#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hdl s ASN 2 N 0.00 2.90 0.50 3.14 2.47 -1.26 -5.00 114.94 117.70 1hdl s ASN 2 Ca 0.00 -0.54 0.15 0.00 0.42 0.00 0.00 52.86 52.90 1hdl s ASN 2 Cb 0.00 -1.33 1.20 0.00 -1.45 0.00 0.00 41.25 39.67 1hdl s ASN 2 CO 0.00 0.10 2.11 -0.33 -3.72 0.00 0.00 177.10 175.26 1hdl h GLU 3 N 7.04 0.12 0.00 0.43 5.08 -1.98 0.17 114.58 125.43 1hdl h GLU 3 Ca -0.26 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1hdl h GLU 3 Cb 1.21 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1hdl h GLU 3 CO 0.50 0.08 0.00 -0.25 -1.00 0.00 0.00 179.01 178.34 1hdl n ASP 4 N -4.51 0.27 -0.08 1.42 8.00 -1.26 0.54 116.55 120.93 1hdl n ASP 4 Ca 0.00 0.58 -0.22 0.00 0.71 0.00 0.00 54.79 55.86 1hdl n ASP 4 Cb 0.16 -0.63 -0.12 0.00 -0.02 0.00 0.00 41.12 40.50 1hdl n ASP 4 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hdl n GLN 5 N -1.81 0.66 0.02 -1.24 6.02 0.55 -4.18 117.38 117.40 1hdl n GLN 5 Ca 0.02 0.30 0.13 0.00 -0.01 0.00 0.00 57.00 57.44 1hdl n GLN 5 Cb 0.15 -1.63 0.44 0.00 1.02 0.00 0.00 30.24 30.22 1hdl n GLN 5 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1hdl n GLU 6 N -3.76 0.06 0.00 -1.09 1.02 -1.05 -5.02 120.64 110.80 1hdl n GLU 6 Ca -0.40 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 56.77 1hdl n GLU 6 Cb 0.93 -1.55 0.00 0.00 -0.02 0.00 0.00 31.44 30.79 1hdl n GLU 6 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1hdl n MET 7 N -1.65 0.00 -3.84 3.49 2.81 0.19 -4.73 117.12 113.39 1hdl n MET 7 Ca 0.06 0.00 -0.24 0.00 -1.81 0.00 0.00 57.70 55.71 1hdl n MET 7 Cb 0.36 0.00 -0.17 0.00 -0.71 0.00 0.00 33.22 32.70 1hdl n MET 7 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1hdl n HIS 9 N 5.01 0.00 -0.13 0.00 8.25 -1.26 -4.34 115.22 122.75 1hdl n HIS 9 Ca -0.10 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.30 1hdl n HIS 9 Cb 0.50 -0.09 0.02 0.00 1.12 0.00 0.00 29.99 31.54 1hdl n HIS 9 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1hdl h GLU 10 N 0.00 0.42 -0.00 -0.41 4.81 -1.99 -1.99 114.58 115.41 1hdl h GLU 10 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1hdl h GLU 10 Cb 0.23 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1hdl h GLU 10 CO 0.00 0.28 -0.30 1.19 -0.73 0.00 0.00 179.01 179.45 1hdl n PHE 11 N -4.90 0.00 -0.29 0.92 3.01 -1.26 -4.22 117.46 110.71 1hdl n PHE 11 Ca 0.02 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.56 1hdl n PHE 11 Cb 0.09 -0.21 0.19 0.00 -0.01 0.00 0.00 39.48 39.54 1hdl n PHE 11 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 1hdl h GLN 12 N 0.54 0.07 0.00 -1.08 4.15 -1.55 2.07 115.11 119.30 1hdl h GLN 12 Ca 0.00 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1hdl h GLN 12 Cb 0.47 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.15 1hdl h GLN 12 CO 0.00 0.05 0.10 0.00 -1.93 0.00 0.00 178.83 177.04 1hdl h ALA 13 N 1.81 1.08 -0.36 3.38 0.00 -1.73 0.15 119.26 123.60 1hdl h ALA 13 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1hdl h ALA 13 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1hdl h ALA 13 CO -0.77 -0.08 0.00 1.19 0.00 0.00 0.00 179.25 179.59 1hdl n PHE 14 N -2.62 0.70 -3.62 0.00 3.72 0.70 -4.83 117.46 111.52 1hdl n PHE 14 Ca -0.02 -0.30 -0.38 0.00 -0.05 0.00 0.00 57.45 56.70 1hdl n PHE 14 Cb 0.14 -0.11 -0.11 0.00 -0.94 0.00 0.00 39.48 38.47 1hdl n PHE 14 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1hdl s MET 15 N -1.63 3.80 -1.00 -1.08 0.23 0.54 -2.25 119.30 117.90 1hdl s MET 15 Ca 0.26 -0.41 -0.13 0.00 -1.03 0.00 0.00 55.69 54.38 1hdl s MET 15 Cb 0.16 -3.61 0.22 0.00 -1.53 0.00 0.00 34.83 30.08 1hdl s MET 15 CO 0.14 -0.23 1.03 0.21 -2.03 0.00 0.00 175.02 174.15 1hdl s LYS 16 N 1.72 3.90 -1.14 3.16 2.47 0.74 -4.60 119.74 125.99 1hdl s LYS 16 Ca 0.07 -2.69 -0.04 0.00 -1.56 0.00 0.00 55.97 51.75 1hdl s LYS 16 Cb -0.16 -4.62 -0.03 0.00 -1.46 0.00 0.00 37.83 31.56 1hdl s LYS 16 CO 0.09 -1.39 0.93 0.09 0.16 0.00 0.00 175.35 175.22 1hdl n ASN 17 N 4.02 -4.07 0.00 1.43 3.02 -1.26 -2.14 115.26 116.26 1hdl n ASN 17 Ca 0.22 -0.70 0.00 0.00 -0.03 0.00 0.00 54.58 54.07 1hdl n ASN 17 Cb 0.44 -4.97 0.00 0.00 -0.61 0.00 0.00 39.78 34.64 1hdl n ASN 17 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hdl n GLY 18 N -1.25 2.39 3.71 7.41 0.00 -1.26 -5.02 105.19 111.17 1hdl n GLY 18 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 1hdl n GLY 18 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hdl s LYS 19 N -0.51 4.25 -0.28 1.61 2.36 -0.91 -5.06 119.74 121.20 1hdl s LYS 19 Ca 0.00 0.20 -0.06 0.00 -2.55 0.00 0.00 55.97 53.56 1hdl s LYS 19 Cb 0.00 -3.46 0.00 0.00 -1.05 0.00 0.00 37.83 33.32 1hdl s LYS 19 CO 0.00 0.13 0.06 -1.17 1.55 0.00 0.00 175.35 175.92 1hdl s LEU 20 N 0.77 3.64 -1.00 5.43 2.96 -1.26 0.26 118.68 129.48 1hdl s LEU 20 Ca 0.19 -0.61 -0.02 0.00 -0.22 0.00 0.00 54.13 53.47 1hdl s LEU 20 Cb -0.14 -1.86 0.30 0.00 0.50 0.00 0.00 46.19 44.99 1hdl s LEU 20 CO 0.06 -0.15 1.37 2.22 -1.32 0.00 0.00 176.35 178.54 1hdl n PHE 21 N 4.85 2.49 -0.12 5.38 -1.74 -0.96 -4.85 117.46 122.52 1hdl n PHE 21 Ca -0.15 -2.84 -0.05 0.00 -0.56 0.00 0.00 57.45 53.85 1hdl n PHE 21 Cb 0.49 -1.13 0.03 0.00 1.52 0.00 0.00 39.48 40.39 1hdl n PHE 21 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1hdl s PRO 23 N -6.15 1.57 0.00 0.00 0.02 -1.26 -4.48 135.00 124.70 1hdl s PRO 23 Ca -0.13 -0.25 0.00 0.00 0.02 0.00 0.00 61.00 60.64 1hdl s PRO 23 Cb 0.13 -4.96 0.00 0.00 0.02 0.00 0.00 34.50 29.69 1hdl s PRO 23 CO 0.72 -4.84 0.00 0.94 -0.33 0.00 0.00 177.00 173.48 1hdl n GLN 24 N 8.43 0.00 -3.42 5.54 7.27 -1.26 -5.02 117.38 128.92 1hdl n GLN 24 Ca 0.43 0.00 -0.26 0.00 0.07 0.00 0.00 57.00 57.24 1hdl n GLN 24 Cb 0.46 0.00 -0.09 0.00 2.41 0.00 0.00 30.24 33.01 1hdl n GLN 24 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1hdl n ASP 25 N -1.19 0.54 0.00 1.69 -0.08 -1.26 -4.93 116.55 111.31 1hdl n ASP 25 Ca 0.00 -2.66 0.07 0.00 -1.51 0.00 0.00 54.79 50.69 1hdl n ASP 25 Cb 0.00 -0.61 0.42 0.00 2.34 0.00 0.00 41.12 43.26 1hdl n ASP 25 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1hdl n LYS 26 N 2.20 0.36 -0.41 -0.67 5.02 -1.26 -3.62 118.16 119.78 1hdl n LYS 26 Ca 0.26 0.07 0.39 0.00 -2.02 0.00 0.00 58.31 57.01 1hdl n LYS 26 Cb 0.47 -1.50 0.66 0.00 -0.02 0.00 0.00 35.03 34.64 1hdl n LYS 26 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1hdl h LYS 27 N 0.00 0.00 -0.47 1.97 1.79 -1.97 0.37 116.57 118.26 1hdl h LYS 27 Ca 0.00 0.00 0.14 0.00 -2.18 0.00 0.00 60.65 58.61 1hdl h LYS 27 Cb 0.06 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.69 1hdl h LYS 27 CO 0.00 0.00 0.77 0.74 -1.08 0.00 0.00 179.45 179.88 1hdl h PHE 28 N 0.00 0.00 0.00 -1.35 0.04 -1.87 0.71 116.94 114.47 1hdl h PHE 28 Ca 0.66 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.43 1hdl h PHE 28 Cb 3.05 0.00 0.00 0.00 2.20 0.00 0.00 35.95 41.20 1hdl h PHE 28 CO 0.00 0.00 0.50 0.35 -0.60 0.00 0.00 178.31 178.56 1hdl h PHE 29 N 0.00 0.00 0.00 -0.55 3.04 -0.42 0.17 116.94 119.18 1hdl h PHE 29 Ca 0.22 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.17 1hdl h PHE 29 Cb 1.75 0.00 0.00 0.00 2.56 0.00 0.00 35.95 40.26 1hdl h PHE 29 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 178.31 177.33 1hdl n GLN 30 N -2.70 0.02 -4.07 1.11 6.02 0.24 -4.49 117.38 113.50 1hdl n GLN 30 Ca -0.01 0.37 -0.09 0.00 -0.01 0.00 0.00 57.00 57.26 1hdl n GLN 30 Cb 0.53 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.20 1hdl n GLN 30 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1hdl s SER 31 N -2.89 0.30 0.07 1.08 0.01 0.58 -5.02 113.70 107.83 1hdl s SER 31 Ca 0.03 -1.04 -0.31 0.00 1.31 0.00 0.00 55.95 55.95 1hdl s SER 31 Cb 0.03 0.29 -0.18 0.00 0.21 0.00 0.00 66.02 66.38 1hdl s SER 31 CO 0.09 -0.72 1.61 0.25 0.41 0.00 0.00 173.24 174.89 1hdl h LEU 32 N 2.88 -0.60 -1.16 2.44 6.46 -1.84 1.03 115.31 124.53 1hdl h LEU 32 Ca -0.34 0.01 0.18 0.00 -0.12 0.00 0.00 57.88 57.60 1hdl h LEU 32 Cb 1.19 0.16 -0.09 0.00 -0.73 0.00 0.00 40.66 41.18 1hdl h LEU 32 CO 0.59 -0.41 0.61 0.44 -0.62 0.00 0.00 178.44 179.05 1hdl h ASP 33 N -0.74 0.71 -0.18 1.25 3.32 -1.97 0.28 116.42 119.09 1hdl h ASP 33 Ca -0.07 0.07 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 1hdl h ASP 33 Cb 0.56 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1hdl h ASP 33 CO 0.12 0.29 -0.47 1.23 -1.72 0.00 0.00 179.24 178.69 1hdl h GLY 34 N 0.71 0.69 1.14 2.75 0.00 -1.50 -2.91 103.07 103.95 1hdl h GLY 34 Ca 0.53 -0.87 0.08 0.00 0.00 0.00 0.00 47.33 47.07 1hdl h GLY 34 CO -0.30 0.78 0.38 -2.22 0.00 0.00 0.00 176.54 175.18 1hdl h ILE 35 N 0.30 0.93 1.01 2.60 1.08 0.43 -2.69 117.51 121.17 1hdl h ILE 35 Ca -0.01 -0.15 -0.05 0.00 -0.39 0.00 0.00 64.86 64.26 1hdl h ILE 35 Cb 1.09 0.46 0.01 0.00 -3.07 0.00 0.00 36.82 35.31 1hdl h ILE 35 CO 0.10 0.08 -0.49 0.24 -0.69 0.00 0.00 178.15 177.40 1hdl h MET 36 N 0.43 -1.31 -0.79 2.37 2.86 -0.43 -2.12 114.93 115.95 1hdl h MET 36 Ca 0.26 0.09 0.14 0.00 -2.06 0.00 0.00 59.70 58.12 1hdl h MET 36 Cb 0.44 0.30 -0.14 0.00 0.06 0.00 0.00 31.60 32.25 1hdl h MET 36 CO -0.07 -0.87 -0.31 0.35 1.06 0.00 0.00 176.91 177.07 1hdl h PHE 37 N -1.36 -0.81 -0.96 -0.22 3.04 -1.46 1.19 116.94 116.36 1hdl h PHE 37 Ca -0.14 0.08 0.18 0.00 3.98 0.00 0.00 57.97 62.07 1hdl h PHE 37 Cb 1.04 0.47 -0.09 0.00 2.56 0.00 0.00 35.95 39.94 1hdl h PHE 37 CO 0.00 -0.38 0.61 0.82 -2.02 0.00 0.00 178.31 177.34 1hdl h ILE 38 N -0.06 0.74 0.00 1.41 2.04 -1.39 2.17 117.51 122.42 1hdl h ILE 38 Ca 0.32 -0.23 -0.08 0.00 1.00 0.00 0.00 64.86 65.87 1hdl h ILE 38 Cb 0.58 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1hdl h ILE 38 CO -0.83 0.12 -0.39 0.78 0.00 0.00 0.00 178.15 177.84 1hdl h ASN 39 N 0.67 0.00 0.25 1.72 -0.26 0.20 -3.04 115.58 115.13 1hdl h ASN 39 Ca 0.51 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.25 1hdl h ASN 39 Cb 0.91 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.17 1hdl h ASN 39 CO -0.27 0.39 -1.57 0.29 -1.06 0.00 0.00 177.43 175.20 1hdl n LYS 40 N -3.58 0.53 0.00 0.81 5.02 0.15 -3.93 118.16 117.17 1hdl n LYS 40 Ca -0.00 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1hdl n LYS 40 Cb 0.51 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.93 1hdl n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hdl h ALA 42 N -1.75 1.55 0.00 0.00 0.00 -1.81 -1.38 119.26 115.88 1hdl h ALA 42 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1hdl h ALA 42 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1hdl h ALA 42 CO 0.00 0.25 0.00 1.15 0.00 0.00 0.00 179.25 180.65 1hdl h THR 43 N 0.00 0.00 0.07 0.00 2.02 -1.59 -3.16 112.91 110.25 1hdl h THR 43 Ca -0.00 -0.65 -0.26 0.00 0.77 0.00 0.00 66.41 66.27 1hdl h THR 43 Cb 0.38 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.38 1hdl h THR 43 CO 0.03 0.00 -1.38 0.00 0.37 0.00 0.00 175.52 174.53 1hdl h LYS 45 N -0.51 0.00 0.00 0.00 5.09 -1.46 0.37 116.57 120.06 1hdl h LYS 45 Ca -0.32 0.00 -0.07 0.00 0.09 0.00 0.00 60.65 60.35 1hdl h LYS 45 Cb 1.61 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.93 1hdl h LYS 45 CO -0.03 0.00 -0.34 0.00 -2.09 0.00 0.00 179.45 176.99 1hdl h MET 46 N 0.00 0.00 -0.36 0.07 -0.00 -1.65 -3.25 114.93 109.74 1hdl h MET 46 Ca 0.09 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 59.77 1hdl h MET 46 Cb 0.51 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.10 1hdl h MET 46 CO -0.00 0.34 0.13 0.82 -0.00 0.00 0.00 176.91 178.20 1hdl h ILE 47 N 0.00 1.20 -0.72 -0.10 1.08 -0.31 -2.46 117.51 116.19 1hdl h ILE 47 Ca -0.00 -0.62 0.03 0.00 -0.39 0.00 0.00 64.86 63.88 1hdl h ILE 47 Cb 1.22 0.93 -0.04 0.00 -3.07 0.00 0.00 36.82 35.86 1hdl h ILE 47 CO 0.04 0.22 0.48 -0.07 -0.69 0.00 0.00 178.15 178.13 1hdl h LEU 48 N 0.43 0.76 -1.51 1.44 3.38 -1.58 -0.54 115.31 117.69 1hdl h LEU 48 Ca 0.12 -0.01 0.22 0.00 0.09 0.00 0.00 57.88 58.30 1hdl h LEU 48 Cb 0.21 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1hdl h LEU 48 CO -0.01 0.52 0.87 -0.33 0.09 0.00 0.00 178.44 179.58 1hdl h GLU 49 N 0.88 0.00 0.04 1.13 4.39 -1.50 1.46 114.58 120.98 1hdl h GLU 49 Ca 0.29 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.76 1hdl h GLU 49 Cb 0.05 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 1hdl h GLU 49 CO -0.08 0.00 -1.07 0.87 -1.16 0.00 0.00 179.01 177.57 1hdl h LYS 50 N 0.00 0.09 0.00 2.33 1.79 -1.19 -3.22 116.57 116.37 1hdl h LYS 50 Ca 0.37 -0.15 -0.00 0.00 -2.18 0.00 0.00 60.65 58.68 1hdl h LYS 50 Cb 2.10 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 32.80 1hdl h LYS 50 CO -0.00 1.07 -0.02 0.93 -1.08 0.00 0.00 179.45 180.35 1hdl h GLU 51 N 0.02 0.00 0.00 3.15 5.08 0.20 -0.64 114.58 122.39 1hdl h GLU 51 Ca -0.05 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 1hdl h GLU 51 Cb 1.83 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.07 1hdl h GLU 51 CO 0.15 0.02 -0.27 0.00 -1.00 0.00 0.00 179.01 177.92 1hdl h ALA 52 N 1.98 0.83 0.03 3.43 0.00 -1.54 -3.24 119.26 120.75 1hdl h ALA 52 Ca -0.00 -0.24 -0.22 0.00 0.00 0.00 0.00 54.91 54.45 1hdl h ALA 52 Cb 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1hdl h ALA 52 CO 0.00 0.33 -0.99 0.87 0.00 0.00 0.00 179.25 179.46 1hdl h LYS 53 N 0.00 0.17 0.00 0.00 1.57 -1.22 -3.12 116.57 113.97 1hdl h LYS 53 Ca -0.00 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1hdl h LYS 53 Cb 1.18 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1hdl h LYS 53 CO 0.03 1.02 0.00 0.43 -0.57 0.00 0.00 179.45 180.37 1hdl n SER 54 N -3.56 0.69 -0.76 0.86 7.64 -1.11 -5.15 113.62 112.23 1hdl n SER 54 Ca -0.04 0.61 0.09 0.00 1.01 0.00 0.00 58.87 60.55 1hdl n SER 54 Cb 0.89 -0.78 0.08 0.00 -1.01 0.00 0.00 64.21 63.39 1hdl n SER 54 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70