#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 7.05 0.09 4.39 0.02 -1.26 -4.93 114.94 120.31 1hdl s ASN 2 Ca 0.00 1.27 0.26 0.00 -1.02 0.00 0.00 52.86 53.38 1hdl s ASN 2 Cb 0.00 -2.44 1.02 0.00 0.02 0.00 0.00 41.25 39.85 1hdl s ASN 2 CO 0.00 -0.15 1.82 -0.62 0.02 0.00 0.00 177.10 178.18 1hdl n GLU 3 N 3.83 0.11 -3.14 -0.60 -0.58 -1.26 -4.42 120.64 114.57 1hdl n GLU 3 Ca 0.00 0.12 -0.11 0.00 -0.42 0.00 0.00 57.16 56.75 1hdl n GLU 3 Cb 0.51 -1.63 -0.04 0.00 -0.57 0.00 0.00 31.44 29.71 1hdl n GLU 3 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1hdl s ASP 4 N -3.63 -0.14 -0.49 1.62 -1.08 -1.26 -5.00 116.67 106.69 1hdl s ASP 4 Ca 0.12 -1.77 0.06 0.00 -0.52 0.00 0.00 52.55 50.44 1hdl s ASP 4 Cb 0.15 1.07 0.23 0.00 -1.46 0.00 0.00 42.92 42.91 1hdl s ASP 4 CO 0.52 -0.16 0.54 1.67 0.52 0.00 0.00 175.17 178.26 1hdl n GLN 5 N 3.58 1.16 -1.84 4.34 7.27 -1.26 -4.86 117.38 125.76 1hdl n GLN 5 Ca 0.17 -3.69 -0.20 0.00 0.07 0.00 0.00 57.00 53.35 1hdl n GLN 5 Cb 0.51 -1.66 -0.06 0.00 2.41 0.00 0.00 30.24 31.44 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 1.61 -1.45 -3.12 3.69 1.02 -1.26 -4.95 120.64 116.17 1hdl n GLU 6 Ca 0.25 1.12 -0.37 0.00 -0.02 0.00 0.00 57.16 58.14 1hdl n GLU 6 Cb 0.47 -5.56 -0.06 0.00 -0.02 0.00 0.00 31.44 26.28 1hdl n GLU 6 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1hdl s MET 7 N -4.12 4.30 -0.08 3.49 -1.94 -1.26 -4.93 119.30 114.76 1hdl s MET 7 Ca 0.00 0.89 0.05 0.00 -1.71 0.00 0.00 55.69 54.91 1hdl s MET 7 Cb 0.00 -3.06 -0.00 0.00 2.01 0.00 0.00 34.83 33.78 1hdl s MET 7 CO 0.00 0.50 -0.23 0.00 -0.01 0.00 0.00 175.02 175.28 1hdl n HIS 9 N 3.36 0.00 0.13 0.00 8.25 -1.26 -4.55 115.22 121.16 1hdl n HIS 9 Ca -0.19 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.05 1hdl n HIS 9 Cb 0.53 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.49 1hdl n HIS 9 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1hdl h GLU 10 N 0.00 0.48 0.00 -0.41 4.11 -2.01 -3.28 114.58 113.48 1hdl h GLU 10 Ca 0.00 -0.80 0.00 0.00 0.07 0.00 0.00 59.36 58.63 1hdl h GLU 10 Cb 0.01 0.30 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1hdl h GLU 10 CO 0.00 1.38 -0.22 0.74 0.07 0.00 0.00 179.01 180.98 1hdl h PHE 11 N 0.14 0.00 -0.88 2.06 -1.00 -1.94 -3.31 116.94 112.01 1hdl h PHE 11 Ca -0.22 0.00 0.23 0.00 2.81 0.00 0.00 57.97 60.79 1hdl h PHE 11 Cb 2.10 0.00 -0.13 0.00 3.61 0.00 0.00 35.95 41.53 1hdl h PHE 11 CO 0.11 0.00 0.28 0.37 -1.61 0.00 0.00 178.31 177.47 1hdl h GLN 12 N 0.00 0.26 -0.01 1.51 4.15 -1.80 2.18 115.11 121.40 1hdl h GLN 12 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1hdl h GLN 12 Cb 0.97 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 28.60 1hdl h GLN 12 CO 0.00 0.17 0.11 0.00 -1.93 0.00 0.00 178.83 177.18 1hdl h ALA 13 N 1.75 1.18 -0.32 3.38 0.00 -1.75 0.23 119.26 123.73 1hdl h ALA 13 Ca 0.55 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1hdl h ALA 13 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1hdl h ALA 13 CO -0.61 -0.12 0.00 1.19 0.00 0.00 0.00 179.25 179.71 1hdl n PHE 14 N -3.12 1.00 -3.57 0.00 3.72 0.74 -4.83 117.46 111.39 1hdl n PHE 14 Ca -0.02 -0.36 -0.39 0.00 -0.05 0.00 0.00 57.45 56.63 1hdl n PHE 14 Cb 0.18 -0.26 -0.11 0.00 -0.94 0.00 0.00 39.48 38.35 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 -1.85 3.79 -1.11 -1.08 0.23 0.81 -0.83 119.30 119.25 1hdl s MET 15 Ca 0.29 -0.43 -0.11 0.00 -1.03 0.00 0.00 55.69 54.40 1hdl s MET 15 Cb 0.21 -3.71 0.24 0.00 -1.53 0.00 0.00 34.83 30.04 1hdl s MET 15 CO 0.10 -0.27 1.18 0.21 -2.03 0.00 0.00 175.02 174.22 1hdl s LYS 16 N 1.75 4.11 -0.76 3.16 2.47 0.42 -4.55 119.74 126.34 1hdl s LYS 16 Ca 0.07 -2.93 -0.01 0.00 -1.56 0.00 0.00 55.97 51.54 1hdl s LYS 16 Cb -0.16 -4.71 -0.01 0.00 -1.46 0.00 0.00 37.83 31.48 1hdl s LYS 16 CO 0.11 -1.42 0.64 -1.71 0.16 0.00 0.00 175.35 173.13 1hdl n ASN 17 N 3.80 -2.90 0.00 1.43 2.85 -1.26 -2.64 115.26 116.53 1hdl n ASN 17 Ca 0.27 -0.42 0.00 0.00 -0.11 0.00 0.00 54.58 54.32 1hdl n ASN 17 Cb 0.41 -3.55 0.00 0.00 1.24 0.00 0.00 39.78 37.88 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 -1.15 2.77 3.44 8.20 0.00 -1.26 -4.98 105.19 112.21 1hdl n GLY 18 Ca -0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.33 3.13 -0.39 1.61 2.36 -1.08 -5.02 119.74 120.02 1hdl s LYS 19 Ca 0.00 -0.91 -0.27 0.00 -2.55 0.00 0.00 55.97 52.23 1hdl s LYS 19 Cb 0.00 -4.14 0.02 0.00 -1.05 0.00 0.00 37.83 32.66 1hdl s LYS 19 CO 0.00 -1.35 1.02 -1.17 1.55 0.00 0.00 175.35 175.40 1hdl s LEU 20 N 2.86 3.89 -1.12 5.43 0.20 -1.26 0.16 118.68 128.83 1hdl s LEU 20 Ca 0.16 0.66 -0.05 0.00 0.69 0.00 0.00 54.13 55.59 1hdl s LEU 20 Cb -0.19 -3.41 0.28 0.00 -0.43 0.00 0.00 46.19 42.43 1hdl s LEU 20 CO 0.11 -0.97 1.56 2.22 -0.29 0.00 0.00 176.35 178.98 1hdl n PHE 21 N 7.08 2.45 -0.20 5.38 1.16 -0.01 -4.84 117.46 128.48 1hdl n PHE 21 Ca 0.10 -2.64 0.00 0.00 -1.87 0.00 0.00 57.45 53.03 1hdl n PHE 21 Cb 0.48 -1.41 0.08 0.00 -1.61 0.00 0.00 39.48 37.02 1hdl n PHE 21 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1hdl s PRO 23 N -6.19 1.52 0.00 0.00 0.02 -1.26 -4.44 135.00 124.66 1hdl s PRO 23 Ca -0.14 -0.37 0.00 0.00 0.02 0.00 0.00 61.00 60.52 1hdl s PRO 23 Cb 0.19 -4.99 0.00 0.00 0.02 0.00 0.00 34.50 29.72 1hdl s PRO 23 CO 0.73 -4.98 0.00 0.94 -0.33 0.00 0.00 177.00 173.37 1hdl n GLN 24 N 8.35 0.00 -3.45 5.54 7.27 -1.25 -5.02 117.38 128.83 1hdl n GLN 24 Ca 0.43 0.00 -0.27 0.00 0.07 0.00 0.00 57.00 57.23 1hdl n GLN 24 Cb 0.46 0.00 -0.10 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 -1.53 0.33 0.00 1.69 -0.08 -1.26 -4.93 116.55 110.76 1hdl n ASP 25 Ca 0.00 -2.59 0.07 0.00 -1.51 0.00 0.00 54.79 50.76 1hdl n ASP 25 Cb 0.00 -0.60 0.39 0.00 2.34 0.00 0.00 41.12 43.25 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 2.42 0.33 -0.38 -0.67 5.02 -1.26 -3.63 118.16 119.99 1hdl n LYS 26 Ca 0.27 0.07 0.37 0.00 -2.02 0.00 0.00 58.31 57.00 1hdl n LYS 26 Cb 0.46 -1.50 0.61 0.00 -0.02 0.00 0.00 35.03 34.59 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 -0.15 1.97 1.57 -1.96 0.38 116.57 118.38 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 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1hdl h LYS 27 CO 0.00 0.00 0.61 0.74 -0.57 0.00 0.00 179.45 180.23 1hdl h PHE 28 N 0.00 0.00 0.00 -1.35 0.04 -1.82 0.13 116.94 113.94 1hdl h PHE 28 Ca 0.64 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.41 1hdl h PHE 28 Cb 3.10 0.00 0.00 0.00 2.20 0.00 0.00 35.95 41.25 1hdl h PHE 28 CO 0.00 0.00 0.17 0.35 -0.60 0.00 0.00 178.31 178.23 1hdl h PHE 29 N 0.00 0.00 0.00 -0.55 3.04 -0.36 -1.12 116.94 117.94 1hdl h PHE 29 Ca 0.07 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.02 1hdl h PHE 29 Cb 1.29 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.80 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 -2.41 0.03 -3.98 1.11 6.02 0.45 -4.59 117.38 114.01 1hdl n GLN 30 Ca -0.02 0.48 -0.10 0.00 -0.01 0.00 0.00 57.00 57.36 1hdl n GLN 30 Cb 0.21 -1.59 -0.07 0.00 1.02 0.00 0.00 30.24 29.80 1hdl n GLN 30 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1hdl s SER 31 N -3.22 0.04 0.05 1.08 1.04 -0.47 -5.02 113.70 107.21 1hdl s SER 31 Ca 0.01 -0.90 -0.29 0.00 0.48 0.00 0.00 55.95 55.25 1hdl s SER 31 Cb 0.03 0.44 -0.17 0.00 0.10 0.00 0.00 66.02 66.41 1hdl s SER 31 CO 0.09 -0.90 1.50 0.25 0.98 0.00 0.00 173.24 175.16 1hdl h LEU 32 N 2.54 -0.50 -1.10 2.42 6.46 -1.84 1.39 115.31 124.68 1hdl h LEU 32 Ca -0.32 -0.04 0.12 0.00 -0.12 0.00 0.00 57.88 57.52 1hdl h LEU 32 Cb 1.23 0.13 -0.08 0.00 -0.73 0.00 0.00 40.66 41.21 1hdl h LEU 32 CO 0.48 -0.27 0.61 -0.78 -0.62 0.00 0.00 178.44 177.86 1hdl h ASP 33 N -0.71 0.85 0.24 1.25 1.82 -1.97 0.38 116.42 118.28 1hdl h ASP 33 Ca -0.06 0.04 -0.19 0.00 -0.39 0.00 0.00 57.03 56.43 1hdl h ASP 33 Cb 0.52 -0.13 -0.00 0.00 0.68 0.00 0.00 39.33 40.39 1hdl h ASP 33 CO 0.10 0.46 -0.77 1.23 -1.61 0.00 0.00 179.24 178.65 1hdl h GLY 34 N 0.92 0.48 1.38 -0.78 0.00 -1.54 -3.06 103.07 100.46 1hdl h GLY 34 Ca 0.48 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 47.05 1hdl h GLY 34 CO -0.24 0.62 0.09 -2.22 0.00 0.00 0.00 176.54 174.79 1hdl h ILE 35 N 0.29 1.22 -0.39 2.60 1.08 0.49 -3.00 117.51 119.81 1hdl h ILE 35 Ca -0.04 -0.84 0.08 0.00 -0.39 0.00 0.00 64.86 63.67 1hdl h ILE 35 Cb 1.36 0.75 -0.09 0.00 -3.07 0.00 0.00 36.82 35.77 1hdl h ILE 35 CO 0.13 0.31 -0.23 0.24 -0.69 0.00 0.00 178.15 177.91 1hdl h MET 36 N 0.74 -0.16 -0.73 2.37 2.86 -0.31 -1.00 114.93 118.71 1hdl h MET 36 Ca 0.16 0.01 0.15 0.00 -2.06 0.00 0.00 59.70 57.96 1hdl h MET 36 Cb 0.32 0.04 -0.14 0.00 0.06 0.00 0.00 31.60 31.88 1hdl h MET 36 CO 0.00 -0.10 -0.14 0.35 1.06 0.00 0.00 176.91 178.08 1hdl h PHE 37 N -0.16 -0.31 -1.00 -0.22 3.04 -1.62 0.73 116.94 117.39 1hdl h PHE 37 Ca 0.19 0.06 0.23 0.00 3.98 0.00 0.00 57.97 62.43 1hdl h PHE 37 Cb 0.46 0.25 -0.10 0.00 2.56 0.00 0.00 35.95 39.12 1hdl h PHE 37 CO -0.45 -0.30 0.62 0.82 -2.02 0.00 0.00 178.31 176.98 1hdl h ILE 38 N 0.02 0.61 0.00 1.41 2.04 -1.29 1.98 117.51 122.28 1hdl h ILE 38 Ca 0.36 -0.20 -0.08 0.00 1.00 0.00 0.00 64.86 65.94 1hdl h ILE 38 Cb 0.57 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1hdl h ILE 38 CO -0.73 0.11 -0.39 0.78 0.00 0.00 0.00 178.15 177.92 1hdl h ASN 39 N 0.58 0.00 0.19 1.72 2.35 0.58 -2.95 115.58 118.05 1hdl h ASN 39 Ca 0.59 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.34 1hdl h ASN 39 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.54 1hdl h ASN 39 CO -0.35 0.39 -1.03 0.29 -1.65 0.00 0.00 177.43 175.08 1hdl n LYS 40 N -3.51 0.14 0.00 0.81 5.02 0.27 -4.04 118.16 116.85 1hdl n LYS 40 Ca -0.00 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1hdl n LYS 40 Cb 0.53 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 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 -2.00 2.22 0.24 0.00 0.00 -1.80 -1.98 119.26 115.94 1hdl h ALA 42 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1hdl h ALA 42 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1hdl h ALA 42 CO 0.00 -0.36 -0.12 1.15 0.00 0.00 0.00 179.25 179.92 1hdl h THR 43 N 0.22 0.51 -0.41 0.00 2.02 -1.67 -3.02 112.91 110.56 1hdl h THR 43 Ca 0.26 -0.93 0.12 0.00 0.77 0.00 0.00 66.41 66.63 1hdl h THR 43 Cb 0.73 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.98 1hdl h THR 43 CO -0.05 0.13 0.61 0.00 0.37 0.00 0.00 175.52 176.59 1hdl h LYS 45 N 0.00 -0.10 -0.05 0.00 3.64 -1.25 -2.96 116.57 115.85 1hdl h LYS 45 Ca 0.19 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1hdl h LYS 45 Cb 1.42 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.26 1hdl h LYS 45 CO -0.00 0.34 0.05 0.00 -2.27 0.00 0.00 179.45 177.57 1hdl h MET 46 N -0.59 0.00 -0.92 1.90 -0.00 -0.87 -0.99 114.93 113.46 1hdl h MET 46 Ca -0.01 0.00 0.06 0.00 -0.00 0.00 0.00 59.70 59.75 1hdl h MET 46 Cb 0.49 0.00 -0.06 0.00 -0.00 0.00 0.00 31.60 32.03 1hdl h MET 46 CO 0.02 0.00 0.60 0.82 -0.00 0.00 0.00 176.91 178.35 1hdl h ILE 47 N 0.00 1.09 -0.33 -0.10 1.08 -1.30 1.54 117.51 119.49 1hdl h ILE 47 Ca 0.02 -0.37 -0.13 0.00 -0.39 0.00 0.00 64.86 63.99 1hdl h ILE 47 Cb 0.13 -0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 33.79 1hdl h ILE 47 CO -0.00 0.20 -0.30 -0.07 -0.69 0.00 0.00 178.15 177.28 1hdl h LEU 48 N 1.08 0.83 -0.09 1.44 -0.00 -1.22 -2.81 115.31 114.54 1hdl h LEU 48 Ca 0.39 -0.46 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 1hdl h LEU 48 Cb 0.15 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.57 1hdl h LEU 48 CO -0.14 1.12 0.00 -0.33 -0.00 0.00 0.00 178.44 179.09 1hdl h GLU 49 N 0.56 0.00 -0.47 1.13 4.39 -1.25 -3.22 114.58 115.71 1hdl h GLU 49 Ca 0.05 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.65 1hdl h GLU 49 Cb 0.88 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.51 1hdl h GLU 49 CO 0.08 0.00 -0.12 -0.22 -1.16 0.00 0.00 179.01 177.58 1hdl h LYS 50 N 0.00 0.87 0.00 2.33 3.11 0.24 -2.02 116.57 121.11 1hdl h LYS 50 Ca 0.00 -0.31 -0.07 0.00 -2.81 0.00 0.00 60.65 57.46 1hdl h LYS 50 Cb 0.80 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.96 1hdl h LYS 50 CO 0.00 0.95 -0.33 1.49 -2.81 0.00 0.00 179.45 178.75 1hdl h GLU 51 N 0.78 0.00 0.00 1.90 4.81 -1.55 -2.57 114.58 117.96 1hdl h GLU 51 Ca 0.12 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.21 1hdl h GLU 51 Cb 0.64 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 1hdl h GLU 51 CO 0.04 0.33 -0.67 0.00 -0.73 0.00 0.00 179.01 177.99 1hdl h ALA 52 N 1.67 0.57 0.00 2.92 0.00 -1.60 -3.23 119.26 119.58 1hdl h ALA 52 Ca -0.00 -0.61 -0.11 0.00 0.00 0.00 0.00 54.91 54.19 1hdl h ALA 52 Cb 0.60 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1hdl h ALA 52 CO 0.04 0.84 -0.51 -0.22 0.00 0.00 0.00 179.25 179.40 1hdl h LYS 53 N 0.00 0.00 0.00 0.00 3.64 -0.97 -2.77 116.57 116.48 1hdl h LYS 53 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1hdl h LYS 53 Cb 1.51 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.33 1hdl h LYS 53 CO 0.09 0.51 0.00 0.66 -2.27 0.00 0.00 179.45 178.44 1hdl h SER 54 N 0.00 0.00 -0.02 4.20 4.64 -1.53 -3.52 113.55 117.32 1hdl h SER 54 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1hdl h SER 54 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1hdl h SER 54 CO 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.03