#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 3.52 0.24 3.14 3.04 -1.26 -4.97 114.94 118.65 1hdl s ASN 2 Ca 0.00 -0.53 0.21 0.00 0.04 0.00 0.00 52.86 52.58 1hdl s ASN 2 Cb 0.00 -1.54 0.96 0.00 -1.54 0.00 0.00 41.25 39.12 1hdl s ASN 2 CO 0.00 0.05 1.64 -0.62 -3.04 0.00 0.00 177.10 175.13 1hdl n GLU 3 N 4.28 0.15 0.00 0.43 -0.58 -1.26 -1.82 120.64 121.85 1hdl n GLU 3 Ca -0.20 0.48 0.10 0.00 -0.42 0.00 0.00 57.16 57.13 1hdl n GLU 3 Cb 0.51 -1.85 0.60 0.00 -0.57 0.00 0.00 31.44 30.14 1hdl n GLU 3 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1hdl n ASP 4 N -2.15 0.00 0.00 1.62 8.00 -1.26 -2.18 116.55 120.58 1hdl n ASP 4 Ca 0.01 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.43 1hdl n ASP 4 Cb 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 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 -0.87 3.19 -3.01 -1.24 1.13 -0.75 -4.85 117.38 110.97 1hdl n GLN 5 Ca 0.15 0.00 -0.17 0.00 -1.94 0.00 0.00 57.00 55.04 1hdl n GLN 5 Cb 0.07 -0.93 -0.02 0.00 0.11 0.00 0.00 30.24 29.48 1hdl n GLN 5 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1hdl n GLU 6 N -1.82 1.35 -0.54 -1.09 -0.58 -1.19 -4.93 120.64 111.84 1hdl n GLU 6 Ca 0.00 -3.55 0.45 0.00 -0.42 0.00 0.00 57.16 53.64 1hdl n GLU 6 Cb 0.43 -1.68 0.76 0.00 -0.57 0.00 0.00 31.44 30.38 1hdl n GLU 6 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 1hdl h MET 7 N 2.98 0.00 -4.49 3.49 2.86 -1.72 -3.29 114.93 114.77 1hdl h MET 7 Ca 0.06 0.00 -0.72 0.00 -2.06 0.00 0.00 59.70 56.98 1hdl h MET 7 Cb 0.97 0.00 -0.23 0.00 0.06 0.00 0.00 31.60 32.40 1hdl h MET 7 CO 0.55 0.00 -0.44 0.00 1.06 0.00 0.00 176.91 178.08 1hdl n HIS 9 N 5.10 0.00 -0.03 0.00 -0.00 -1.24 -4.17 115.22 114.88 1hdl n HIS 9 Ca -0.11 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.45 1hdl n HIS 9 Cb 0.46 -0.01 -0.09 0.00 -0.00 0.00 0.00 29.99 30.35 1hdl n HIS 9 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 1hdl h GLU 10 N 0.00 0.41 0.00 -0.41 5.08 -1.93 -3.23 114.58 114.50 1hdl h GLU 10 Ca 0.00 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1hdl h GLU 10 Cb 0.22 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1hdl h GLU 10 CO 0.00 0.97 -0.42 1.19 -1.00 0.00 0.00 179.01 179.74 1hdl n PHE 11 N -4.35 0.48 -0.31 4.33 3.01 -1.26 -4.04 117.46 115.32 1hdl n PHE 11 Ca -0.08 0.14 0.15 0.00 1.01 0.00 0.00 57.45 58.67 1hdl n PHE 11 Cb 0.54 -0.63 0.32 0.00 -0.01 0.00 0.00 39.48 39.70 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 0.22 0.00 -1.08 4.15 -1.72 2.07 115.11 118.75 1hdl h GLN 12 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1hdl h GLN 12 Cb 0.68 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.32 1hdl h GLN 12 CO 0.00 0.14 0.02 0.00 -1.93 0.00 0.00 178.83 177.07 1hdl h ALA 13 N 1.80 1.02 -0.25 3.38 0.00 -1.76 0.61 119.26 124.06 1hdl h ALA 13 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1hdl h ALA 13 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1hdl h ALA 13 CO -0.65 -0.02 0.00 1.19 0.00 0.00 0.00 179.25 179.76 1hdl n PHE 14 N -2.99 0.60 -3.05 0.00 3.72 0.70 -4.79 117.46 111.65 1hdl n PHE 14 Ca -0.03 -0.24 -0.43 0.00 -0.05 0.00 0.00 57.45 56.70 1hdl n PHE 14 Cb 0.09 -0.13 -0.06 0.00 -0.94 0.00 0.00 39.48 38.44 1hdl n PHE 14 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1hdl s MET 15 N -1.65 3.25 -0.56 -1.08 -1.94 0.21 -0.89 119.30 116.62 1hdl s MET 15 Ca 0.20 -0.51 -0.21 0.00 -1.71 0.00 0.00 55.69 53.47 1hdl s MET 15 Cb 0.13 -4.03 0.07 0.00 2.01 0.00 0.00 34.83 33.01 1hdl s MET 15 CO 0.10 -1.20 0.76 0.21 -0.01 0.00 0.00 175.02 174.87 1hdl s LYS 16 N 3.05 3.14 -1.21 2.03 2.20 0.35 -4.39 119.74 124.91 1hdl s LYS 16 Ca 0.22 -0.88 -0.09 0.00 -0.36 0.00 0.00 55.97 54.86 1hdl s LYS 16 Cb -0.15 -4.16 -0.01 0.00 -1.51 0.00 0.00 37.83 32.00 1hdl s LYS 16 CO 0.17 -1.46 0.75 -1.71 -0.36 0.00 0.00 175.35 172.74 1hdl n ASN 17 N 6.71 -3.55 -1.01 1.43 2.85 -1.26 -0.58 115.26 119.86 1hdl n ASN 17 Ca -0.05 -0.90 -0.13 0.00 -0.11 0.00 0.00 54.58 53.40 1hdl n ASN 17 Cb 0.45 -3.89 -0.05 0.00 1.24 0.00 0.00 39.78 37.53 1hdl n ASN 17 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1hdl n GLY 18 N -1.60 1.20 2.75 8.20 0.00 -1.26 -4.96 105.19 109.51 1hdl n GLY 18 Ca -0.19 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 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 -3.22 0.78 0.03 1.61 2.36 0.26 -5.10 119.74 116.45 1hdl s LYS 19 Ca 0.00 -1.16 -0.30 0.00 -2.55 0.00 0.00 55.97 51.96 1hdl s LYS 19 Cb 0.00 -2.07 -0.06 0.00 -1.05 0.00 0.00 37.83 34.65 1hdl s LYS 19 CO 0.00 -0.99 1.44 -1.17 1.55 0.00 0.00 175.35 176.18 1hdl s LEU 20 N 1.52 4.33 -0.93 5.43 0.20 -1.26 0.13 118.68 128.11 1hdl s LEU 20 Ca 0.10 2.21 -0.04 0.00 0.69 0.00 0.00 54.13 57.09 1hdl s LEU 20 Cb -0.18 -3.56 0.23 0.00 -0.43 0.00 0.00 46.19 42.25 1hdl s LEU 20 CO -0.23 -0.74 0.84 0.72 -0.29 0.00 0.00 176.35 176.65 1hdl s PHE 21 N 2.24 3.95 0.24 5.38 -0.12 -0.07 -4.89 117.98 124.71 1hdl s PHE 21 Ca 0.66 -2.90 -0.05 0.00 -0.05 0.00 0.00 56.93 54.59 1hdl s PHE 21 Cb -0.34 -3.40 0.39 0.00 -0.63 0.00 0.00 43.02 39.05 1hdl s PHE 21 CO 0.28 -0.80 1.78 0.00 -0.05 0.00 0.00 175.22 176.42 1hdl n PRO 23 N -4.86 0.50 0.00 0.00 -0.02 -1.26 -4.44 135.00 124.93 1hdl n PRO 23 Ca 0.13 -1.62 0.00 0.00 -2.02 0.00 0.00 63.50 59.99 1hdl n PRO 23 Cb 0.32 -3.29 0.00 0.00 -0.02 0.00 0.00 33.50 30.50 1hdl n PRO 23 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1hdl n GLN 24 N 7.96 0.00 -3.27 -0.52 7.27 -1.25 -5.01 117.38 122.57 1hdl n GLN 24 Ca 0.45 0.00 -0.25 0.00 0.07 0.00 0.00 57.00 57.27 1hdl n GLN 24 Cb 0.44 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 33.02 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 -0.43 1.65 0.00 1.69 -0.08 -1.26 -4.91 116.55 113.21 1hdl n ASP 25 Ca 0.00 -3.01 0.05 0.00 -1.51 0.00 0.00 54.79 50.31 1hdl n ASP 25 Cb 0.00 -0.65 0.24 0.00 2.34 0.00 0.00 41.12 43.06 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 1.10 0.16 -0.47 -0.67 5.02 -1.26 -3.47 118.16 118.56 1hdl n LYS 26 Ca 0.25 0.17 0.41 0.00 -2.02 0.00 0.00 58.31 57.12 1hdl n LYS 26 Cb 0.49 -1.50 0.65 0.00 -0.02 0.00 0.00 35.03 34.65 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 -0.13 1.97 1.57 -1.98 0.66 116.57 118.66 1hdl h LYS 27 Ca 0.00 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1hdl h LYS 27 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1hdl h LYS 27 CO 0.00 0.00 0.54 0.74 -0.57 0.00 0.00 179.45 180.16 1hdl h PHE 28 N 0.00 0.00 0.00 -1.35 0.04 -1.87 -0.19 116.94 113.58 1hdl h PHE 28 Ca 0.72 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.49 1hdl h PHE 28 Cb 3.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 41.48 1hdl h PHE 28 CO 0.00 0.00 0.42 0.35 -0.60 0.00 0.00 178.31 178.48 1hdl h PHE 29 N 0.00 0.00 0.00 -0.55 3.04 0.15 0.14 116.94 119.72 1hdl h PHE 29 Ca 0.06 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.01 1hdl h PHE 29 Cb 1.13 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.64 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 -2.68 0.16 -3.97 1.11 6.02 -0.08 -4.56 117.38 113.39 1hdl n GLN 30 Ca -0.02 0.18 -0.08 0.00 -0.01 0.00 0.00 57.00 57.07 1hdl n GLN 30 Cb 0.45 -1.50 -0.08 0.00 1.02 0.00 0.00 30.24 30.13 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 -2.56 0.23 0.06 1.08 0.01 0.49 -5.03 113.70 107.97 1hdl s SER 31 Ca 0.11 -0.84 -0.34 0.00 1.31 0.00 0.00 55.95 56.19 1hdl s SER 31 Cb 0.07 0.31 -0.19 0.00 0.21 0.00 0.00 66.02 66.42 1hdl s SER 31 CO 0.17 -0.72 1.53 0.25 0.41 0.00 0.00 173.24 174.89 1hdl h LEU 32 N 2.84 -0.89 -1.27 2.44 7.12 -1.85 1.20 115.31 124.90 1hdl h LEU 32 Ca -0.34 0.02 0.26 0.00 0.13 0.00 0.00 57.88 57.95 1hdl h LEU 32 Cb 1.19 0.23 -0.10 0.00 -0.53 0.00 0.00 40.66 41.45 1hdl h LEU 32 CO 0.58 -0.61 0.65 0.44 -0.13 0.00 0.00 178.44 179.37 1hdl h ASP 33 N -1.10 0.51 -0.09 1.25 3.32 -1.98 0.60 116.42 118.93 1hdl h ASP 33 Ca -0.11 0.10 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 1hdl h ASP 33 Cb 0.81 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.38 1hdl h ASP 33 CO 0.18 0.10 -0.36 1.23 -1.72 0.00 0.00 179.24 178.67 1hdl h GLY 34 N 0.45 0.45 1.09 2.75 0.00 -1.48 -2.93 103.07 103.39 1hdl h GLY 34 Ca 0.61 -0.60 0.11 0.00 0.00 0.00 0.00 47.33 47.44 1hdl h GLY 34 CO -0.34 0.54 0.36 -2.22 0.00 0.00 0.00 176.54 174.88 1hdl h ILE 35 N -0.04 0.85 0.71 2.60 1.08 0.64 -2.55 117.51 120.80 1hdl h ILE 35 Ca -0.02 -0.08 -0.03 0.00 -0.39 0.00 0.00 64.86 64.35 1hdl h ILE 35 Cb 0.99 0.60 -0.00 0.00 -3.07 0.00 0.00 36.82 35.34 1hdl h ILE 35 CO 0.07 0.04 -0.45 0.24 -0.69 0.00 0.00 178.15 177.36 1hdl h MET 36 N 0.22 -1.05 -0.64 2.37 2.86 -0.07 -1.96 114.93 116.67 1hdl h MET 36 Ca 0.24 0.07 0.12 0.00 -2.06 0.00 0.00 59.70 58.08 1hdl h MET 36 Cb 0.66 0.24 -0.12 0.00 0.06 0.00 0.00 31.60 32.44 1hdl h MET 36 CO -0.05 -0.70 -0.25 0.35 1.06 0.00 0.00 176.91 177.32 1hdl h PHE 37 N -1.09 -0.65 -0.94 -0.22 3.04 -1.47 1.05 116.94 116.65 1hdl h PHE 37 Ca -0.09 0.07 0.23 0.00 3.98 0.00 0.00 57.97 62.15 1hdl h PHE 37 Cb 0.88 0.38 -0.07 0.00 2.56 0.00 0.00 35.95 39.70 1hdl h PHE 37 CO -0.10 -0.34 0.63 0.82 -2.02 0.00 0.00 178.31 177.29 1hdl h ILE 38 N -0.08 0.63 0.00 1.41 2.04 -1.39 0.78 117.51 120.88 1hdl h ILE 38 Ca 0.28 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 66.02 1hdl h ILE 38 Cb 0.53 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1hdl h ILE 38 CO -0.69 0.06 -0.26 0.78 0.00 0.00 0.00 178.15 178.04 1hdl h ASN 39 N 0.35 0.00 0.53 1.72 2.35 0.17 -3.31 115.58 117.40 1hdl h ASN 39 Ca 0.49 -0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.98 1hdl h ASN 39 Cb 1.33 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.65 1hdl h ASN 39 CO -0.18 0.00 -1.65 1.17 -1.65 0.00 0.00 177.43 175.13 1hdl n LYS 40 N -2.94 0.63 0.00 0.81 4.81 0.23 -4.00 118.16 117.70 1hdl n LYS 40 Ca 0.03 0.27 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1hdl n LYS 40 Cb 0.53 -1.79 0.00 0.00 0.02 0.00 0.00 35.03 33.79 1hdl n LYS 40 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1hdl h ALA 42 N -1.96 2.81 0.00 0.00 0.00 -1.80 2.47 119.26 120.79 1hdl h ALA 42 Ca 0.00 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1hdl h ALA 42 Cb 0.00 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1hdl h ALA 42 CO 0.00 -1.38 -0.46 1.15 0.00 0.00 0.00 179.25 178.55 1hdl h THR 43 N 0.11 0.81 0.13 0.00 2.02 -1.61 -3.20 112.91 111.16 1hdl h THR 43 Ca 0.78 -2.11 -0.27 0.00 0.77 0.00 0.00 66.41 65.59 1hdl h THR 43 Cb 2.53 2.37 0.00 0.00 -1.74 0.00 0.00 68.15 71.31 1hdl h THR 43 CO -0.33 0.45 -1.36 0.00 0.37 0.00 0.00 175.52 174.65 1hdl h LYS 45 N -0.28 0.39 0.00 0.00 3.64 0.16 0.39 116.57 120.87 1hdl h LYS 45 Ca -0.29 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.07 1hdl h LYS 45 Cb 1.78 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 33.51 1hdl h LYS 45 CO 0.08 0.26 -0.01 0.00 -2.27 0.00 0.00 179.45 177.51 1hdl h MET 46 N 0.40 0.00 -0.78 1.90 -0.00 -1.68 -1.39 114.93 113.38 1hdl h MET 46 Ca 0.38 0.00 0.06 0.00 -0.00 0.00 0.00 59.70 60.14 1hdl h MET 46 Cb 0.55 0.00 -0.05 0.00 -0.00 0.00 0.00 31.60 32.10 1hdl h MET 46 CO -0.39 0.01 0.51 0.82 -0.00 0.00 0.00 176.91 177.86 1hdl h ILE 47 N 0.00 1.03 -0.20 -0.10 1.08 -0.30 -1.81 117.51 117.20 1hdl h ILE 47 Ca -0.00 -0.29 -0.17 0.00 -0.39 0.00 0.00 64.86 64.01 1hdl h ILE 47 Cb 0.03 0.12 0.00 0.00 -3.07 0.00 0.00 36.82 33.90 1hdl h ILE 47 CO 0.00 0.15 -0.53 -0.07 -0.69 0.00 0.00 178.15 177.01 1hdl h LEU 48 N 0.84 0.82 -1.55 1.44 3.38 -1.26 -0.79 115.31 118.18 1hdl h LEU 48 Ca 0.34 -0.57 0.14 0.00 0.09 0.00 0.00 57.88 57.88 1hdl h LEU 48 Cb 0.24 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1hdl h LEU 48 CO -0.12 1.25 0.70 -0.33 0.09 0.00 0.00 178.44 180.03 1hdl h GLU 49 N 0.43 0.00 0.00 1.13 5.08 -1.27 0.55 114.58 120.49 1hdl h GLU 49 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1hdl h GLU 49 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1hdl h GLU 49 CO 0.12 0.00 -0.76 0.36 -1.00 0.00 0.00 179.01 177.73 1hdl n LYS 50 N -3.34 2.71 -0.06 2.33 2.85 -1.09 -4.50 118.16 117.06 1hdl n LYS 50 Ca 0.10 -0.03 0.23 0.00 -1.05 0.00 0.00 58.31 57.57 1hdl n LYS 50 Cb 0.88 -1.06 0.71 0.00 -0.65 0.00 0.00 35.03 34.92 1hdl n LYS 50 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1hdl h GLU 51 N 0.00 0.00 -7.39 -1.58 4.81 0.16 -3.41 114.58 107.17 1hdl h GLU 51 Ca 0.00 0.00 -0.50 0.00 -0.13 0.00 0.00 59.36 58.73 1hdl h GLU 51 Cb 0.31 0.00 0.07 0.00 0.63 0.00 0.00 28.75 29.75 1hdl h GLU 51 CO 0.00 0.00 0.42 0.00 -0.73 0.00 0.00 179.01 178.70 1hdl s ALA 52 N -4.95 3.03 -1.01 2.92 0.00 -1.23 -4.96 121.76 115.56 1hdl s ALA 52 Ca -0.05 -0.16 0.27 0.00 0.00 0.00 0.00 51.96 52.02 1hdl s ALA 52 Cb 0.20 -3.07 0.91 0.00 0.00 0.00 0.00 23.12 21.16 1hdl s ALA 52 CO 0.73 -0.83 1.70 1.63 0.00 0.00 0.00 175.76 178.98 1hdl n LYS 53 N -2.83 0.01 0.25 0.00 4.76 -1.26 -3.51 118.16 115.58 1hdl n LYS 53 Ca 0.06 -0.00 0.14 0.00 -2.87 0.00 0.00 58.31 55.64 1hdl n LYS 53 Cb 0.55 -1.50 0.49 0.00 -1.84 0.00 0.00 35.03 32.73 1hdl n LYS 53 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1hdl h SER 54 N 0.01 0.00 0.00 4.39 4.64 -1.92 -3.54 113.55 117.13 1hdl h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hdl h SER 54 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1hdl h SER 54 CO 0.00 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.03