#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 6.19 0.48 4.39 0.02 -1.26 -4.95 114.94 119.81 1hdl s ASN 2 Ca 0.00 1.23 0.24 0.00 -1.02 0.00 0.00 52.86 53.31 1hdl s ASN 2 Cb 0.00 -2.35 1.19 0.00 0.02 0.00 0.00 41.25 40.10 1hdl s ASN 2 CO 0.00 -0.80 1.96 -0.33 0.02 0.00 0.00 177.10 177.95 1hdl h GLU 3 N -0.15 0.00 0.00 -0.60 5.08 -2.00 -2.08 114.58 114.83 1hdl h GLU 3 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1hdl h GLU 3 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1hdl h GLU 3 CO 0.62 0.19 0.00 -0.44 -1.00 0.00 0.00 179.01 178.38 1hdl h ASP 4 N 0.00 0.00 -1.09 1.42 3.32 -1.98 -2.90 116.42 115.20 1hdl h ASP 4 Ca -0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.55 1hdl h ASP 4 Cb 0.51 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.98 1hdl h ASP 4 CO 0.02 0.00 1.24 -1.58 -1.72 0.00 0.00 179.24 177.21 1hdl s GLN 5 N -3.42 3.23 -1.20 3.56 0.74 -0.78 -3.82 119.66 117.98 1hdl s GLN 5 Ca 0.04 -0.77 -0.08 0.00 0.05 0.00 0.00 55.36 54.60 1hdl s GLN 5 Cb 0.09 -5.18 0.01 0.00 1.10 0.00 0.00 33.01 29.03 1hdl s GLN 5 CO 0.55 -2.57 1.05 0.39 -0.55 0.00 0.00 175.29 174.15 1hdl n GLU 6 N 8.92 -7.04 -0.54 1.67 1.02 -1.26 -4.82 120.64 118.59 1hdl n GLU 6 Ca 0.33 0.73 0.44 0.00 -0.02 0.00 0.00 57.16 58.64 1hdl n GLU 6 Cb 0.50 -5.48 0.76 0.00 -0.02 0.00 0.00 31.44 27.19 1hdl n GLU 6 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 1hdl h MET 7 N -2.39 0.03 -6.06 3.49 4.05 -1.61 -3.36 114.93 109.09 1hdl h MET 7 Ca -0.50 -0.00 -0.56 0.00 -0.28 0.00 0.00 59.70 58.36 1hdl h MET 7 Cb 1.33 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 32.07 1hdl h MET 7 CO 0.49 0.02 0.14 0.00 0.23 0.00 0.00 176.91 177.80 1hdl n HIS 9 N 3.94 0.00 -0.04 0.00 -0.00 -1.26 -4.75 115.22 113.11 1hdl n HIS 9 Ca 0.00 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.08 1hdl n HIS 9 Cb 0.51 0.00 -0.14 0.00 -0.12 0.00 0.00 29.99 30.24 1hdl n HIS 9 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 1hdl n GLU 10 N -1.66 0.66 0.21 1.57 0.28 -1.26 -4.10 120.64 116.34 1hdl n GLU 10 Ca 0.00 0.21 0.09 0.00 -0.16 0.00 0.00 57.16 57.30 1hdl n GLU 10 Cb 0.11 -1.70 0.30 0.00 1.43 0.00 0.00 31.44 31.57 1hdl n GLU 10 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 177.13 177.71 1hdl h PHE 11 N 0.01 0.00 -0.80 -1.84 0.04 -1.96 -3.27 116.94 109.12 1hdl h PHE 11 Ca -0.38 0.00 0.19 0.00 2.80 0.00 0.00 57.97 60.58 1hdl h PHE 11 Cb 2.07 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 40.09 1hdl h PHE 11 CO 0.01 0.22 0.03 0.37 -0.60 0.00 0.00 178.31 178.33 1hdl h GLN 12 N 0.00 0.10 0.00 1.51 4.15 -1.86 2.14 115.11 121.15 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 0.95 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.62 1hdl h GLN 12 CO 0.03 0.07 0.11 0.00 -1.93 0.00 0.00 178.83 177.11 1hdl h ALA 13 N 1.75 1.11 -0.42 3.38 0.00 -1.82 0.23 119.26 123.49 1hdl h ALA 13 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1hdl h ALA 13 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1hdl h ALA 13 CO -0.70 -0.11 0.00 1.19 0.00 0.00 0.00 179.25 179.63 1hdl n PHE 14 N -2.83 0.85 -3.45 0.00 3.72 0.72 -4.84 117.46 111.63 1hdl n PHE 14 Ca -0.02 -0.35 -0.40 0.00 -0.05 0.00 0.00 57.45 56.63 1hdl n PHE 14 Cb 0.17 -0.13 -0.10 0.00 -0.94 0.00 0.00 39.48 38.48 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 -1.64 3.76 -0.92 -1.08 0.23 0.80 -1.80 119.30 118.66 1hdl s MET 15 Ca 0.31 -0.30 -0.14 0.00 -1.03 0.00 0.00 55.69 54.53 1hdl s MET 15 Cb 0.19 -3.74 0.21 0.00 -1.53 0.00 0.00 34.83 29.97 1hdl s MET 15 CO 0.17 -0.38 0.93 0.21 -2.03 0.00 0.00 175.02 173.92 1hdl s LYS 16 N 1.95 3.73 -1.18 3.16 2.20 0.61 -4.56 119.74 125.65 1hdl s LYS 16 Ca 0.11 -2.46 -0.01 0.00 -0.36 0.00 0.00 55.97 53.25 1hdl s LYS 16 Cb -0.16 -4.58 -0.01 0.00 -1.51 0.00 0.00 37.83 31.57 1hdl s LYS 16 CO 0.11 -1.40 0.98 0.09 -0.36 0.00 0.00 175.35 174.77 1hdl n ASN 17 N 4.34 -2.75 0.00 1.43 3.02 -1.26 -2.19 115.26 117.84 1hdl n ASN 17 Ca 0.19 -0.64 0.00 0.00 -0.03 0.00 0.00 54.58 54.10 1hdl n ASN 17 Cb 0.46 -5.12 0.00 0.00 -0.61 0.00 0.00 39.78 34.51 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 -1.15 2.46 3.52 7.41 0.00 -1.26 -5.01 105.19 111.15 1hdl n GLY 18 Ca -0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.57 3.39 -0.22 1.61 2.36 -0.93 -5.05 119.74 120.33 1hdl s LYS 19 Ca 0.00 -0.60 -0.14 0.00 -2.55 0.00 0.00 55.97 52.68 1hdl s LYS 19 Cb 0.00 -3.86 -0.04 0.00 -1.05 0.00 0.00 37.83 32.88 1hdl s LYS 19 CO 0.00 -0.59 0.33 -1.17 1.55 0.00 0.00 175.35 175.47 1hdl s LEU 20 N 1.94 4.13 -1.02 5.43 0.20 -1.26 0.22 118.68 128.32 1hdl s LEU 20 Ca 0.10 0.37 -0.04 0.00 0.69 0.00 0.00 54.13 55.25 1hdl s LEU 20 Cb -0.17 -2.39 0.29 0.00 -0.43 0.00 0.00 46.19 43.48 1hdl s LEU 20 CO 0.12 -0.06 1.24 2.22 -0.29 0.00 0.00 176.35 179.57 1hdl n PHE 21 N 4.56 3.35 -0.22 5.38 1.16 -0.74 -4.88 117.46 126.08 1hdl n PHE 21 Ca -0.10 -3.25 0.00 0.00 -1.87 0.00 0.00 57.45 52.23 1hdl n PHE 21 Cb 0.51 -1.27 0.07 0.00 -1.61 0.00 0.00 39.48 37.19 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 -6.22 1.40 0.00 0.00 0.02 -1.26 -4.44 135.00 124.50 1hdl s PRO 23 Ca -0.14 -0.31 0.00 0.00 0.02 0.00 0.00 61.00 60.57 1hdl s PRO 23 Cb 0.20 -4.97 0.00 0.00 0.02 0.00 0.00 34.50 29.75 1hdl s PRO 23 CO 0.74 -5.13 0.00 0.94 -0.33 0.00 0.00 177.00 173.22 1hdl n GLN 24 N 8.33 0.00 -3.50 5.54 7.27 -1.25 -5.02 117.38 128.76 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 -1.25 0.84 0.00 1.69 2.03 -1.26 -4.93 116.55 113.67 1hdl n ASP 25 Ca 0.00 -2.72 0.07 0.00 0.52 0.00 0.00 54.79 52.66 1hdl n ASP 25 Cb 0.00 -0.63 0.39 0.00 -0.72 0.00 0.00 41.12 40.16 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 2.25 0.34 -0.37 -0.67 5.02 -1.26 -3.62 118.16 119.86 1hdl n LYS 26 Ca 0.26 0.06 0.37 0.00 -2.02 0.00 0.00 58.31 56.98 1hdl n LYS 26 Cb 0.45 -1.50 0.62 0.00 -0.02 0.00 0.00 35.03 34.58 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 1.79 -1.96 0.60 116.57 118.84 1hdl h LYS 27 Ca 0.00 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.51 1hdl h LYS 27 Cb 0.05 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.69 1hdl h LYS 27 CO 0.00 0.00 0.52 0.74 -1.08 0.00 0.00 179.45 179.63 1hdl h PHE 28 N 0.00 0.00 0.00 -1.35 0.04 -1.81 0.17 116.94 113.99 1hdl h PHE 28 Ca 0.62 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.39 1hdl h PHE 28 Cb 3.02 0.00 0.00 0.00 2.20 0.00 0.00 35.95 41.17 1hdl h PHE 28 CO 0.00 0.00 0.14 0.35 -0.60 0.00 0.00 178.31 178.20 1hdl h PHE 29 N 0.00 0.00 0.00 -0.55 3.04 0.07 -0.59 116.94 118.91 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 1.10 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.61 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 -2.42 0.10 -3.97 1.11 1.13 0.59 -4.64 117.38 109.27 1hdl n GLN 30 Ca -0.02 0.24 -0.10 0.00 -1.94 0.00 0.00 57.00 55.19 1hdl n GLN 30 Cb 0.18 -1.50 -0.07 0.00 0.11 0.00 0.00 30.24 28.96 1hdl n GLN 30 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1hdl s SER 31 N -2.69 0.04 0.01 1.08 1.04 -0.31 -5.01 113.70 107.86 1hdl s SER 31 Ca 0.08 -0.89 -0.25 0.00 0.48 0.00 0.00 55.95 55.36 1hdl s SER 31 Cb 0.06 0.44 -0.16 0.00 0.10 0.00 0.00 66.02 66.46 1hdl s SER 31 CO 0.15 -0.90 1.25 0.25 0.98 0.00 0.00 173.24 174.96 1hdl h LEU 32 N 2.53 -0.41 -0.85 2.42 6.46 -1.85 1.47 115.31 125.09 1hdl h LEU 32 Ca -0.32 -0.14 0.08 0.00 -0.12 0.00 0.00 57.88 57.39 1hdl h LEU 32 Cb 1.23 0.11 -0.07 0.00 -0.73 0.00 0.00 40.66 41.20 1hdl h LEU 32 CO 0.48 -0.06 0.51 -0.78 -0.62 0.00 0.00 178.44 177.97 1hdl h ASP 33 N -0.80 0.76 0.41 1.25 1.82 -1.98 0.42 116.42 118.31 1hdl h ASP 33 Ca -0.05 0.03 -0.16 0.00 -0.39 0.00 0.00 57.03 56.47 1hdl h ASP 33 Cb 0.52 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.40 1hdl h ASP 33 CO 0.08 0.46 -0.66 1.23 -1.61 0.00 0.00 179.24 178.74 1hdl h GLY 34 N 0.89 0.25 1.36 -0.78 0.00 -1.64 -3.00 103.07 100.15 1hdl h GLY 34 Ca 0.39 -0.34 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 1hdl h GLY 34 CO -0.21 0.30 -0.10 -2.22 0.00 0.00 0.00 176.54 174.31 1hdl h ILE 35 N 0.16 1.25 -0.55 2.60 1.08 0.45 -3.05 117.51 119.46 1hdl h ILE 35 Ca -0.01 -1.14 0.11 0.00 -0.39 0.00 0.00 64.86 63.43 1hdl h ILE 35 Cb 1.20 1.03 -0.11 0.00 -3.07 0.00 0.00 36.82 35.87 1hdl h ILE 35 CO 0.10 0.39 -0.19 0.24 -0.69 0.00 0.00 178.15 178.00 1hdl h MET 36 N 0.69 -0.05 -0.79 2.37 2.86 -0.14 0.44 114.93 120.31 1hdl h MET 36 Ca 0.12 0.00 0.18 0.00 -2.06 0.00 0.00 59.70 57.94 1hdl h MET 36 Cb 0.57 0.01 -0.14 0.00 0.06 0.00 0.00 31.60 32.10 1hdl h MET 36 CO 0.03 -0.04 -0.05 0.35 1.06 0.00 0.00 176.91 178.27 1hdl h PHE 37 N -0.06 -0.15 -0.83 -0.22 3.04 -1.64 0.68 116.94 117.77 1hdl h PHE 37 Ca 0.26 0.06 0.15 0.00 3.98 0.00 0.00 57.97 62.42 1hdl h PHE 37 Cb 0.46 0.19 -0.09 0.00 2.56 0.00 0.00 35.95 39.06 1hdl h PHE 37 CO -0.50 -0.29 0.41 0.82 -2.02 0.00 0.00 178.31 176.73 1hdl h ILE 38 N 0.07 0.71 0.00 1.41 2.04 -1.03 2.19 117.51 122.90 1hdl h ILE 38 Ca 0.42 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 66.03 1hdl h ILE 38 Cb 0.74 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1hdl h ILE 38 CO -0.73 0.11 -0.24 0.78 0.00 0.00 0.00 178.15 178.06 1hdl h ASN 39 N 0.58 0.00 0.35 1.72 2.35 0.50 -2.79 115.58 118.29 1hdl h ASN 39 Ca 0.45 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.16 1hdl h ASN 39 Cb 0.65 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 1hdl h ASN 39 CO -0.37 0.24 -1.69 1.17 -1.65 0.00 0.00 177.43 175.13 1hdl n LYS 40 N -3.89 0.64 0.00 0.81 4.81 0.13 -3.92 118.16 116.75 1hdl n LYS 40 Ca -0.02 -0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 1hdl n LYS 40 Cb 0.33 -1.63 0.00 0.00 0.02 0.00 0.00 35.03 33.75 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 -1.87 2.18 0.00 0.00 0.00 -1.81 0.17 119.26 117.93 1hdl h ALA 42 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1hdl h ALA 42 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1hdl h ALA 42 CO 0.00 -0.25 0.00 1.15 0.00 0.00 0.00 179.25 180.15 1hdl h THR 43 N 0.06 0.00 0.00 0.00 2.02 -1.60 -3.20 112.91 110.19 1hdl h THR 43 Ca 0.13 -0.73 -0.21 0.00 0.77 0.00 0.00 66.41 66.37 1hdl h THR 43 Cb 0.44 1.72 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 1hdl h THR 43 CO -0.01 0.00 -1.32 0.00 0.37 0.00 0.00 175.52 174.56 1hdl h LYS 45 N -1.00 0.00 0.00 0.00 2.10 -1.19 0.88 116.57 117.36 1hdl h LYS 45 Ca -0.32 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.24 1hdl h LYS 45 Cb 1.17 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.49 1hdl h LYS 45 CO -0.19 0.00 -0.46 0.00 -2.00 0.00 0.00 179.45 176.80 1hdl h MET 46 N 0.00 0.00 -0.32 0.07 -0.00 -1.70 -3.15 114.93 109.83 1hdl h MET 46 Ca 0.18 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.83 1hdl h MET 46 Cb 1.15 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.73 1hdl h MET 46 CO -0.00 0.46 -0.01 0.82 -0.00 0.00 0.00 176.91 178.18 1hdl h ILE 47 N 0.00 1.19 -0.40 -0.10 1.08 0.71 -2.32 117.51 117.67 1hdl h ILE 47 Ca -0.00 -0.76 -0.14 0.00 -0.39 0.00 0.00 64.86 63.56 1hdl h ILE 47 Cb 1.27 0.96 -0.01 0.00 -3.07 0.00 0.00 36.82 35.97 1hdl h ILE 47 CO 0.06 0.26 -0.30 -0.07 -0.69 0.00 0.00 178.15 177.40 1hdl h LEU 48 N 0.48 0.93 -1.47 1.44 3.38 -1.52 -2.58 115.31 115.96 1hdl h LEU 48 Ca 0.10 -0.38 0.22 0.00 0.09 0.00 0.00 57.88 57.91 1hdl h LEU 48 Cb 0.32 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1hdl h LEU 48 CO 0.01 1.15 0.88 -0.33 0.09 0.00 0.00 178.44 180.25 1hdl h GLU 49 N 0.75 0.00 0.01 1.13 4.39 -1.46 1.45 114.58 120.85 1hdl h GLU 49 Ca 0.08 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.58 1hdl h GLU 49 Cb 0.87 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.51 1hdl h GLU 49 CO 0.08 0.00 -0.89 0.87 -1.16 0.00 0.00 179.01 177.91 1hdl h LYS 50 N 0.00 0.18 0.00 2.33 1.79 -1.50 -3.13 116.57 116.24 1hdl h LYS 50 Ca 0.36 -0.20 -0.01 0.00 -2.18 0.00 0.00 60.65 58.63 1hdl h LYS 50 Cb 2.13 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 32.83 1hdl h LYS 50 CO -0.00 0.95 -0.06 1.49 -1.08 0.00 0.00 179.45 180.75 1hdl h GLU 51 N 0.09 0.00 -7.47 3.15 4.81 0.19 -3.43 114.58 111.93 1hdl h GLU 51 Ca -0.04 0.00 -0.49 0.00 -0.13 0.00 0.00 59.36 58.69 1hdl h GLU 51 Cb 1.52 0.00 0.08 0.00 0.63 0.00 0.00 28.75 30.98 1hdl h GLU 51 CO 0.13 0.06 0.42 0.00 -0.73 0.00 0.00 179.01 178.88 1hdl s ALA 52 N -4.65 2.90 -1.16 2.92 0.00 -1.18 -4.96 121.76 115.64 1hdl s ALA 52 Ca -0.04 -0.33 0.27 0.00 0.00 0.00 0.00 51.96 51.86 1hdl s ALA 52 Cb 0.15 -3.03 0.88 0.00 0.00 0.00 0.00 23.12 21.13 1hdl s ALA 52 CO 0.61 -1.12 1.67 1.63 0.00 0.00 0.00 175.76 178.55 1hdl n LYS 53 N -3.00 0.17 0.22 0.00 5.02 -1.26 -3.61 118.16 115.71 1hdl n LYS 53 Ca 0.07 -0.07 0.15 0.00 -2.02 0.00 0.00 58.31 56.44 1hdl n LYS 53 Cb 0.57 -1.50 0.61 0.00 -0.02 0.00 0.00 35.03 34.70 1hdl n LYS 53 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1hdl h SER 54 N 0.17 0.00 0.00 4.39 4.64 -1.92 -3.53 113.55 117.30 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 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1hdl h SER 54 CO 0.00 0.00 0.00 1.67 -0.87 0.00 0.00 176.83 177.63