#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 6.38 0.66 -5.58 2.47 -1.26 -4.93 114.94 112.69 1hdl s ASN 2 Ca 0.00 0.45 0.34 0.00 0.42 0.00 0.00 52.86 54.07 1hdl s ASN 2 Cb 0.00 -2.24 1.86 0.00 -1.45 0.00 0.00 41.25 39.42 1hdl s ASN 2 CO 0.00 -0.15 2.05 -0.33 -3.72 0.00 0.00 177.10 174.95 1hdl h GLU 3 N 7.75 0.00 -0.01 0.43 5.08 -1.94 0.40 114.58 126.29 1hdl h GLU 3 Ca -0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1hdl h GLU 3 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1hdl h GLU 3 CO 0.69 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 178.45 1hdl n ASP 4 N -2.98 0.05 -0.02 1.42 8.00 -1.26 -0.54 116.55 121.21 1hdl n ASP 4 Ca -0.02 -1.54 -0.02 0.00 0.71 0.00 0.00 54.79 53.92 1hdl n ASP 4 Cb 0.30 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.36 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 -0.70 3.39 -0.49 -1.24 6.02 0.14 -4.69 117.38 119.81 1hdl n GLN 5 Ca 0.11 -0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.17 1hdl n GLN 5 Cb 0.06 -1.09 0.13 0.00 1.02 0.00 0.00 30.24 30.35 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 -2.14 1.05 -0.96 -1.09 1.02 -1.17 -5.08 120.64 112.27 1hdl n GLU 6 Ca -0.06 -2.54 -0.37 0.00 -0.02 0.00 0.00 57.16 54.17 1hdl n GLU 6 Cb 0.62 -1.21 0.05 0.00 -0.02 0.00 0.00 31.44 30.88 1hdl n GLU 6 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1hdl n MET 7 N -0.88 -0.14 -3.42 3.49 0.00 0.29 -4.96 117.12 111.51 1hdl n MET 7 Ca 0.14 -0.04 -0.21 0.00 0.00 0.00 0.00 57.70 57.59 1hdl n MET 7 Cb 0.73 -1.10 -0.10 0.00 0.00 0.00 0.00 33.22 32.75 1hdl n MET 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1hdl h HIS 9 N 7.79 0.00 -0.18 0.00 3.86 -2.00 -3.18 115.15 121.44 1hdl h HIS 9 Ca -0.07 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.07 1hdl h HIS 9 Cb 1.04 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.50 1hdl h HIS 9 CO 0.31 0.00 -0.23 0.93 0.86 0.00 0.00 177.93 179.81 1hdl h GLU 10 N 0.00 0.32 0.00 2.45 5.08 -2.02 -2.94 114.58 117.47 1hdl h GLU 10 Ca 0.00 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1hdl h GLU 10 Cb 0.82 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1hdl h GLU 10 CO 0.00 0.54 -1.38 1.19 -1.00 0.00 0.00 179.01 178.35 1hdl n PHE 11 N -4.17 0.22 -0.12 4.33 3.01 -1.25 -4.21 117.46 115.28 1hdl n PHE 11 Ca -0.01 0.06 0.27 0.00 1.01 0.00 0.00 57.45 58.79 1hdl n PHE 11 Cb 0.36 -0.47 0.63 0.00 -0.01 0.00 0.00 39.48 39.99 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 0.00 0.00 0.00 -1.08 4.15 -1.49 2.04 115.11 118.73 1hdl h GLN 12 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 1hdl h GLN 12 Cb 0.83 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.52 1hdl h GLN 12 CO 0.00 0.00 -0.17 0.00 -1.93 0.00 0.00 178.83 176.73 1hdl h ALA 13 N 1.07 0.97 -0.32 3.38 0.00 -1.73 -2.83 119.26 119.80 1hdl h ALA 13 Ca 0.39 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1hdl h ALA 13 Cb 2.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.86 1hdl h ALA 13 CO -0.00 0.21 0.00 1.19 0.00 0.00 0.00 179.25 180.64 1hdl n PHE 14 N -3.24 0.96 -3.52 0.00 3.72 0.69 -4.83 117.46 111.24 1hdl n PHE 14 Ca 0.01 -0.35 -0.39 0.00 -0.05 0.00 0.00 57.45 56.67 1hdl n PHE 14 Cb 0.46 -0.25 -0.10 0.00 -0.94 0.00 0.00 39.48 38.65 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 -1.82 3.80 -0.99 -1.08 0.23 -1.07 -2.35 119.30 116.01 1hdl s MET 15 Ca 0.28 -0.36 -0.13 0.00 -1.03 0.00 0.00 55.69 54.45 1hdl s MET 15 Cb 0.20 -3.72 0.22 0.00 -1.53 0.00 0.00 34.83 30.00 1hdl s MET 15 CO 0.10 -0.31 1.03 0.21 -2.03 0.00 0.00 175.02 174.03 1hdl s LYS 16 N 1.83 3.87 -1.15 3.16 2.20 0.73 -4.59 119.74 125.79 1hdl s LYS 16 Ca 0.09 -2.62 -0.03 0.00 -0.36 0.00 0.00 55.97 53.05 1hdl s LYS 16 Cb -0.16 -4.64 -0.03 0.00 -1.51 0.00 0.00 37.83 31.49 1hdl s LYS 16 CO 0.11 -1.42 0.93 0.09 -0.36 0.00 0.00 175.35 174.71 1hdl n ASN 17 N 4.20 -3.74 0.00 1.43 3.02 -1.26 -2.10 115.26 116.81 1hdl n ASN 17 Ca 0.22 -0.69 0.00 0.00 -0.03 0.00 0.00 54.58 54.08 1hdl n ASN 17 Cb 0.44 -4.99 0.00 0.00 -0.61 0.00 0.00 39.78 34.62 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 -1.23 2.58 3.72 7.41 0.00 -1.26 -5.02 105.19 111.39 1hdl n GLY 18 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.52 4.32 -0.34 1.61 2.36 -0.89 -5.05 119.74 121.22 1hdl s LYS 19 Ca 0.00 0.37 -0.07 0.00 -2.55 0.00 0.00 55.97 53.72 1hdl s LYS 19 Cb 0.00 -3.44 0.04 0.00 -1.05 0.00 0.00 37.83 33.37 1hdl s LYS 19 CO 0.00 0.15 0.11 -1.17 1.55 0.00 0.00 175.35 176.00 1hdl s LEU 20 N 0.66 4.34 -1.13 5.43 0.20 -1.26 0.26 118.68 127.18 1hdl s LEU 20 Ca 0.24 -1.11 -0.04 0.00 0.69 0.00 0.00 54.13 53.91 1hdl s LEU 20 Cb -0.15 -1.88 0.26 0.00 -0.43 0.00 0.00 46.19 43.99 1hdl s LEU 20 CO 0.09 -0.33 1.87 2.22 -0.29 0.00 0.00 176.35 179.91 1hdl n PHE 21 N 4.83 2.61 -0.22 5.38 1.16 -0.99 -4.80 117.46 125.43 1hdl n PHE 21 Ca -0.12 -2.64 0.03 0.00 -1.87 0.00 0.00 57.45 52.84 1hdl n PHE 21 Cb 0.45 -1.42 0.14 0.00 -1.61 0.00 0.00 39.48 37.04 1hdl n PHE 21 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1hdl n PRO 23 N -5.09 0.90 0.00 0.00 -0.02 -1.26 -4.67 135.00 124.86 1hdl n PRO 23 Ca 0.11 -2.06 0.00 0.00 -2.02 0.00 0.00 63.50 59.53 1hdl n PRO 23 Cb 0.36 -3.74 0.00 0.00 -0.02 0.00 0.00 33.50 30.11 1hdl n PRO 23 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hdl n GLN 24 N 8.14 0.00 -2.55 -0.52 10.64 -1.25 -4.96 117.38 126.89 1hdl n GLN 24 Ca 0.44 0.00 -0.43 0.00 -1.83 0.00 0.00 57.00 55.18 1hdl n GLN 24 Cb 0.46 0.00 0.01 0.00 -0.86 0.00 0.00 30.24 29.85 1hdl n GLN 24 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1hdl n ASP 25 N 0.00 5.74 0.00 2.61 2.03 -1.26 -4.75 116.55 120.92 1hdl n ASP 25 Ca 0.00 -3.23 0.06 0.00 0.52 0.00 0.00 54.79 52.14 1hdl n ASP 25 Cb 0.00 -1.39 0.33 0.00 -0.72 0.00 0.00 41.12 39.34 1hdl n ASP 25 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1hdl n LYS 26 N 2.79 0.25 -0.25 -0.67 5.02 -1.26 -3.51 118.16 120.52 1hdl n LYS 26 Ca 0.36 0.11 0.31 0.00 -2.02 0.00 0.00 58.31 57.08 1hdl n LYS 26 Cb 0.34 -1.50 0.57 0.00 -0.02 0.00 0.00 35.03 34.42 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 -0.53 1.97 1.57 -1.99 0.24 116.57 117.83 1hdl h LYS 27 Ca 0.00 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.93 1hdl h LYS 27 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1hdl h LYS 27 CO 0.00 0.00 0.80 0.74 -0.57 0.00 0.00 179.45 180.42 1hdl h PHE 28 N 0.00 0.00 -0.88 -1.35 0.04 -1.91 -1.10 116.94 111.74 1hdl h PHE 28 Ca 0.52 0.00 0.25 0.00 2.80 0.00 0.00 57.97 61.54 1hdl h PHE 28 Cb 2.73 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 40.84 1hdl h PHE 28 CO 0.00 0.00 1.07 0.35 -0.60 0.00 0.00 178.31 179.13 1hdl h PHE 29 N 0.00 0.00 0.00 -0.55 3.04 -0.74 1.32 116.94 120.01 1hdl h PHE 29 Ca 0.25 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.20 1hdl h PHE 29 Cb 1.84 0.00 0.00 0.00 2.56 0.00 0.00 35.95 40.35 1hdl h PHE 29 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 178.31 176.29 1hdl n GLN 30 N -3.29 0.61 -4.13 1.11 10.64 -0.42 -4.33 117.38 117.57 1hdl n GLN 30 Ca 0.19 0.00 -0.10 0.00 -1.83 0.00 0.00 57.00 55.27 1hdl n GLN 30 Cb 1.34 -1.49 -0.10 0.00 -0.86 0.00 0.00 30.24 29.13 1hdl n GLN 30 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1hdl s SER 31 N -1.99 0.92 0.11 2.61 0.15 0.45 -5.03 113.70 110.92 1hdl s SER 31 Ca 0.29 -0.95 -0.24 0.00 0.70 0.00 0.00 55.95 55.75 1hdl s SER 31 Cb 0.13 0.12 -0.08 0.00 -1.71 0.00 0.00 66.02 64.48 1hdl s SER 31 CO 0.22 -0.47 1.68 0.25 1.20 0.00 0.00 173.24 176.12 1hdl h LEU 32 N 3.20 -0.39 -1.44 3.45 6.46 -1.85 0.32 115.31 125.05 1hdl h LEU 32 Ca -0.35 0.06 0.16 0.00 -0.12 0.00 0.00 57.88 57.63 1hdl h LEU 32 Cb 1.16 0.17 -0.06 0.00 -0.73 0.00 0.00 40.66 41.19 1hdl h LEU 32 CO 0.62 -0.19 0.56 -0.78 -0.62 0.00 0.00 178.44 178.03 1hdl h ASP 33 N -0.23 0.50 0.10 1.25 1.82 -1.97 0.27 116.42 118.15 1hdl h ASP 33 Ca 0.04 0.04 -0.00 0.00 -0.39 0.00 0.00 57.03 56.72 1hdl h ASP 33 Cb 0.29 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.24 1hdl h ASP 33 CO -0.13 0.24 -0.05 1.23 -1.61 0.00 0.00 179.24 178.93 1hdl h GLY 34 N 0.52 -0.14 0.67 -0.78 0.00 -1.21 -0.59 103.07 101.55 1hdl h GLY 34 Ca 0.43 0.05 0.18 0.00 0.00 0.00 0.00 47.33 47.99 1hdl h GLY 34 CO -0.17 -0.05 0.48 -2.22 0.00 0.00 0.00 176.54 174.58 1hdl h ILE 35 N -0.67 0.71 0.10 2.60 1.08 0.94 0.88 117.51 123.15 1hdl h ILE 35 Ca -0.01 -0.05 -0.00 0.00 -0.39 0.00 0.00 64.86 64.41 1hdl h ILE 35 Cb 0.53 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 34.84 1hdl h ILE 35 CO 0.02 0.02 -0.05 0.24 -0.69 0.00 0.00 178.15 177.70 1hdl h MET 36 N 0.14 -0.13 -0.73 2.37 2.86 -0.30 -2.61 114.93 116.53 1hdl h MET 36 Ca 0.33 0.01 0.15 0.00 -2.06 0.00 0.00 59.70 58.13 1hdl h MET 36 Cb 1.13 0.03 -0.14 0.00 0.06 0.00 0.00 31.60 32.68 1hdl h MET 36 CO -0.05 -0.09 -0.16 0.35 1.06 0.00 0.00 176.91 178.03 1hdl h PHE 37 N -0.38 -0.34 -0.96 -0.22 3.04 -0.84 1.12 116.94 118.35 1hdl h PHE 37 Ca -0.01 0.06 0.19 0.00 3.98 0.00 0.00 57.97 62.19 1hdl h PHE 37 Cb 0.10 0.26 -0.09 0.00 2.56 0.00 0.00 35.95 38.79 1hdl h PHE 37 CO 0.04 -0.30 0.61 0.82 -2.02 0.00 0.00 178.31 177.46 1hdl h ILE 38 N 0.01 0.71 -0.28 1.41 2.04 -0.93 1.94 117.51 122.41 1hdl h ILE 38 Ca 0.36 -0.21 -0.15 0.00 1.00 0.00 0.00 64.86 65.85 1hdl h ILE 38 Cb 0.55 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1hdl h ILE 38 CO -0.73 0.11 -0.44 0.78 0.00 0.00 0.00 178.15 177.86 1hdl h ASN 39 N 0.62 0.78 1.47 1.72 2.35 0.16 -2.86 115.58 119.83 1hdl h ASN 39 Ca 0.52 -0.37 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1hdl h ASN 39 Cb 0.99 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.14 1hdl h ASN 39 CO -0.27 1.11 -0.31 0.11 -1.65 0.00 0.00 177.43 176.42 1hdl h LYS 40 N 0.58 0.00 0.00 0.81 1.57 0.12 -3.29 116.57 116.36 1hdl h LYS 40 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1hdl h LYS 40 Cb 1.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1hdl h LYS 40 CO 0.09 0.00 -0.10 0.00 -0.57 0.00 0.00 179.45 178.87 1hdl h ALA 42 N -1.30 1.43 -0.32 0.00 0.00 -1.73 -0.93 119.26 116.41 1hdl h ALA 42 Ca 0.00 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 1hdl h ALA 42 Cb 0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1hdl h ALA 42 CO -0.07 0.40 -0.37 1.15 0.00 0.00 0.00 179.25 180.36 1hdl h THR 43 N 0.30 1.29 0.00 0.00 2.02 -1.48 -2.85 112.91 112.18 1hdl h THR 43 Ca 0.06 -1.54 -0.17 0.00 0.77 0.00 0.00 66.41 65.53 1hdl h THR 43 Cb 0.41 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 1hdl h THR 43 CO 0.02 0.50 -0.81 0.00 0.37 0.00 0.00 175.52 175.61 1hdl h LYS 45 N 0.00 0.70 0.00 0.00 3.64 -1.02 -1.95 116.57 117.94 1hdl h LYS 45 Ca -0.01 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.24 1hdl h LYS 45 Cb 1.46 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 33.15 1hdl h LYS 45 CO 0.11 0.61 -0.10 0.00 -2.27 0.00 0.00 179.45 177.79 1hdl h MET 46 N 0.63 0.00 -0.80 1.90 -0.00 -1.53 -2.45 114.93 112.67 1hdl h MET 46 Ca 0.16 0.00 0.06 0.00 -0.00 0.00 0.00 59.70 59.92 1hdl h MET 46 Cb 0.16 0.00 -0.06 0.00 -0.00 0.00 0.00 31.60 31.70 1hdl h MET 46 CO -0.02 0.10 0.49 0.82 -0.00 0.00 0.00 176.91 178.30 1hdl h ILE 47 N 0.00 1.03 -0.35 -0.10 1.08 -1.37 -0.83 117.51 116.97 1hdl h ILE 47 Ca -0.00 -0.31 -0.16 0.00 -0.39 0.00 0.00 64.86 64.00 1hdl h ILE 47 Cb 0.27 0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.07 1hdl h ILE 47 CO 0.01 0.16 -0.42 -0.07 -0.69 0.00 0.00 178.15 177.15 1hdl h LEU 48 N 0.90 0.96 -1.82 1.44 -0.00 -1.48 -2.88 115.31 112.42 1hdl h LEU 48 Ca 0.35 -0.45 -0.03 0.00 -0.00 0.00 0.00 57.88 57.75 1hdl h LEU 48 Cb 0.16 -0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 40.55 1hdl h LEU 48 CO -0.17 1.24 -0.13 -0.33 -0.00 0.00 0.00 178.44 179.06 1hdl h GLU 49 N 0.72 0.00 -0.06 1.13 4.39 -1.30 -2.71 114.58 116.74 1hdl h GLU 49 Ca 0.05 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.76 1hdl h GLU 49 Cb 1.01 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 1hdl h GLU 49 CO 0.10 0.13 0.02 0.87 -1.16 0.00 0.00 179.01 178.96 1hdl h LYS 50 N 0.00 0.04 0.00 2.33 1.57 -0.95 -1.62 116.57 117.94 1hdl h LYS 50 Ca -0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1hdl h LYS 50 Cb 0.24 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1hdl h LYS 50 CO 0.02 0.03 0.00 1.05 -0.57 0.00 0.00 179.45 179.98 1hdl h GLU 51 N 0.04 0.00 0.00 3.15 4.11 -1.56 -2.50 114.58 117.83 1hdl h GLU 51 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 1hdl h GLU 51 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1hdl h GLU 51 CO -0.03 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.05 1hdl h ALA 52 N 2.02 1.00 0.19 1.06 0.00 -1.04 -2.76 119.26 119.72 1hdl h ALA 52 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.59 1hdl h ALA 52 Cb 0.45 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.26 1hdl h ALA 52 CO 0.00 0.00 -1.51 0.87 0.00 0.00 0.00 179.25 178.61 1hdl h LYS 53 N 0.00 0.40 0.00 0.00 1.57 -1.41 -3.24 116.57 113.88 1hdl h LYS 53 Ca 0.00 -0.68 0.00 0.00 -1.87 0.00 0.00 60.65 58.10 1hdl h LYS 53 Cb 0.32 0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1hdl h LYS 53 CO 0.00 1.30 0.00 0.66 -0.57 0.00 0.00 179.45 180.84 1hdl h SER 54 N 0.11 0.00 -0.01 0.86 4.64 -1.62 -3.53 113.55 114.01 1hdl h SER 54 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1hdl h SER 54 Cb 2.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.18 1hdl h SER 54 CO 0.22 0.00 0.00 1.67 -0.87 0.00 0.00 176.83 177.85