00 0.00 55.97 53.58 1hly s LYS 35 Cb -0.29 -1.14 -0.02 0.00 -1.68 0.00 0.00 37.83 34.70 1hly s LYS 35 CO 0.39 -1.28 0.95 0.00 -0.76 0.00 0.00 175.35 174.66 1hly s TYR 37 N 1.35 3.50 -1.41 0.00 1.51 0.12 -4.75 117.35 117.68 1hly s TYR 37 Ca 0.49 -2.41 -0.14 0.00 -1.01 0.00 0.00 57.07 54.00 1hly s TYR 37 Cb -0.20 -3.30 -0.01 0.00 -0.11 0.00 0.00 41.96 38.34 1hly s TYR 37 CO 0.23 -0.93 2.37 -0.35 -1.11 0.00 0.00 175.55 175.76 1hly n PRO 38 N 4.18 2.88 0.00 -1.71 -0.04 -1.26 -0.83 135.00 138.22 1hly n PRO 38 Ca 0.02 -2.39 0.00 0.00 -0.04 0.00 0.00 63.50 61.09 1hly n PRO 38 Cb 0.40 -3.11 0.00 0.00 -0.04 0.00 0.00 33.50 30.75 1hly n PRO 38 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04