#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r48 n GLY 2 N 0.00 2.90 0.00 0.00 0.00 -1.26 -4.83 105.19 101.99 1r48 n GLY 2 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1r48 n GLY 2 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r48 n GLY 3 N 0.00 0.34 0.93 -0.02 0.00 -1.26 -4.67 105.19 100.51 1r48 n GLY 3 Ca 0.00 -1.08 0.08 0.00 0.00 0.00 0.00 46.02 45.01 1r48 n GLY 3 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r48 n ASP 4 N 0.00 3.71 -0.02 1.61 9.92 -1.26 -4.58 116.55 125.93 1r48 n ASP 4 Ca 0.00 -2.54 0.23 0.00 -0.53 0.00 0.00 54.79 51.95 1r48 n ASP 4 Cb 0.00 -0.43 0.72 0.00 -0.64 0.00 0.00 41.12 40.76 1r48 n ASP 4 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 1r48 h ASN 5 N 2.31 0.00 0.12 -2.24 -0.26 -1.88 0.66 115.58 114.29 1r48 h ASN 5 Ca 0.00 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.56 1r48 h ASN 5 Cb 1.19 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 38.46 1r48 h ASN 5 CO 0.15 0.00 -0.85 0.40 -1.06 0.00 0.00 177.43 176.07 1r48 h ILE 6 N 0.00 1.45 -0.15 2.81 2.04 -1.90 -3.22 117.51 118.54 1r48 h ILE 6 Ca 0.28 -2.49 0.04 0.00 1.00 0.00 0.00 64.86 63.69 1r48 h ILE 6 Cb 1.22 3.12 -0.01 0.00 -0.74 0.00 0.00 36.82 40.42 1r48 h ILE 6 CO -0.00 0.70 0.23 -0.08 0.00 0.00 0.00 178.15 178.99 1r48 h GLU 7 N -0.43 0.00 0.11 2.37 4.81 -1.23 0.11 114.58 120.32 1r48 h GLU 7 Ca -0.16 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.80 1r48 h GLU 7 Cb 1.60 0.00 0.03 0.00 0.63 0.00 0.00 28.75 31.00 1r48 h GLU 7 CO 0.12 0.00 -1.12 0.37 -0.73 0.00 0.00 179.01 177.65 1r48 h GLN 8 N 0.00 0.56 -0.87 1.92 -0.00 -1.26 -2.78 115.11 112.68 1r48 h GLN 8 Ca 0.07 -0.75 -0.01 0.00 -0.00 0.00 0.00 58.65 57.96 1r48 h GLN 8 Cb 0.53 0.25 -0.04 0.00 0.00 0.00 0.00 27.48 28.22 1r48 h GLN 8 CO -0.00 1.33 0.50 -0.22 0.00 0.00 0.00 178.83 180.45 1r48 h LYS 9 N 0.14 1.20 -0.32 1.69 3.64 -1.00 -2.66 116.57 119.25 1r48 h LYS 9 Ca -0.17 -0.12 -0.10 0.00 -1.27 0.00 0.00 60.65 58.99 1r48 h LYS 9 Cb 1.82 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 33.39 1r48 h LYS 9 CO 0.21 0.85 -0.19 -0.84 -2.27 0.00 0.00 179.45 177.22 1r48 h ILE 10 N 1.21 1.29 -1.01 2.00 3.07 -1.47 -2.83 117.51 119.77 1r48 h ILE 10 Ca 0.31 -1.31 0.26 0.00 1.55 0.00 0.00 64.86 65.67 1r48 h ILE 10 Cb -0.02 1.44 -0.07 0.00 -0.27 0.00 0.00 36.82 37.90 1r48 h ILE 10 CO -0.05 0.43 0.67 0.44 -1.05 0.00 0.00 178.15 178.58 1r48 h ASP 11 N 0.46 0.33 -0.19 2.16 3.32 -1.18 0.57 116.42 121.89 1r48 h ASP 11 Ca 0.07 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 1r48 h ASP 11 Cb 0.73 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 1r48 h ASP 11 CO 0.05 0.09 -0.02 -0.78 -1.72 0.00 0.00 179.24 176.86 1r48 h ASP 12 N 0.30 0.35 -0.38 6.45 1.82 -1.33 -2.91 116.42 120.73 1r48 h ASP 12 Ca 0.54 -0.34 -0.00 0.00 -0.39 0.00 0.00 57.03 56.84 1r48 h ASP 12 Cb 1.54 -0.10 -0.02 0.00 0.68 0.00 0.00 39.33 41.44 1r48 h ASP 12 CO -0.19 0.61 0.23 0.40 -1.61 0.00 0.00 179.24 178.68 1r48 h ILE 13 N 0.09 1.12 -1.08 2.25 2.04 0.03 -1.84 117.51 120.13 1r48 h ILE 13 Ca 0.05 -0.28 0.30 0.00 1.00 0.00 0.00 64.86 65.93 1r48 h ILE 13 Cb 0.44 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 1r48 h ILE 13 CO 0.01 0.12 0.75 -0.78 0.00 0.00 0.00 178.15 178.26 1r48 h ASP 14 N 0.50 0.16 0.90 1.72 3.58 -0.21 1.28 116.42 124.36 1r48 h ASP 14 Ca 0.14 0.03 -0.15 0.00 0.42 0.00 0.00 57.03 57.47 1r48 h ASP 14 Cb -0.00 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.03 1r48 h ASP 14 CO -0.03 0.03 -0.70 -0.74 -2.88 0.00 0.00 179.24 174.93 1r48 h HIS 15 N 0.14 0.00 0.08 0.28 2.76 -1.15 -2.93 115.15 114.33 1r48 h HIS 15 Ca 0.55 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.43 1r48 h HIS 15 Cb 1.90 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.84 1r48 h HIS 15 CO -0.00 0.70 -1.46 0.93 -1.30 0.00 0.00 177.93 176.79 1r48 h GLU 16 N 0.00 0.16 -0.26 5.26 4.39 0.15 -2.98 114.58 121.31 1r48 h GLU 16 Ca -0.01 -0.27 -0.06 0.00 0.34 0.00 0.00 59.36 59.36 1r48 h GLU 16 Cb 1.33 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 30.07 1r48 h GLU 16 CO 0.09 0.99 -0.12 0.82 -1.16 0.00 0.00 179.01 179.63 1r48 h ILE 17 N 0.04 1.22 0.13 3.13 2.04 0.09 -2.85 117.51 121.32 1r48 h ILE 17 Ca -0.21 -0.95 -0.28 0.00 1.00 0.00 0.00 64.86 64.42 1r48 h ILE 17 Cb 1.97 1.15 0.01 0.00 -0.74 0.00 0.00 36.82 39.22 1r48 h ILE 17 CO 0.14 0.31 -1.24 0.00 0.00 0.00 0.00 178.15 177.36 1r48 h ALA 18 N 1.48 0.08 -0.57 1.87 0.00 -1.61 -3.10 119.26 117.41 1r48 h ALA 18 Ca 0.08 -0.84 0.09 0.00 0.00 0.00 0.00 54.91 54.23 1r48 h ALA 18 Cb 0.45 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 1r48 h ALA 18 CO 0.03 0.87 0.20 0.22 0.00 0.00 0.00 179.25 180.57 1r48 h ASP 19 N 0.13 0.19 -0.00 0.00 3.58 -1.34 -0.12 116.42 118.86 1r48 h ASP 19 Ca -0.15 0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.37 1r48 h ASP 19 Cb 1.95 0.06 -0.00 0.00 1.72 0.00 0.00 39.33 43.06 1r48 h ASP 19 CO 0.22 0.12 0.00 -0.07 -2.88 0.00 0.00 179.24 176.63 1r48 h LEU 20 N 0.38 0.00 -0.87 2.28 3.38 -1.62 -3.03 115.31 115.83 1r48 h LEU 20 Ca 0.28 -0.30 0.16 0.00 0.09 0.00 0.00 57.88 58.12 1r48 h LEU 20 Cb 0.34 -0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.99 1r48 h LEU 20 CO -0.29 0.30 0.45 -0.61 0.09 0.00 0.00 178.44 178.38 1r48 h GLN 21 N -0.30 0.60 -0.57 1.13 4.15 -1.35 -0.66 115.11 118.12 1r48 h GLN 21 Ca 0.00 -0.04 0.05 0.00 0.77 0.00 0.00 58.65 59.44 1r48 h GLN 21 Cb 0.30 -0.14 -0.05 0.00 0.21 0.00 0.00 27.48 27.80 1r48 h GLN 21 CO 0.00 0.40 0.29 0.00 -1.93 0.00 0.00 178.83 177.59 1r48 h ALA 22 N 1.58 0.74 -0.91 3.38 0.00 -0.93 0.19 119.26 123.31 1r48 h ALA 22 Ca 0.49 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.42 1r48 h ALA 22 Cb 0.73 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 1r48 h ALA 22 CO -0.38 -0.06 0.54 0.87 0.00 0.00 0.00 179.25 180.22 1r48 h LYS 23 N 0.55 1.24 -0.33 0.00 1.57 -1.02 -0.97 116.57 117.61 1r48 h LYS 23 Ca 0.26 -0.12 -0.14 0.00 -1.87 0.00 0.00 60.65 58.77 1r48 h LYS 23 Cb 0.17 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 1r48 h LYS 23 CO -0.18 0.87 -0.36 -0.09 -0.57 0.00 0.00 179.45 179.13 1r48 h ARG 24 N 1.25 0.82 0.31 3.15 2.43 -0.78 -3.05 114.38 118.52 1r48 h ARG 24 Ca 0.32 -0.44 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 1r48 h ARG 24 Cb -0.04 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1r48 h ARG 24 CO -0.06 1.08 -0.15 1.15 -1.51 0.00 0.00 179.97 180.48 1r48 h THR 25 N 0.60 0.71 -0.99 0.20 2.02 -0.31 0.49 112.91 115.63 1r48 h THR 25 Ca 0.05 -0.12 0.21 0.00 0.77 0.00 0.00 66.41 67.32 1r48 h THR 25 Cb 0.94 0.78 -0.11 0.00 -1.74 0.00 0.00 68.15 68.02 1r48 h THR 25 CO 0.09 0.03 0.58 0.08 0.37 0.00 0.00 175.52 176.66 1r48 h ARG 26 N -0.48 0.64 -0.04 6.66 0.11 -1.24 0.50 114.38 120.53 1r48 h ARG 26 Ca -0.04 -0.04 -0.16 0.00 0.10 0.00 0.00 59.98 59.84 1r48 h ARG 26 Cb 0.36 -0.14 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 1r48 h ARG 26 CO 0.07 0.43 -0.69 -0.07 0.10 0.00 0.00 179.97 179.80 1r48 h LEU 27 N 0.66 0.25 0.14 0.08 4.07 -1.37 -2.79 115.31 116.35 1r48 h LEU 27 Ca 0.60 -0.16 -0.01 0.00 0.08 0.00 0.00 57.88 58.39 1r48 h LEU 27 Cb 1.02 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.69 1r48 h LEU 27 CO -0.43 0.86 -0.07 0.58 -1.08 0.00 0.00 178.44 178.30 1r48 h VAL 28 N 0.14 1.02 -0.68 1.22 2.07 0.21 -2.27 116.25 117.96 1r48 h VAL 28 Ca -0.02 -0.89 0.19 0.00 0.82 0.00 0.00 66.70 66.80 1r48 h VAL 28 Cb 1.23 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 32.52 1r48 h VAL 28 CO 0.11 0.20 0.48 -0.61 0.02 0.00 0.00 177.57 177.77 1r48 h GLN 29 N -0.63 0.06 0.00 1.57 4.15 -0.43 1.10 115.11 120.93 1r48 h GLN 29 Ca -0.02 -0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.33 1r48 h GLN 29 Cb 0.48 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.15 1r48 h GLN 29 CO 0.03 0.04 -0.30 0.37 -1.93 0.00 0.00 178.83 177.04 1r48 h GLN 30 N 0.06 0.00 -2.26 1.69 5.75 -1.27 -3.30 115.11 115.79 1r48 h GLN 30 Ca 0.32 0.00 -0.74 0.00 -0.15 0.00 0.00 58.65 58.09 1r48 h GLN 30 Cb 1.20 0.00 -0.32 0.00 1.07 0.00 0.00 27.48 29.43 1r48 h GLN 30 CO -0.02 0.30 0.49 0.72 -2.65 0.00 0.00 178.83 177.67 1r48 n HIS 31 N -3.40 3.20 -0.00 3.99 8.25 0.38 -4.80 115.22 122.84 1r48 n HIS 31 Ca 0.00 -3.03 -0.07 0.00 -0.26 0.00 0.00 57.72 54.36 1r48 n HIS 31 Cb 0.50 -0.97 0.11 0.00 1.12 0.00 0.00 29.99 30.76 1r48 n HIS 31 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1r48 h PRO 32 N 3.81 0.55 0.00 -0.41 0.13 -1.64 -3.47 132.00 130.97 1r48 h PRO 32 Ca 0.41 -0.27 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1r48 h PRO 32 Cb 0.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.51 1r48 h PRO 32 CO 1.06 0.85 0.00 2.89 -0.23 0.00 0.00 178.00 182.57