#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 0.58 2.50 0.00 0.00 -1.26 -4.85 105.19 102.16 1r48 n GLY 2 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 5.00 -1.15 2.64 -0.02 0.00 -1.26 -3.66 105.19 106.73 1r48 n GLY 3 Ca 0.00 0.91 -0.13 0.00 0.00 0.00 0.00 46.02 46.80 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 -0.36 -5.33 -0.02 1.61 8.00 -1.26 -4.82 116.55 114.36 1r48 n ASP 4 Ca 0.09 0.31 0.21 0.00 0.71 0.00 0.00 54.79 56.11 1r48 n ASP 4 Cb 0.34 -3.95 0.69 0.00 -0.02 0.00 0.00 41.12 38.18 1r48 n ASP 4 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 1r48 h ASN 5 N 0.00 0.01 -0.01 -2.24 -0.00 -1.89 0.12 115.58 111.57 1r48 h ASN 5 Ca -0.26 0.00 -0.11 0.00 -0.00 0.00 0.00 56.30 55.93 1r48 h ASN 5 Cb 1.09 -0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.42 1r48 h ASN 5 CO 0.38 0.00 -0.43 0.40 -0.00 0.00 0.00 177.43 177.79 1r48 h ILE 6 N 0.01 1.47 -0.26 2.57 2.04 -1.92 -2.94 117.51 118.49 1r48 h ILE 6 Ca 0.28 -1.98 0.07 0.00 1.00 0.00 0.00 64.86 64.23 1r48 h ILE 6 Cb 1.09 2.63 -0.01 0.00 -0.74 0.00 0.00 36.82 39.79 1r48 h ILE 6 CO -0.01 0.56 0.26 -0.08 0.00 0.00 0.00 178.15 178.89 1r48 h GLU 7 N -0.27 0.00 0.08 2.37 4.81 -1.39 -0.28 114.58 119.90 1r48 h GLU 7 Ca -0.05 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.99 1r48 h GLU 7 Cb 1.15 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.55 1r48 h GLU 7 CO 0.08 0.00 -0.81 0.37 -0.73 0.00 0.00 179.01 177.93 1r48 h GLN 8 N 0.00 0.41 -0.91 1.92 -0.00 -1.30 -2.62 115.11 112.61 1r48 h GLN 8 Ca 0.12 -0.54 0.00 0.00 -0.00 0.00 0.00 58.65 58.23 1r48 h GLN 8 Cb 0.65 0.18 -0.04 0.00 0.00 0.00 0.00 27.48 28.26 1r48 h GLN 8 CO -0.00 1.21 0.58 -0.22 0.00 0.00 0.00 178.83 180.40 1r48 h LYS 9 N -0.14 1.21 -0.34 1.69 3.64 -0.92 -2.64 116.57 119.08 1r48 h LYS 9 Ca -0.12 -0.09 -0.10 0.00 -1.27 0.00 0.00 60.65 59.07 1r48 h LYS 9 Cb 1.56 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 33.10 1r48 h LYS 9 CO 0.15 0.82 -0.18 -0.84 -2.27 0.00 0.00 179.45 177.13 1r48 h ILE 10 N 1.24 1.29 -1.10 2.00 3.07 -1.32 -2.82 117.51 119.87 1r48 h ILE 10 Ca 0.33 -1.31 0.30 0.00 1.55 0.00 0.00 64.86 65.73 1r48 h ILE 10 Cb -0.11 1.41 -0.09 0.00 -0.27 0.00 0.00 36.82 37.76 1r48 h ILE 10 CO -0.07 0.43 0.72 -0.78 -1.05 0.00 0.00 178.15 177.40 1r48 h ASP 11 N 0.49 0.35 -0.05 2.16 1.82 -1.10 0.63 116.42 120.72 1r48 h ASP 11 Ca 0.07 0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.78 1r48 h ASP 11 Cb 0.73 0.03 -0.00 0.00 0.68 0.00 0.00 39.33 40.76 1r48 h ASP 11 CO 0.05 0.04 -0.00 0.44 -1.61 0.00 0.00 179.24 178.16 1r48 h ASP 12 N 0.29 0.09 -0.27 2.28 3.32 -1.35 -2.92 116.42 117.87 1r48 h ASP 12 Ca 0.62 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1r48 h ASP 12 Cb 1.75 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 41.26 1r48 h ASP 12 CO -0.27 0.38 0.18 0.40 -1.72 0.00 0.00 179.24 178.21 1r48 h ILE 13 N -0.21 1.08 -1.15 0.35 2.04 0.08 -1.91 117.51 117.79 1r48 h ILE 13 Ca 0.01 -0.15 0.33 0.00 1.00 0.00 0.00 64.86 66.05 1r48 h ILE 13 Cb 0.34 0.69 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 1r48 h ILE 13 CO 0.00 0.07 0.80 -0.78 0.00 0.00 0.00 178.15 178.25 1r48 h ASP 14 N 0.36 0.14 0.87 1.72 1.82 -0.09 1.35 116.42 122.59 1r48 h ASP 14 Ca 0.10 0.03 -0.16 0.00 -0.39 0.00 0.00 57.03 56.61 1r48 h ASP 14 Cb -0.03 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 39.97 1r48 h ASP 14 CO -0.02 0.02 -0.75 -0.74 -1.61 0.00 0.00 179.24 176.13 1r48 h HIS 15 N 0.12 0.00 0.09 0.28 2.76 -1.16 -2.91 115.15 114.33 1r48 h HIS 15 Ca 0.59 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.47 1r48 h HIS 15 Cb 2.06 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 31.01 1r48 h HIS 15 CO -0.00 0.75 -1.48 0.93 -1.30 0.00 0.00 177.93 176.83 1r48 h GLU 16 N 0.00 0.19 -0.20 5.26 5.08 0.17 -3.01 114.58 122.06 1r48 h GLU 16 Ca -0.01 -0.32 -0.06 0.00 -1.00 0.00 0.00 59.36 57.97 1r48 h GLU 16 Cb 1.39 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.75 1r48 h GLU 16 CO 0.10 1.03 -0.15 0.82 -1.00 0.00 0.00 179.01 179.81 1r48 h ILE 17 N 0.05 1.21 0.14 3.13 2.04 0.12 -2.88 117.51 121.33 1r48 h ILE 17 Ca -0.22 -0.95 -0.29 0.00 1.00 0.00 0.00 64.86 64.41 1r48 h ILE 17 Cb 1.98 1.23 0.02 0.00 -0.74 0.00 0.00 36.82 39.31 1r48 h ILE 17 CO 0.15 0.30 -1.26 0.00 0.00 0.00 0.00 178.15 177.33 1r48 h ALA 18 N 1.53 0.04 -0.54 1.87 0.00 -1.61 -3.09 119.26 117.47 1r48 h ALA 18 Ca 0.06 -0.82 0.08 0.00 0.00 0.00 0.00 54.91 54.23 1r48 h ALA 18 Cb 0.46 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 1r48 h ALA 18 CO 0.03 0.80 0.17 0.22 0.00 0.00 0.00 179.25 180.48 1r48 h ASP 19 N 0.17 0.15 0.02 0.00 1.82 -1.36 -0.05 116.42 117.16 1r48 h ASP 19 Ca -0.17 0.07 -0.00 0.00 -0.39 0.00 0.00 57.03 56.54 1r48 h ASP 19 Cb 1.95 0.07 0.00 0.00 0.68 0.00 0.00 39.33 42.03 1r48 h ASP 19 CO 0.23 0.11 -0.01 -0.07 -1.61 0.00 0.00 179.24 177.88 1r48 h LEU 20 N 0.34 -0.02 -0.85 2.28 3.38 -1.62 -2.98 115.31 115.84 1r48 h LEU 20 Ca 0.27 -0.26 0.13 0.00 0.09 0.00 0.00 57.88 58.10 1r48 h LEU 20 Cb 0.32 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 40.99 1r48 h LEU 20 CO -0.29 0.25 0.46 -0.61 0.09 0.00 0.00 178.44 178.35 1r48 h GLN 21 N -0.29 0.67 -0.99 1.13 4.15 -1.37 -0.68 115.11 117.74 1r48 h GLN 21 Ca -0.00 -0.04 0.05 0.00 0.77 0.00 0.00 58.65 59.42 1r48 h GLN 21 Cb 0.28 -0.15 -0.06 0.00 0.21 0.00 0.00 27.48 27.76 1r48 h GLN 21 CO 0.00 0.45 0.65 0.00 -1.93 0.00 0.00 178.83 177.99 1r48 h ALA 22 N 1.53 1.38 -0.46 3.38 0.00 -0.92 -0.21 119.26 123.95 1r48 h ALA 22 Ca 0.45 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.25 1r48 h ALA 22 Cb 0.57 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1r48 h ALA 22 CO -0.32 0.51 -0.01 0.87 0.00 0.00 0.00 179.25 180.30 1r48 h LYS 23 N 1.22 0.77 -0.09 0.00 1.57 -0.98 -2.13 116.57 116.92 1r48 h LYS 23 Ca 0.40 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.90 1r48 h LYS 23 Cb 0.06 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1r48 h LYS 23 CO -0.14 0.78 -0.25 0.00 -0.57 0.00 0.00 179.45 179.27 1r48 h ARG 24 N 0.72 0.32 -0.13 3.15 3.08 -0.91 -3.05 114.38 117.55 1r48 h ARG 24 Ca 0.14 -0.23 0.03 0.00 0.07 0.00 0.00 59.98 59.99 1r48 h ARG 24 Cb 0.45 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 1r48 h ARG 24 CO 0.02 0.85 -0.07 1.15 -1.07 0.00 0.00 179.97 180.85 1r48 h THR 25 N -0.15 0.78 -0.85 2.04 2.02 -0.98 0.45 112.91 116.21 1r48 h THR 25 Ca -0.01 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.29 1r48 h THR 25 Cb 0.87 0.78 -0.08 0.00 -1.74 0.00 0.00 68.15 67.97 1r48 h THR 25 CO 0.05 0.00 0.48 0.08 0.37 0.00 0.00 175.52 176.50 1r48 h ARG 26 N -0.06 0.74 -0.02 6.66 0.11 -1.47 0.35 114.38 120.69 1r48 h ARG 26 Ca 0.08 -0.04 -0.15 0.00 0.10 0.00 0.00 59.98 59.96 1r48 h ARG 26 Cb 0.17 -0.17 -0.02 0.00 1.11 0.00 0.00 29.97 31.07 1r48 h ARG 26 CO -0.17 0.49 -0.68 -0.07 0.10 0.00 0.00 179.97 179.63 1r48 h LEU 27 N 0.76 0.11 -0.01 0.08 4.07 -1.27 -2.94 115.31 116.11 1r48 h LEU 27 Ca 0.43 -0.07 -0.00 0.00 0.08 0.00 0.00 57.88 58.32 1r48 h LEU 27 Cb 0.48 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.19 1r48 h LEU 27 CO -0.29 0.76 -0.00 0.58 -1.08 0.00 0.00 178.44 178.40 1r48 h VAL 28 N 0.07 1.35 -0.86 1.22 2.07 0.21 -2.19 116.25 118.12 1r48 h VAL 28 Ca -0.01 -1.05 0.16 0.00 0.82 0.00 0.00 66.70 66.63 1r48 h VAL 28 Cb 1.21 2.05 -0.06 0.00 -1.52 0.00 0.00 31.29 32.97 1r48 h VAL 28 CO 0.10 0.27 0.56 -0.61 0.02 0.00 0.00 177.57 177.91 1r48 h GLN 29 N -0.43 0.51 0.00 1.57 5.75 -0.45 1.00 115.11 123.07 1r48 h GLN 29 Ca 0.00 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 58.42 1r48 h GLN 29 Cb 0.45 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.88 1r48 h GLN 29 CO 0.00 0.34 -0.23 0.37 -2.65 0.00 0.00 178.83 176.66 1r48 h GLN 30 N 0.53 0.00 -2.38 1.69 5.75 -1.33 -3.27 115.11 116.10 1r48 h GLN 30 Ca 0.44 0.00 -0.74 0.00 -0.15 0.00 0.00 58.65 58.20 1r48 h GLN 30 Cb 0.90 0.00 -0.32 0.00 1.07 0.00 0.00 27.48 29.13 1r48 h GLN 30 CO -0.18 0.23 0.45 0.72 -2.65 0.00 0.00 178.83 177.40 1r48 n HIS 31 N -3.46 3.06 0.24 3.99 8.25 0.34 -4.81 115.22 122.82 1r48 n HIS 31 Ca -0.00 -3.05 0.09 0.00 -0.26 0.00 0.00 57.72 54.50 1r48 n HIS 31 Cb 0.40 -0.98 0.61 0.00 1.12 0.00 0.00 29.99 31.14 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 4.13 0.00 0.00 -0.41 0.13 -1.61 -3.47 132.00 130.78 1r48 h PRO 32 Ca 0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.48 1r48 h PRO 32 Cb 0.45 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.58 1r48 h PRO 32 CO 1.09 0.17 0.00 2.89 -0.23 0.00 0.00 178.00 181.92