#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 0.84 0.00 0.00 0.00 -1.26 -5.18 105.19 99.59 1r48 n GLY 2 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.50 1.18 -0.02 0.00 -1.26 -4.50 105.19 99.08 1r48 n GLY 3 Ca 0.00 -2.07 0.07 0.00 0.00 0.00 0.00 46.02 44.01 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 3.43 0.05 1.61 8.00 -1.26 -4.32 116.55 124.06 1r48 n ASP 4 Ca 0.00 -2.29 0.21 0.00 0.71 0.00 0.00 54.79 53.42 1r48 n ASP 4 Cb 0.00 -0.47 0.74 0.00 -0.02 0.00 0.00 41.12 41.36 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 2.88 0.00 0.13 -2.24 4.21 -2.01 0.65 115.58 119.20 1r48 h ASN 5 Ca 0.00 0.00 -0.19 0.00 1.21 0.00 0.00 56.30 57.32 1r48 h ASN 5 Cb 1.06 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.28 1r48 h ASN 5 CO 0.15 0.00 -0.90 0.40 -1.29 0.00 0.00 177.43 175.80 1r48 h ILE 6 N 0.00 1.43 -0.31 2.81 2.04 -1.92 -3.18 117.51 118.37 1r48 h ILE 6 Ca 0.22 -2.50 0.09 0.00 1.00 0.00 0.00 64.86 63.68 1r48 h ILE 6 Cb 1.06 3.10 -0.01 0.00 -0.74 0.00 0.00 36.82 40.24 1r48 h ILE 6 CO -0.00 0.70 0.25 -0.08 0.00 0.00 0.00 178.15 179.02 1r48 h GLU 7 N -0.40 0.00 -0.07 2.37 4.81 -1.22 -0.25 114.58 119.82 1r48 h GLU 7 Ca -0.17 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 58.82 1r48 h GLU 7 Cb 1.63 0.00 0.02 0.00 0.63 0.00 0.00 28.75 31.02 1r48 h GLU 7 CO 0.12 0.00 -0.89 0.37 -0.73 0.00 0.00 179.01 177.88 1r48 h GLN 8 N 0.00 0.73 -0.97 1.92 5.75 -1.28 -2.52 115.11 118.74 1r48 h GLN 8 Ca 0.15 -0.69 -0.00 0.00 -0.15 0.00 0.00 58.65 57.96 1r48 h GLN 8 Cb 0.65 0.17 -0.05 0.00 1.07 0.00 0.00 27.48 29.32 1r48 h GLN 8 CO -0.00 1.28 0.60 0.87 -2.65 0.00 0.00 178.83 178.92 1r48 h LYS 9 N 0.43 1.30 -0.25 1.69 1.57 -1.05 -2.72 116.57 117.55 1r48 h LYS 9 Ca -0.09 -0.11 -0.11 0.00 -1.87 0.00 0.00 60.65 58.47 1r48 h LYS 9 Cb 1.53 -0.28 -0.00 0.00 0.08 0.00 0.00 32.23 33.56 1r48 h LYS 9 CO 0.18 0.90 -0.28 -0.84 -0.57 0.00 0.00 179.45 178.83 1r48 h ILE 10 N 1.33 1.31 -1.11 1.86 3.07 -1.40 -2.92 117.51 119.65 1r48 h ILE 10 Ca 0.35 -1.46 0.31 0.00 1.55 0.00 0.00 64.86 65.60 1r48 h ILE 10 Cb -0.08 1.67 -0.08 0.00 -0.27 0.00 0.00 36.82 38.06 1r48 h ILE 10 CO -0.07 0.46 0.74 -0.78 -1.05 0.00 0.00 178.15 177.46 1r48 h ASP 11 N 0.36 0.29 -0.08 2.16 1.82 -1.13 0.62 116.42 120.45 1r48 h ASP 11 Ca 0.04 0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 56.72 1r48 h ASP 11 Cb 0.85 0.02 -0.00 0.00 0.68 0.00 0.00 39.33 40.88 1r48 h ASP 11 CO 0.07 0.03 -0.04 -0.78 -1.61 0.00 0.00 179.24 176.91 1r48 h ASP 12 N 0.24 0.18 -0.20 2.28 3.58 -1.35 -2.93 116.42 118.22 1r48 h ASP 12 Ca 0.61 -0.41 0.00 0.00 0.42 0.00 0.00 57.03 57.65 1r48 h ASP 12 Cb 1.85 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 42.84 1r48 h ASP 12 CO -0.22 0.55 0.13 0.40 -2.88 0.00 0.00 179.24 177.21 1r48 h ILE 13 N -0.19 1.05 -1.09 2.25 2.04 0.09 -1.89 117.51 119.77 1r48 h ILE 13 Ca 0.02 -0.09 0.30 0.00 1.00 0.00 0.00 64.86 66.09 1r48 h ILE 13 Cb 0.48 0.76 -0.07 0.00 -0.74 0.00 0.00 36.82 37.25 1r48 h ILE 13 CO 0.01 0.05 0.75 -0.78 0.00 0.00 0.00 178.15 178.18 1r48 h ASP 14 N 0.27 0.19 0.88 1.72 3.58 -0.25 1.29 116.42 124.10 1r48 h ASP 14 Ca 0.07 0.04 -0.13 0.00 0.42 0.00 0.00 57.03 57.43 1r48 h ASP 14 Cb -0.03 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.01 1r48 h ASP 14 CO -0.02 0.04 -0.61 -0.74 -2.88 0.00 0.00 179.24 175.03 1r48 h HIS 15 N 0.17 0.00 0.11 0.28 2.76 -1.16 -2.93 115.15 114.38 1r48 h HIS 15 Ca 0.56 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 58.42 1r48 h HIS 15 Cb 1.87 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.81 1r48 h HIS 15 CO -0.00 0.61 -1.61 0.93 -1.30 0.00 0.00 177.93 176.55 1r48 h GLU 16 N 0.00 0.23 -0.19 5.26 4.39 0.16 -2.97 114.58 121.46 1r48 h GLU 16 Ca -0.01 -0.39 -0.03 0.00 0.34 0.00 0.00 59.36 59.28 1r48 h GLU 16 Cb 1.21 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.99 1r48 h GLU 16 CO 0.08 1.07 -0.01 0.82 -1.16 0.00 0.00 179.01 179.81 1r48 h ILE 17 N 0.06 1.13 0.17 3.13 2.04 0.13 -2.58 117.51 121.59 1r48 h ILE 17 Ca -0.27 -0.51 -0.31 0.00 1.00 0.00 0.00 64.86 64.77 1r48 h ILE 17 Cb 2.02 1.00 0.01 0.00 -0.74 0.00 0.00 36.82 39.11 1r48 h ILE 17 CO 0.14 0.17 -1.44 0.00 0.00 0.00 0.00 178.15 177.02 1r48 h ALA 18 N 1.72 0.07 -0.73 1.87 0.00 -1.62 -3.08 119.26 117.49 1r48 h ALA 18 Ca 0.06 -0.96 0.10 0.00 0.00 0.00 0.00 54.91 54.12 1r48 h ALA 18 Cb 0.21 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 1r48 h ALA 18 CO 0.01 0.94 0.36 -0.44 0.00 0.00 0.00 179.25 180.11 1r48 h ASP 19 N 0.10 0.45 0.08 0.00 3.32 -1.29 0.63 116.42 119.70 1r48 h ASP 19 Ca -0.22 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 1r48 h ASP 19 Cb 2.06 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.60 1r48 h ASP 19 CO 0.21 0.25 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.88 1r48 h LEU 20 N 0.59 -0.09 -1.73 1.55 3.38 -1.61 -2.85 115.31 114.56 1r48 h LEU 20 Ca 0.37 -0.43 0.16 0.00 0.09 0.00 0.00 57.88 58.06 1r48 h LEU 20 Cb 0.41 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 1r48 h LEU 20 CO -0.29 0.42 0.49 -0.61 0.09 0.00 0.00 178.44 178.53 1r48 h GLN 21 N -0.62 0.25 -0.10 1.13 4.15 -1.38 0.10 115.11 118.64 1r48 h GLN 21 Ca -0.01 -0.01 -0.15 0.00 0.77 0.00 0.00 58.65 59.24 1r48 h GLN 21 Cb 0.52 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 1r48 h GLN 21 CO 0.02 0.16 -0.59 0.00 -1.93 0.00 0.00 178.83 176.49 1r48 h ALA 22 N 1.66 0.79 -0.08 3.38 0.00 -0.84 -2.73 119.26 121.44 1r48 h ALA 22 Ca 0.35 -0.54 -0.19 0.00 0.00 0.00 0.00 54.91 54.53 1r48 h ALA 22 Cb 0.99 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1r48 h ALA 22 CO -0.08 0.71 -0.75 0.87 0.00 0.00 0.00 179.25 180.01 1r48 h LYS 23 N 0.26 0.44 -0.31 0.00 6.56 -0.60 -2.70 116.57 120.20 1r48 h LYS 23 Ca -0.00 -0.37 -0.06 0.00 -1.06 0.00 0.00 60.65 59.17 1r48 h LYS 23 Cb 1.11 0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.84 1r48 h LYS 23 CO 0.10 1.00 -0.02 -0.09 -2.06 0.00 0.00 179.45 178.38 1r48 h ARG 24 N 0.29 0.57 0.44 3.15 2.43 -1.21 -2.59 114.38 117.47 1r48 h ARG 24 Ca -0.04 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 58.92 1r48 h ARG 24 Cb 1.33 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1r48 h ARG 24 CO 0.13 0.72 -0.21 1.15 -1.51 0.00 0.00 179.97 180.25 1r48 h THR 25 N 0.36 0.53 -0.90 0.20 2.02 -1.53 -1.81 112.91 111.78 1r48 h THR 25 Ca 0.09 -0.31 0.21 0.00 0.77 0.00 0.00 66.41 67.17 1r48 h THR 25 Cb 0.48 0.67 -0.12 0.00 -1.74 0.00 0.00 68.15 67.44 1r48 h THR 25 CO 0.02 0.05 0.43 0.08 0.37 0.00 0.00 175.52 176.47 1r48 h ARG 26 N -0.78 0.45 -0.68 6.66 0.11 -1.54 0.63 114.38 119.23 1r48 h ARG 26 Ca -0.06 -0.03 -0.05 0.00 0.10 0.00 0.00 59.98 59.94 1r48 h ARG 26 Cb 0.54 -0.10 -0.03 0.00 1.11 0.00 0.00 29.97 31.49 1r48 h ARG 26 CO 0.10 0.30 0.23 -0.07 0.10 0.00 0.00 179.97 180.63 1r48 h LEU 27 N 0.47 0.96 -0.41 0.08 3.38 -1.32 -2.54 115.31 115.92 1r48 h LEU 27 Ca 0.55 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 1r48 h LEU 27 Cb 1.01 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1r48 h LEU 27 CO -0.49 0.88 0.15 0.58 0.09 0.00 0.00 178.44 179.65 1r48 h VAL 28 N 1.00 1.21 -0.66 1.22 2.07 0.10 -1.65 116.25 119.54 1r48 h VAL 28 Ca 0.22 -0.66 0.19 0.00 0.82 0.00 0.00 66.70 67.28 1r48 h VAL 28 Cb 0.26 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 1r48 h VAL 28 CO -0.01 0.24 0.51 1.56 0.02 0.00 0.00 177.57 179.88 1r48 h GLN 29 N 0.51 0.00 -0.02 1.57 1.08 -0.42 0.83 115.11 118.67 1r48 h GLN 29 Ca 0.13 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.17 1r48 h GLN 29 Cb 0.22 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.64 1r48 h GLN 29 CO -0.01 0.00 -0.73 0.37 -0.95 0.00 0.00 178.83 177.51 1r48 h GLN 30 N 0.00 0.13 -2.01 1.46 4.15 -1.04 -3.37 115.11 114.43 1r48 h GLN 30 Ca 0.31 -0.11 -0.53 0.00 0.77 0.00 0.00 58.65 59.09 1r48 h GLN 30 Cb 1.33 0.03 -0.40 0.00 0.21 0.00 0.00 27.48 28.65 1r48 h GLN 30 CO -0.00 0.80 -1.12 -2.39 -1.93 0.00 0.00 178.83 174.19 1r48 n HIS 31 N -3.74 0.06 0.14 3.99 1.44 0.25 -4.94 115.22 112.43 1r48 n HIS 31 Ca -0.02 -3.69 0.00 0.00 -2.01 0.00 0.00 57.72 52.01 1r48 n HIS 31 Cb 0.71 -0.39 0.18 0.00 0.12 0.00 0.00 29.99 30.61 1r48 n HIS 31 CO 0.00 0.00 0.00 -1.00 -2.81 0.00 0.00 176.34 172.53 1r48 h PRO 32 N 3.61 0.00 0.00 -1.40 0.13 -0.69 -3.45 132.00 130.20 1r48 h PRO 32 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1r48 h PRO 32 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1r48 h PRO 32 CO 0.49 0.58 0.00 2.89 -0.23 0.00 0.00 178.00 181.74