#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 0.78 0.00 0.00 0.00 -1.26 -5.11 105.19 99.60 1r48 n GLY 2 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.74 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 2.41 0.83 1.13 -0.02 0.00 -1.26 -4.89 105.19 103.38 1r48 n GLY 3 Ca 0.00 -0.15 0.07 0.00 0.00 0.00 0.00 46.02 45.94 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 3.29 -0.00 1.61 8.00 -1.26 -4.31 116.55 123.88 1r48 n ASP 4 Ca 0.00 -2.26 0.22 0.00 0.71 0.00 0.00 54.79 53.47 1r48 n ASP 4 Cb 0.00 -0.45 0.73 0.00 -0.02 0.00 0.00 41.12 41.37 1r48 n ASP 4 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1r48 h ASN 5 N 2.82 0.00 0.12 -2.24 4.21 -2.00 0.98 115.58 119.46 1r48 h ASN 5 Ca 0.00 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 57.34 1r48 h ASN 5 Cb 1.01 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 38.23 1r48 h ASN 5 CO 0.14 0.00 -0.79 0.40 -1.29 0.00 0.00 177.43 175.89 1r48 h ILE 6 N 0.00 1.49 -0.28 2.81 2.04 -1.96 -2.79 117.51 118.82 1r48 h ILE 6 Ca 0.27 -2.50 0.08 0.00 1.00 0.00 0.00 64.86 63.71 1r48 h ILE 6 Cb 1.23 3.16 -0.01 0.00 -0.74 0.00 0.00 36.82 40.46 1r48 h ILE 6 CO -0.00 0.70 0.20 -0.08 0.00 0.00 0.00 178.15 178.97 1r48 h GLU 7 N -0.45 0.00 0.22 2.37 4.22 -1.17 0.11 114.58 119.87 1r48 h GLU 7 Ca -0.15 0.00 -0.30 0.00 0.08 0.00 0.00 59.36 59.00 1r48 h GLU 7 Cb 1.57 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.86 1r48 h GLU 7 CO 0.12 0.00 -1.29 0.37 -2.18 0.00 0.00 179.01 176.03 1r48 h GLN 8 N 0.00 0.49 -0.37 1.92 4.15 -1.20 -2.87 115.11 117.23 1r48 h GLN 8 Ca 0.13 -0.82 -0.02 0.00 0.77 0.00 0.00 58.65 58.71 1r48 h GLN 8 Cb 0.54 0.30 -0.02 0.00 0.21 0.00 0.00 27.48 28.51 1r48 h GLN 8 CO -0.00 1.39 0.13 0.87 -1.93 0.00 0.00 178.83 179.28 1r48 h LYS 9 N 0.03 0.53 -0.13 1.69 1.57 -0.94 -2.72 116.57 116.60 1r48 h LYS 9 Ca -0.22 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.34 1r48 h LYS 9 Cb 2.01 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 34.23 1r48 h LYS 9 CO 0.24 0.47 -0.47 -0.84 -0.57 0.00 0.00 179.45 178.28 1r48 h ILE 10 N 0.53 1.36 -0.98 1.86 3.07 -1.09 -3.03 117.51 119.23 1r48 h ILE 10 Ca 0.13 -1.76 0.25 0.00 1.55 0.00 0.00 64.86 65.02 1r48 h ILE 10 Cb 0.15 2.10 -0.07 0.00 -0.27 0.00 0.00 36.82 38.73 1r48 h ILE 10 CO -0.01 0.53 0.66 -0.78 -1.05 0.00 0.00 178.15 177.50 1r48 h ASP 11 N 0.17 0.32 -0.10 2.16 1.82 -1.25 0.43 116.42 119.97 1r48 h ASP 11 Ca -0.02 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 56.64 1r48 h ASP 11 Cb 1.10 -0.01 -0.00 0.00 0.68 0.00 0.00 39.33 41.10 1r48 h ASP 11 CO 0.10 0.09 -0.02 -0.78 -1.61 0.00 0.00 179.24 177.02 1r48 h ASP 12 N 0.30 0.19 -0.36 2.28 1.82 -1.43 -2.97 116.42 116.24 1r48 h ASP 12 Ca 0.52 -0.36 0.01 0.00 -0.39 0.00 0.00 57.03 56.80 1r48 h ASP 12 Cb 1.48 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 41.42 1r48 h ASP 12 CO -0.18 0.51 0.23 0.40 -1.61 0.00 0.00 179.24 178.60 1r48 h ILE 13 N -0.13 1.07 -1.10 2.25 2.04 -0.25 -1.85 117.51 119.54 1r48 h ILE 13 Ca 0.03 -0.16 0.30 0.00 1.00 0.00 0.00 64.86 66.03 1r48 h ILE 13 Cb 0.43 0.56 -0.08 0.00 -0.74 0.00 0.00 36.82 36.99 1r48 h ILE 13 CO 0.01 0.09 0.74 -0.78 0.00 0.00 0.00 178.15 178.20 1r48 h ASP 14 N 0.47 0.28 0.80 1.72 3.58 -0.30 1.30 116.42 124.28 1r48 h ASP 14 Ca 0.14 0.06 -0.13 0.00 0.42 0.00 0.00 57.03 57.52 1r48 h ASP 14 Cb -0.03 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.02 1r48 h ASP 14 CO -0.04 0.04 -0.62 -0.74 -2.88 0.00 0.00 179.24 174.99 1r48 h HIS 15 N 0.24 0.00 0.08 0.28 2.76 -1.18 -2.93 115.15 114.39 1r48 h HIS 15 Ca 0.60 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.48 1r48 h HIS 15 Cb 1.82 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.76 1r48 h HIS 15 CO -0.00 0.62 -1.51 0.93 -1.30 0.00 0.00 177.93 176.67 1r48 h GLU 16 N 0.00 0.17 -0.15 5.26 5.08 0.16 -3.03 114.58 122.06 1r48 h GLU 16 Ca -0.01 -0.28 -0.05 0.00 -1.00 0.00 0.00 59.36 58.02 1r48 h GLU 16 Cb 1.19 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1r48 h GLU 16 CO 0.08 0.98 -0.13 0.82 -1.00 0.00 0.00 179.01 179.76 1r48 h ILE 17 N 0.05 1.18 0.24 3.13 2.04 0.18 -2.86 117.51 121.47 1r48 h ILE 17 Ca -0.23 -0.79 -0.33 0.00 1.00 0.00 0.00 64.86 64.51 1r48 h ILE 17 Cb 1.98 1.22 0.04 0.00 -0.74 0.00 0.00 36.82 39.31 1r48 h ILE 17 CO 0.14 0.24 -1.48 0.00 0.00 0.00 0.00 178.15 177.05 1r48 h ALA 18 N 1.65 -0.13 -0.76 1.87 0.00 -1.61 -3.09 119.26 117.18 1r48 h ALA 18 Ca 0.05 -0.88 0.11 0.00 0.00 0.00 0.00 54.91 54.19 1r48 h ALA 18 Cb 0.38 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 1r48 h ALA 18 CO 0.02 0.73 0.38 0.22 0.00 0.00 0.00 179.25 180.60 1r48 h ASP 19 N 0.14 0.47 0.24 0.00 1.82 -1.38 -0.01 116.42 117.71 1r48 h ASP 19 Ca -0.25 0.07 -0.01 0.00 -0.39 0.00 0.00 57.03 56.45 1r48 h ASP 19 Cb 2.16 -0.00 0.00 0.00 0.68 0.00 0.00 39.33 42.17 1r48 h ASP 19 CO 0.27 0.25 -0.11 -0.07 -1.61 0.00 0.00 179.24 177.96 1r48 h LEU 20 N 0.61 -0.27 -1.71 2.28 3.38 -1.62 -2.74 115.31 115.23 1r48 h LEU 20 Ca 0.39 -0.25 0.19 0.00 0.09 0.00 0.00 57.88 58.30 1r48 h LEU 20 Cb 0.46 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 1r48 h LEU 20 CO -0.30 0.16 0.55 -0.61 0.09 0.00 0.00 178.44 178.32 1r48 h GLN 21 N -0.77 0.25 0.00 1.13 4.15 -1.40 0.23 115.11 118.70 1r48 h GLN 21 Ca -0.03 -0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.24 1r48 h GLN 21 Cb 0.50 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.12 1r48 h GLN 21 CO 0.05 0.16 -0.64 0.00 -1.93 0.00 0.00 178.83 176.48 1r48 h ALA 22 N 1.63 0.88 -0.07 3.38 0.00 -0.96 -3.05 119.26 121.07 1r48 h ALA 22 Ca 0.40 -0.58 -0.20 0.00 0.00 0.00 0.00 54.91 54.53 1r48 h ALA 22 Cb 1.18 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1r48 h ALA 22 CO -0.10 0.80 -0.78 0.87 0.00 0.00 0.00 179.25 180.05 1r48 h LYS 23 N 0.00 0.45 -0.19 0.00 6.56 -0.25 -2.87 116.57 120.27 1r48 h LYS 23 Ca -0.01 -0.39 -0.03 0.00 -1.06 0.00 0.00 60.65 59.17 1r48 h LYS 23 Cb 1.17 0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 32.91 1r48 h LYS 23 CO 0.08 1.03 0.00 0.00 -2.06 0.00 0.00 179.45 178.50 1r48 h ARG 24 N 0.30 0.33 0.67 3.15 3.08 -1.35 -2.45 114.38 118.11 1r48 h ARG 24 Ca -0.04 -0.10 -0.03 0.00 0.07 0.00 0.00 59.98 59.87 1r48 h ARG 24 Cb 1.37 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 31.39 1r48 h ARG 24 CO 0.14 0.53 -0.32 1.15 -1.07 0.00 0.00 179.97 180.40 1r48 h THR 25 N 0.09 0.32 -1.01 2.04 2.02 -1.60 -0.39 112.91 114.39 1r48 h THR 25 Ca 0.05 -0.05 0.24 0.00 0.77 0.00 0.00 66.41 67.42 1r48 h THR 25 Cb 0.38 0.34 -0.12 0.00 -1.74 0.00 0.00 68.15 67.01 1r48 h THR 25 CO 0.01 0.01 0.60 0.08 0.37 0.00 0.00 175.52 176.59 1r48 h ARG 26 N -0.94 0.59 -0.52 6.66 0.11 -1.56 0.50 114.38 119.22 1r48 h ARG 26 Ca -0.09 -0.04 -0.12 0.00 0.10 0.00 0.00 59.98 59.84 1r48 h ARG 26 Cb 0.70 -0.13 -0.02 0.00 1.11 0.00 0.00 29.97 31.63 1r48 h ARG 26 CO 0.15 0.39 -0.13 -0.07 0.10 0.00 0.00 179.97 180.41 1r48 h LEU 27 N 0.61 1.00 -0.20 0.08 3.38 -1.12 -2.90 115.31 116.15 1r48 h LEU 27 Ca 0.63 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 1r48 h LEU 27 Cb 1.18 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1r48 h LEU 27 CO -0.45 1.12 0.11 0.58 0.09 0.00 0.00 178.44 179.90 1r48 h VAL 28 N 0.88 1.10 -0.90 1.22 2.07 0.17 -1.52 116.25 119.26 1r48 h VAL 28 Ca 0.13 -0.26 0.22 0.00 0.82 0.00 0.00 66.70 67.61 1r48 h VAL 28 Cb 0.70 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 1r48 h VAL 28 CO 0.05 0.10 0.61 1.56 0.02 0.00 0.00 177.57 179.91 1r48 h GLN 29 N 0.23 0.26 -0.18 1.57 7.50 -0.89 0.89 115.11 124.48 1r48 h GLN 29 Ca 0.07 -0.02 -0.07 0.00 0.50 0.00 0.00 58.65 59.13 1r48 h GLN 29 Cb 0.05 -0.06 -0.01 0.00 0.05 0.00 0.00 27.48 27.51 1r48 h GLN 29 CO -0.01 0.17 -0.21 0.37 -1.50 0.00 0.00 178.83 177.65 1r48 h GLN 30 N 0.27 0.32 -2.59 1.46 -0.00 -1.09 -3.36 115.11 110.12 1r48 h GLN 30 Ca 0.46 -0.10 -0.59 0.00 -0.00 0.00 0.00 58.65 58.42 1r48 h GLN 30 Cb 1.35 -0.03 -0.39 0.00 0.00 0.00 0.00 27.48 28.41 1r48 h GLN 30 CO -0.13 0.52 -0.86 -3.38 0.00 0.00 0.00 178.83 174.98 1r48 s HIS 31 N -4.56 1.30 0.31 3.99 -3.43 0.30 -4.97 115.29 108.23 1r48 s HIS 31 Ca -0.06 -2.19 0.19 0.00 -0.80 0.00 0.00 55.06 52.21 1r48 s HIS 31 Cb 0.15 -1.21 0.92 0.00 -1.43 0.00 0.00 32.58 31.00 1r48 s HIS 31 CO 0.76 -0.80 1.86 -1.00 -2.00 0.00 0.00 174.74 173.56 1r48 h PRO 32 N 6.25 0.00 0.00 -0.38 0.13 -1.59 -3.44 132.00 132.97 1r48 h PRO 32 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1r48 h PRO 32 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1r48 h PRO 32 CO 0.38 0.30 0.00 0.54 -0.23 0.00 0.00 178.00 178.99