#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 7.01 0.27 4.39 0.01 -1.26 -4.96 114.94 120.40 1hdl s ASN 2 Ca 0.00 1.20 0.26 0.00 -0.71 0.00 0.00 52.86 53.61 1hdl s ASN 2 Cb 0.00 -2.34 0.82 0.00 0.41 0.00 0.00 41.25 40.14 1hdl s ASN 2 CO 0.00 0.28 1.75 -0.08 -1.51 0.00 0.00 177.10 177.54 1hdl h GLU 3 N 4.60 0.00 0.00 -0.60 4.81 -2.00 -3.01 114.58 118.38 1hdl h GLU 3 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1hdl h GLU 3 Cb 1.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1hdl h GLU 3 CO 0.63 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 175.44 1hdl n ASP 4 N -2.40 0.00 -0.01 1.04 2.03 -1.26 -1.25 116.55 114.69 1hdl n ASP 4 Ca 0.04 -1.42 -0.01 0.00 0.52 0.00 0.00 54.79 53.93 1hdl n ASP 4 Cb 0.39 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.76 1hdl n ASP 4 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1hdl n GLN 5 N -0.76 2.27 -2.75 -0.67 7.27 -1.14 -4.78 117.38 116.83 1hdl n GLN 5 Ca 0.12 -0.01 -0.04 0.00 0.07 0.00 0.00 57.00 57.13 1hdl n GLN 5 Cb 0.05 -1.10 0.05 0.00 2.41 0.00 0.00 30.24 31.65 1hdl n GLN 5 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1hdl n GLU 6 N -1.98 1.44 -0.60 3.69 1.02 -1.20 -4.92 120.64 118.09 1hdl n GLU 6 Ca -0.04 -3.23 0.48 0.00 -0.02 0.00 0.00 57.16 54.34 1hdl n GLU 6 Cb 0.45 -1.30 0.77 0.00 -0.02 0.00 0.00 31.44 31.35 1hdl n GLU 6 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 1hdl h MET 7 N 2.68 0.01 -4.72 3.49 2.86 -1.47 -3.30 114.93 114.48 1hdl h MET 7 Ca -0.14 -0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.81 1hdl h MET 7 Cb 1.23 -0.00 -0.24 0.00 0.06 0.00 0.00 31.60 32.65 1hdl h MET 7 CO 0.29 0.01 -0.56 0.00 1.06 0.00 0.00 176.91 177.71 1hdl n HIS 9 N 4.95 0.48 0.06 0.00 -0.00 -1.25 -2.80 115.22 116.67 1hdl n HIS 9 Ca -0.13 0.14 -0.22 0.00 -0.00 0.00 0.00 57.72 57.51 1hdl n HIS 9 Cb 0.48 -0.60 -0.15 0.00 -0.00 0.00 0.00 29.99 29.72 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 0.35 0.00 -0.41 5.08 -1.93 -3.36 114.58 114.31 1hdl h GLU 10 Ca 0.00 -0.59 -0.16 0.00 -1.00 0.00 0.00 59.36 57.60 1hdl h GLU 10 Cb 0.73 0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 1hdl h GLU 10 CO 0.00 1.26 -0.95 0.74 -1.00 0.00 0.00 179.01 179.06 1hdl h PHE 11 N 0.09 0.00 -0.89 4.33 0.04 -1.99 -3.32 116.94 115.21 1hdl h PHE 11 Ca -0.34 0.00 0.23 0.00 2.80 0.00 0.00 57.97 60.66 1hdl h PHE 11 Cb 2.08 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 40.09 1hdl h PHE 11 CO 0.09 0.70 0.30 0.37 -0.60 0.00 0.00 178.31 179.17 1hdl h GLN 12 N 0.00 0.26 0.00 1.51 4.15 -1.66 2.20 115.11 121.56 1hdl h GLN 12 Ca -0.07 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.34 1hdl h GLN 12 Cb 1.59 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 29.22 1hdl h GLN 12 CO 0.08 0.17 0.00 0.00 -1.93 0.00 0.00 178.83 177.15 1hdl h ALA 13 N 1.76 1.00 -0.30 3.38 0.00 -1.75 -0.52 119.26 122.83 1hdl h ALA 13 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1hdl h ALA 13 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1hdl h ALA 13 CO -0.61 0.00 0.00 1.19 0.00 0.00 0.00 179.25 179.83 1hdl n PHE 14 N -2.84 0.80 -3.63 0.00 3.72 0.74 -4.81 117.46 111.45 1hdl n PHE 14 Ca -0.02 -0.30 -0.39 0.00 -0.05 0.00 0.00 57.45 56.69 1hdl n PHE 14 Cb 0.11 -0.19 -0.11 0.00 -0.94 0.00 0.00 39.48 38.34 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 -1.73 3.47 -0.97 -1.08 0.23 -0.21 -1.22 119.30 117.80 1hdl s MET 15 Ca 0.25 -0.63 -0.16 0.00 -1.03 0.00 0.00 55.69 54.12 1hdl s MET 15 Cb 0.17 -3.61 0.18 0.00 -1.53 0.00 0.00 34.83 30.04 1hdl s MET 15 CO 0.10 -0.37 1.08 0.21 -2.03 0.00 0.00 175.02 174.01 1hdl s LYS 16 N 1.65 3.74 -1.18 3.16 2.20 0.49 -4.51 119.74 125.30 1hdl s LYS 16 Ca 0.05 -2.23 -0.03 0.00 -0.36 0.00 0.00 55.97 53.41 1hdl s LYS 16 Cb -0.17 -4.77 -0.02 0.00 -1.51 0.00 0.00 37.83 31.36 1hdl s LYS 16 CO 0.08 -1.59 0.91 0.09 -0.36 0.00 0.00 175.35 174.48 1hdl n ASN 17 N 5.33 -3.17 0.00 1.43 3.02 -1.26 -1.88 115.26 118.74 1hdl n ASN 17 Ca 0.23 -0.70 0.00 0.00 -0.03 0.00 0.00 54.58 54.08 1hdl n ASN 17 Cb 0.47 -4.85 0.00 0.00 -0.61 0.00 0.00 39.78 34.78 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 -1.27 2.29 3.45 7.41 0.00 -1.26 -5.00 105.19 110.81 1hdl n GLY 18 Ca -0.23 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.53 3.13 -0.44 1.61 2.36 -0.79 -5.02 119.74 120.07 1hdl s LYS 19 Ca 0.00 -0.87 -0.24 0.00 -2.55 0.00 0.00 55.97 52.31 1hdl s LYS 19 Cb 0.00 -4.11 0.02 0.00 -1.05 0.00 0.00 37.83 32.70 1hdl s LYS 19 CO 0.00 -1.26 0.86 -1.17 1.55 0.00 0.00 175.35 175.33 1hdl s LEU 20 N 2.74 4.10 -1.10 5.43 2.96 -1.26 0.19 118.68 131.74 1hdl s LEU 20 Ca 0.16 0.12 -0.04 0.00 -0.22 0.00 0.00 54.13 54.15 1hdl s LEU 20 Cb -0.19 -3.11 0.30 0.00 0.50 0.00 0.00 46.19 43.69 1hdl s LEU 20 CO 0.12 -0.95 1.54 2.22 -1.32 0.00 0.00 176.35 177.97 1hdl n PHE 21 N 6.89 2.30 -0.20 5.38 1.16 -0.36 -4.84 117.46 127.79 1hdl n PHE 21 Ca 0.05 -2.58 0.01 0.00 -1.87 0.00 0.00 57.45 53.06 1hdl n PHE 21 Cb 0.48 -1.31 0.10 0.00 -1.61 0.00 0.00 39.48 37.15 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 -5.27 0.33 -0.07 0.00 -0.02 -1.26 -4.29 135.00 124.42 1hdl n PRO 23 Ca 0.09 -1.43 -0.11 0.00 -2.02 0.00 0.00 63.50 60.03 1hdl n PRO 23 Cb 0.35 -3.09 -0.06 0.00 -0.02 0.00 0.00 33.50 30.69 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 7.94 0.33 -2.68 -0.52 7.27 -1.24 -4.94 117.38 123.55 1hdl n GLN 24 Ca 0.45 0.09 -0.05 0.00 0.07 0.00 0.00 57.00 57.57 1hdl n GLN 24 Cb 0.44 -1.20 0.10 0.00 2.41 0.00 0.00 30.24 31.99 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 -3.11 -1.58 0.17 1.69 2.03 -1.26 -4.99 116.55 109.51 1hdl n ASP 25 Ca -0.25 -2.39 0.09 0.00 0.52 0.00 0.00 54.79 52.76 1hdl n ASP 25 Cb 0.74 1.35 0.48 0.00 -0.72 0.00 0.00 41.12 42.98 1hdl n ASP 25 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1hdl h LYS 26 N 2.51 0.00 -1.43 -0.67 1.57 -1.92 -2.77 116.57 113.86 1hdl h LYS 26 Ca -0.25 0.00 0.41 0.00 -1.87 0.00 0.00 60.65 58.95 1hdl h LYS 26 Cb 1.18 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.43 1hdl h LYS 26 CO 0.03 0.00 1.26 0.87 -0.57 0.00 0.00 179.45 181.03 1hdl h LYS 27 N 0.00 0.00 -0.66 3.15 1.57 -1.99 0.74 116.57 119.38 1hdl h LYS 27 Ca 0.00 0.00 0.19 0.00 -1.87 0.00 0.00 60.65 58.97 1hdl h LYS 27 Cb 0.36 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 1hdl h LYS 27 CO 0.00 0.00 0.63 0.74 -0.57 0.00 0.00 179.45 180.25 1hdl h PHE 28 N 0.00 0.00 -0.93 -1.35 0.04 -1.84 -0.94 116.94 111.91 1hdl h PHE 28 Ca 0.68 0.00 0.27 0.00 2.80 0.00 0.00 57.97 61.72 1hdl h PHE 28 Cb 3.18 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 41.30 1hdl h PHE 28 CO 0.00 0.00 1.06 0.35 -0.60 0.00 0.00 178.31 179.12 1hdl h PHE 29 N 0.00 0.00 0.00 -0.55 3.57 0.34 1.03 116.94 121.32 1hdl h PHE 29 Ca 0.32 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.82 1hdl h PHE 29 Cb 1.57 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.31 1hdl h PHE 29 CO 0.00 0.00 0.00 1.04 -2.23 0.00 0.00 178.31 177.12 1hdl n GLN 30 N -3.37 0.08 -4.39 1.11 6.02 -0.36 -4.02 117.38 112.45 1hdl n GLN 30 Ca 0.20 0.26 -0.19 0.00 -0.01 0.00 0.00 57.00 57.26 1hdl n GLN 30 Cb 1.35 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 31.00 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 -2.72 2.24 0.07 1.08 0.01 0.35 -4.99 113.70 109.74 1hdl s SER 31 Ca 0.07 -1.25 -0.29 0.00 1.31 0.00 0.00 55.95 55.78 1hdl s SER 31 Cb 0.06 -0.07 -0.18 0.00 0.21 0.00 0.00 66.02 66.04 1hdl s SER 31 CO 0.14 -0.49 1.62 0.25 0.41 0.00 0.00 173.24 175.17 1hdl h LEU 32 N 2.33 -0.52 -1.34 2.44 6.46 -1.84 0.91 115.31 123.74 1hdl h LEU 32 Ca -0.39 -0.00 0.17 0.00 -0.12 0.00 0.00 57.88 57.54 1hdl h LEU 32 Cb 1.23 0.13 -0.07 0.00 -0.73 0.00 0.00 40.66 41.22 1hdl h LEU 32 CO 0.67 -0.35 0.59 0.44 -0.62 0.00 0.00 178.44 179.17 1hdl h ASP 33 N -0.65 0.57 -0.09 1.25 3.32 -1.96 0.30 116.42 119.16 1hdl h ASP 33 Ca -0.06 0.05 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 1hdl h ASP 33 Cb 0.49 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1hdl h ASP 33 CO 0.10 0.25 -0.30 1.23 -1.72 0.00 0.00 179.24 178.80 1hdl h GLY 34 N 0.58 0.39 0.81 2.75 0.00 -1.45 -0.93 103.07 105.22 1hdl h GLY 34 Ca 0.47 -0.52 0.12 0.00 0.00 0.00 0.00 47.33 47.41 1hdl h GLY 34 CO -0.22 0.47 0.48 -2.22 0.00 0.00 0.00 176.54 175.05 1hdl h ILE 35 N -0.11 0.85 0.11 2.60 1.08 0.33 0.16 117.51 122.52 1hdl h ILE 35 Ca -0.01 -0.16 -0.01 0.00 -0.39 0.00 0.00 64.86 64.29 1hdl h ILE 35 Cb 0.94 0.34 0.00 0.00 -3.07 0.00 0.00 36.82 35.02 1hdl h ILE 35 CO 0.06 0.09 -0.05 0.24 -0.69 0.00 0.00 178.15 177.80 1hdl h MET 36 N 0.47 -0.14 -0.71 2.37 2.86 -0.36 -2.95 114.93 116.47 1hdl h MET 36 Ca 0.34 0.01 0.15 0.00 -2.06 0.00 0.00 59.70 58.15 1hdl h MET 36 Cb 0.69 0.03 -0.13 0.00 0.06 0.00 0.00 31.60 32.25 1hdl h MET 36 CO -0.11 -0.10 -0.08 0.27 1.06 0.00 0.00 176.91 177.95 1hdl h PHE 37 N -0.57 -0.21 -0.95 -0.22 -0.00 -1.02 0.94 116.94 114.92 1hdl h PHE 37 Ca -0.02 0.06 0.22 0.00 -0.00 0.00 0.00 57.97 58.23 1hdl h PHE 37 Cb 0.11 0.20 -0.12 0.00 -0.00 0.00 0.00 35.95 36.15 1hdl h PHE 37 CO 0.02 -0.27 0.51 0.82 -0.00 0.00 0.00 178.31 179.40 1hdl h ILE 38 N 0.05 0.57 -0.18 0.88 1.08 -0.80 1.96 117.51 121.06 1hdl h ILE 38 Ca 0.37 -0.19 -0.11 0.00 -0.39 0.00 0.00 64.86 64.54 1hdl h ILE 38 Cb 0.61 -0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.31 1hdl h ILE 38 CO -0.68 0.10 -0.37 0.78 -0.69 0.00 0.00 178.15 177.29 1hdl h ASN 39 N 0.55 0.41 1.07 1.72 2.35 0.10 -2.96 115.58 118.83 1hdl h ASN 39 Ca 0.58 -0.17 -0.14 0.00 -0.55 0.00 0.00 56.30 56.02 1hdl h ASN 39 Cb 1.05 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.28 1hdl h ASN 39 CO -0.46 0.75 -0.98 0.11 -1.65 0.00 0.00 177.43 175.19 1hdl h LYS 40 N 0.34 0.00 0.00 0.81 1.57 0.17 -3.31 116.57 116.15 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 0.81 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.12 1hdl h LYS 40 CO 0.06 0.43 0.00 0.00 -0.57 0.00 0.00 179.45 179.37 1hdl h ALA 42 N -1.50 2.05 0.52 0.00 0.00 -1.75 -2.34 119.26 116.24 1hdl h ALA 42 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1hdl h ALA 42 Cb 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.72 1hdl h ALA 42 CO 0.00 -0.20 -0.25 1.15 0.00 0.00 0.00 179.25 179.95 1hdl h THR 43 N 0.39 0.24 -1.08 0.00 2.02 -1.29 -2.97 112.91 110.22 1hdl h THR 43 Ca 0.29 -0.48 0.30 0.00 0.77 0.00 0.00 66.41 67.29 1hdl h THR 43 Cb 0.62 0.35 -0.07 0.00 -1.74 0.00 0.00 68.15 67.30 1hdl h THR 43 CO -0.08 0.04 0.73 0.00 0.37 0.00 0.00 175.52 176.59 1hdl h LYS 45 N 0.21 0.33 0.00 0.00 3.64 -1.28 -1.53 116.57 117.94 1hdl h LYS 45 Ca 0.57 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.91 1hdl h LYS 45 Cb 1.81 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 33.56 1hdl h LYS 45 CO -0.17 0.25 -0.06 0.00 -2.27 0.00 0.00 179.45 177.20 1hdl h MET 46 N 0.32 0.00 -0.65 1.90 -0.00 -0.66 -2.30 114.93 113.54 1hdl h MET 46 Ca 0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.75 1hdl h MET 46 Cb -0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 31.57 1hdl h MET 46 CO -0.02 0.06 0.25 0.82 -0.00 0.00 0.00 176.91 178.03 1hdl h ILE 47 N 0.00 1.24 -0.56 -0.10 1.08 -0.93 -2.60 117.51 115.64 1hdl h ILE 47 Ca -0.00 -0.76 -0.11 0.00 -0.39 0.00 0.00 64.86 63.60 1hdl h ILE 47 Cb 0.24 0.52 -0.02 0.00 -3.07 0.00 0.00 36.82 34.49 1hdl h ILE 47 CO 0.01 0.30 -0.08 -0.07 -0.69 0.00 0.00 178.15 177.61 1hdl h LEU 48 N 0.91 1.05 -2.18 1.44 -0.00 -1.33 -2.42 115.31 112.78 1hdl h LEU 48 Ca 0.21 -0.34 0.06 0.00 -0.00 0.00 0.00 57.88 57.82 1hdl h LEU 48 Cb 0.22 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 40.59 1hdl h LEU 48 CO -0.02 1.14 0.21 -0.33 -0.00 0.00 0.00 178.44 179.44 1hdl h GLU 49 N 0.94 0.00 -0.65 1.13 4.39 -1.36 -0.77 114.58 118.27 1hdl h GLU 49 Ca 0.15 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.78 1hdl h GLU 49 Cb 0.65 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.27 1hdl h GLU 49 CO 0.04 0.00 0.13 0.87 -1.16 0.00 0.00 179.01 178.89 1hdl h LYS 50 N 0.00 1.04 -0.17 2.33 1.57 -1.16 -2.18 116.57 118.00 1hdl h LYS 50 Ca 0.10 -0.25 0.05 0.00 -1.87 0.00 0.00 60.65 58.68 1hdl h LYS 50 Cb 0.52 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1hdl h LYS 50 CO -0.00 0.94 0.17 0.93 -0.57 0.00 0.00 179.45 180.91 1hdl h GLU 51 N 0.98 0.00 0.00 3.15 5.08 -1.22 0.16 114.58 122.73 1hdl h GLU 51 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1hdl h GLU 51 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1hdl h GLU 51 CO 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.02 1hdl h ALA 52 N 1.82 1.00 0.00 3.43 0.00 -1.47 -3.18 119.26 120.87 1hdl h ALA 52 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1hdl h ALA 52 Cb 0.41 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1hdl h ALA 52 CO -0.00 0.00 -1.01 -0.22 0.00 0.00 0.00 179.25 178.02 1hdl h LYS 53 N 0.00 0.00 0.00 0.00 3.64 -0.68 -3.28 116.57 116.25 1hdl h LYS 53 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1hdl h LYS 53 Cb 0.92 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 1hdl h LYS 53 CO 0.00 0.33 0.00 0.77 -2.27 0.00 0.00 179.45 178.28 1hdl h SER 54 N 0.00 0.00 0.00 4.20 0.02 -1.45 -3.52 113.55 112.80 1hdl h SER 54 Ca -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1hdl h SER 54 Cb 1.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.98 1hdl h SER 54 CO 0.05 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.74