#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 0.03 4.04 0.00 0.00 -1.26 -4.94 105.19 103.06 1r48 n GLY 2 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.48 -0.35 0.00 -0.02 0.00 -1.26 -4.83 105.19 97.25 1r48 n GLY 3 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -2.84 0.00 0.00 1.61 8.00 -1.26 -5.05 116.55 117.00 1r48 n ASP 4 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1r48 n ASP 4 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 1r48 n ASP 4 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1r48 n ASN 5 N -0.60 0.00 -0.00 -2.24 5.03 -1.26 -4.84 115.26 111.34 1r48 n ASN 5 Ca 0.00 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.33 1r48 n ASN 5 Cb 0.00 0.05 -0.07 0.00 -1.02 0.00 0.00 39.78 38.74 1r48 n ASN 5 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 1r48 h ILE 6 N 0.00 1.15 -0.48 2.41 2.04 -1.98 -2.09 117.51 118.57 1r48 h ILE 6 Ca 0.00 -0.45 0.14 0.00 1.00 0.00 0.00 64.86 65.55 1r48 h ILE 6 Cb 0.00 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 1r48 h ILE 6 CO 0.00 0.13 0.47 -0.08 0.00 0.00 0.00 178.15 178.66 1r48 h GLU 7 N -0.07 0.00 0.23 2.37 4.22 -1.91 0.17 114.58 119.60 1r48 h GLU 7 Ca 0.02 0.00 -0.33 0.00 0.08 0.00 0.00 59.36 59.13 1r48 h GLU 7 Cb 0.18 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.46 1r48 h GLU 7 CO -0.00 0.00 -1.48 0.37 -2.18 0.00 0.00 179.01 175.72 1r48 h GLN 8 N 0.00 0.49 -0.52 1.92 4.15 -1.74 -3.05 115.11 116.36 1r48 h GLN 8 Ca 0.23 -0.84 -0.01 0.00 0.77 0.00 0.00 58.65 58.80 1r48 h GLN 8 Cb 1.16 0.31 -0.03 0.00 0.21 0.00 0.00 27.48 29.13 1r48 h GLN 8 CO -0.00 1.40 0.29 0.87 -1.93 0.00 0.00 178.83 179.46 1r48 h LYS 9 N 0.13 0.71 -0.19 1.69 1.57 -0.05 -2.63 116.57 117.81 1r48 h LYS 9 Ca -0.25 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.36 1r48 h LYS 9 Cb 2.14 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 34.30 1r48 h LYS 9 CO 0.26 0.52 -0.29 -0.84 -0.57 0.00 0.00 179.45 178.53 1r48 h ILE 10 N 0.72 1.34 -1.01 1.86 3.07 -1.38 -2.96 117.51 119.15 1r48 h ILE 10 Ca 0.19 -1.52 0.27 0.00 1.55 0.00 0.00 64.86 65.35 1r48 h ILE 10 Cb 0.01 1.87 -0.07 0.00 -0.27 0.00 0.00 36.82 38.36 1r48 h ILE 10 CO -0.03 0.46 0.68 -0.78 -1.05 0.00 0.00 178.15 177.43 1r48 h ASP 11 N 0.18 0.28 -0.25 2.16 3.58 -1.35 0.65 116.42 121.68 1r48 h ASP 11 Ca 0.02 0.04 -0.07 0.00 0.42 0.00 0.00 57.03 57.44 1r48 h ASP 11 Cb 0.88 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.92 1r48 h ASP 11 CO 0.07 0.07 -0.11 0.44 -2.88 0.00 0.00 179.24 176.83 1r48 h ASP 12 N 0.26 0.52 -0.01 2.28 3.32 -1.37 -2.94 116.42 118.47 1r48 h ASP 12 Ca 0.53 -0.40 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1r48 h ASP 12 Cb 1.61 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 41.01 1r48 h ASP 12 CO -0.17 0.81 0.01 0.40 -1.72 0.00 0.00 179.24 178.57 1r48 h ILE 13 N 0.23 1.08 -1.15 0.35 2.04 0.25 -2.29 117.51 118.03 1r48 h ILE 13 Ca 0.06 -0.24 0.33 0.00 1.00 0.00 0.00 64.86 66.01 1r48 h ILE 13 Cb 0.61 1.22 -0.07 0.00 -0.74 0.00 0.00 36.82 37.84 1r48 h ILE 13 CO 0.03 0.06 0.80 -0.78 0.00 0.00 0.00 178.15 178.27 1r48 h ASP 14 N -0.08 0.15 0.90 1.72 1.82 -0.46 1.48 116.42 121.95 1r48 h ASP 14 Ca 0.00 0.03 -0.14 0.00 -0.39 0.00 0.00 57.03 56.54 1r48 h ASP 14 Cb 0.10 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 40.10 1r48 h ASP 14 CO -0.00 0.02 -0.65 -0.74 -1.61 0.00 0.00 179.24 176.26 1r48 h HIS 15 N 0.12 0.00 0.13 0.28 2.76 -1.24 -2.98 115.15 114.23 1r48 h HIS 15 Ca 0.59 0.00 -0.32 0.00 -2.20 0.00 0.00 60.37 58.44 1r48 h HIS 15 Cb 2.06 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 31.01 1r48 h HIS 15 CO -0.00 0.65 -1.62 0.93 -1.30 0.00 0.00 177.93 176.59 1r48 h GLU 16 N 0.00 0.27 -0.48 5.26 4.39 0.20 -2.92 114.58 121.30 1r48 h GLU 16 Ca -0.01 -0.47 -0.01 0.00 0.34 0.00 0.00 59.36 59.22 1r48 h GLU 16 Cb 1.27 0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 30.07 1r48 h GLU 16 CO 0.08 1.14 0.27 0.82 -1.16 0.00 0.00 179.01 180.16 1r48 h ILE 17 N 0.07 1.14 0.17 3.13 2.04 0.10 -2.44 117.51 121.72 1r48 h ILE 17 Ca -0.28 -0.35 -0.29 0.00 1.00 0.00 0.00 64.86 64.94 1r48 h ILE 17 Cb 2.04 0.49 0.01 0.00 -0.74 0.00 0.00 36.82 38.62 1r48 h ILE 17 CO 0.16 0.15 -1.32 0.00 0.00 0.00 0.00 178.15 177.14 1r48 h ALA 18 N 1.64 0.02 -0.61 1.87 0.00 -1.63 -3.11 119.26 117.45 1r48 h ALA 18 Ca 0.17 -0.88 0.08 0.00 0.00 0.00 0.00 54.91 54.28 1r48 h ALA 18 Cb 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 1r48 h ALA 18 CO -0.03 0.90 0.25 0.22 0.00 0.00 0.00 179.25 180.59 1r48 h ASP 19 N 0.10 0.29 0.06 0.00 3.58 -1.24 -1.32 116.42 117.88 1r48 h ASP 19 Ca -0.17 0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.34 1r48 h ASP 19 Cb 2.03 0.03 0.00 0.00 1.72 0.00 0.00 39.33 43.11 1r48 h ASP 19 CO 0.22 0.18 -0.03 -0.07 -2.88 0.00 0.00 179.24 176.66 1r48 h LEU 20 N 0.45 -0.07 -1.88 2.28 3.38 -1.59 -2.82 115.31 115.08 1r48 h LEU 20 Ca 0.30 -0.32 0.27 0.00 0.09 0.00 0.00 57.88 58.21 1r48 h LEU 20 Cb 0.33 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 1r48 h LEU 20 CO -0.27 0.29 0.67 -0.61 0.09 0.00 0.00 178.44 178.61 1r48 h GLN 21 N -0.44 0.09 -0.04 1.13 4.15 -1.39 0.50 115.11 119.11 1r48 h GLN 21 Ca -0.01 -0.01 -0.18 0.00 0.77 0.00 0.00 58.65 59.23 1r48 h GLN 21 Cb 0.38 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 1r48 h GLN 21 CO 0.01 0.06 -0.76 0.00 -1.93 0.00 0.00 178.83 176.21 1r48 h ALA 22 N 1.54 0.63 -0.25 3.38 0.00 -1.06 -2.81 119.26 120.68 1r48 h ALA 22 Ca 0.47 -0.64 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 1r48 h ALA 22 Cb 1.71 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 1r48 h ALA 22 CO -0.05 0.81 -0.36 0.87 0.00 0.00 0.00 179.25 180.51 1r48 h LYS 23 N 0.19 0.56 -0.29 0.00 1.57 0.22 -2.12 116.57 116.69 1r48 h LYS 23 Ca -0.03 -0.27 -0.10 0.00 -1.87 0.00 0.00 60.65 58.38 1r48 h LYS 23 Cb 1.33 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.63 1r48 h LYS 23 CO 0.12 0.84 -0.21 -0.09 -0.57 0.00 0.00 179.45 179.54 1r48 h ARG 24 N 0.47 0.67 0.38 3.15 2.43 -1.31 -2.80 114.38 117.36 1r48 h ARG 24 Ca 0.05 -0.32 -0.02 0.00 -0.81 0.00 0.00 59.98 58.88 1r48 h ARG 24 Cb 0.85 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.40 1r48 h ARG 24 CO 0.07 0.92 -0.18 1.15 -1.51 0.00 0.00 179.97 180.42 1r48 h THR 25 N 0.41 0.63 -0.82 0.20 2.02 -1.44 -1.92 112.91 111.98 1r48 h THR 25 Ca 0.06 -0.32 0.18 0.00 0.77 0.00 0.00 66.41 67.10 1r48 h THR 25 Cb 0.76 0.79 -0.11 0.00 -1.74 0.00 0.00 68.15 67.85 1r48 h THR 25 CO 0.06 0.06 0.31 0.08 0.37 0.00 0.00 175.52 176.40 1r48 h ARG 26 N -0.69 0.37 -0.72 6.66 0.11 -1.45 0.55 114.38 119.20 1r48 h ARG 26 Ca -0.05 -0.02 -0.03 0.00 0.10 0.00 0.00 59.98 59.98 1r48 h ARG 26 Cb 0.49 -0.08 -0.03 0.00 1.11 0.00 0.00 29.97 31.45 1r48 h ARG 26 CO 0.09 0.24 0.34 -0.07 0.10 0.00 0.00 179.97 180.67 1r48 h LEU 27 N 0.38 0.93 -0.53 0.08 4.07 -1.37 -2.29 115.31 116.58 1r48 h LEU 27 Ca 0.49 -0.11 -0.02 0.00 0.08 0.00 0.00 57.88 58.32 1r48 h LEU 27 Cb 0.86 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.33 1r48 h LEU 27 CO -0.50 0.80 0.24 0.58 -1.08 0.00 0.00 178.44 178.48 1r48 h VAL 28 N 1.02 1.21 -0.79 1.22 2.07 0.81 -1.48 116.25 120.31 1r48 h VAL 28 Ca 0.25 -0.61 0.21 0.00 0.82 0.00 0.00 66.70 67.37 1r48 h VAL 28 Cb 0.12 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 1r48 h VAL 28 CO -0.03 0.24 0.55 -0.61 0.02 0.00 0.00 177.57 177.74 1r48 h GLN 29 N 0.72 0.11 -0.03 1.57 4.15 -0.39 0.82 115.11 122.05 1r48 h GLN 29 Ca 0.18 -0.01 -0.14 0.00 0.77 0.00 0.00 58.65 59.45 1r48 h GLN 29 Cb 0.15 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.80 1r48 h GLN 29 CO -0.02 0.07 -0.63 1.96 -1.93 0.00 0.00 178.83 178.28 1r48 h GLN 30 N 0.11 0.11 -2.02 1.69 4.20 -1.06 -3.36 115.11 114.78 1r48 h GLN 30 Ca 0.38 -0.08 -0.56 0.00 0.06 0.00 0.00 58.65 58.45 1r48 h GLN 30 Cb 1.36 0.01 -0.39 0.00 0.30 0.00 0.00 27.48 28.76 1r48 h GLN 30 CO -0.05 0.70 -1.06 -2.39 -0.67 0.00 0.00 178.83 175.37 1r48 n HIS 31 N -3.82 0.11 0.29 2.96 1.44 0.26 -4.95 115.22 111.50 1r48 n HIS 31 Ca -0.02 -3.64 0.13 0.00 -2.01 0.00 0.00 57.72 52.19 1r48 n HIS 31 Cb 0.63 -0.38 0.84 0.00 0.12 0.00 0.00 29.99 31.20 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 3.95 0.00 0.00 -1.40 0.13 -0.95 -3.45 132.00 130.28 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 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1r48 h PRO 32 CO 0.50 0.01 0.00 2.89 -0.23 0.00 0.00 178.00 181.18