#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 0.00 0.00 0.00 0.00 -1.26 -5.16 105.19 98.77 1r48 n GLY 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.92 0.86 -0.02 0.00 -1.26 -4.84 105.19 97.01 1r48 n GLY 3 Ca 0.00 -1.10 0.06 0.00 0.00 0.00 0.00 46.02 44.99 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 2.48 -0.14 1.61 8.00 -1.26 -4.25 116.55 122.98 1r48 n ASP 4 Ca 0.00 -2.08 0.27 0.00 0.71 0.00 0.00 54.79 53.68 1r48 n ASP 4 Cb 0.00 -0.33 0.71 0.00 -0.02 0.00 0.00 41.12 41.48 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 2.43 0.01 0.02 -2.24 -0.00 -2.00 0.25 115.58 114.04 1r48 h ASN 5 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 56.30 56.14 1r48 h ASN 5 Cb 0.69 -0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.02 1r48 h ASN 5 CO 0.04 0.00 -0.64 0.40 -0.00 0.00 0.00 177.43 177.23 1r48 h ILE 6 N 0.01 1.43 -0.38 2.57 2.04 -1.94 -2.52 117.51 118.72 1r48 h ILE 6 Ca 0.39 -2.14 0.11 0.00 1.00 0.00 0.00 64.86 64.21 1r48 h ILE 6 Cb 1.55 2.67 -0.02 0.00 -0.74 0.00 0.00 36.82 40.28 1r48 h ILE 6 CO -0.01 0.62 0.27 -0.08 0.00 0.00 0.00 178.15 178.96 1r48 h GLU 7 N -0.12 0.02 0.19 2.37 4.81 -0.86 0.64 114.58 121.63 1r48 h GLU 7 Ca -0.09 -0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.87 1r48 h GLU 7 Cb 1.37 -0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.78 1r48 h GLU 7 CO 0.13 0.01 -1.17 0.37 -0.73 0.00 0.00 179.01 177.62 1r48 h GLN 8 N 0.02 0.46 -0.46 1.92 4.15 -1.23 -2.91 115.11 117.07 1r48 h GLN 8 Ca 0.18 -0.75 -0.02 0.00 0.77 0.00 0.00 58.65 58.83 1r48 h GLN 8 Cb 0.70 0.27 -0.02 0.00 0.21 0.00 0.00 27.48 28.64 1r48 h GLN 8 CO -0.01 1.35 0.20 -0.22 -1.93 0.00 0.00 178.83 178.22 1r48 h LYS 9 N -0.03 0.65 -0.17 1.69 3.64 -0.72 -2.72 116.57 118.90 1r48 h LYS 9 Ca -0.20 -0.08 -0.12 0.00 -1.27 0.00 0.00 60.65 58.98 1r48 h LYS 9 Cb 1.91 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.61 1r48 h LYS 9 CO 0.22 0.52 -0.36 -0.84 -2.27 0.00 0.00 179.45 176.72 1r48 h ILE 10 N 0.65 1.34 -1.00 2.00 3.07 -1.00 -2.99 117.51 119.58 1r48 h ILE 10 Ca 0.16 -1.61 0.25 0.00 1.55 0.00 0.00 64.86 65.22 1r48 h ILE 10 Cb 0.10 1.94 -0.08 0.00 -0.27 0.00 0.00 36.82 38.52 1r48 h ILE 10 CO -0.02 0.49 0.66 -0.78 -1.05 0.00 0.00 178.15 177.46 1r48 h ASP 11 N 0.19 0.35 -0.21 2.16 1.82 -1.27 0.55 116.42 120.02 1r48 h ASP 11 Ca 0.00 0.06 -0.04 0.00 -0.39 0.00 0.00 57.03 56.66 1r48 h ASP 11 Cb 0.96 -0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.96 1r48 h ASP 11 CO 0.08 0.10 -0.02 0.44 -1.61 0.00 0.00 179.24 178.22 1r48 h ASP 12 N 0.33 0.38 -0.25 2.28 5.19 -1.40 -2.95 116.42 120.00 1r48 h ASP 12 Ca 0.54 -0.34 -0.00 0.00 -0.62 0.00 0.00 57.03 56.61 1r48 h ASP 12 Cb 1.50 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.89 1r48 h ASP 12 CO -0.21 0.63 0.15 0.40 -3.12 0.00 0.00 179.24 177.09 1r48 h ILE 13 N 0.13 1.11 -1.14 0.35 2.04 0.01 -2.10 117.51 117.91 1r48 h ILE 13 Ca 0.06 -0.28 0.32 0.00 1.00 0.00 0.00 64.86 65.96 1r48 h ILE 13 Cb 0.45 0.84 -0.07 0.00 -0.74 0.00 0.00 36.82 37.30 1r48 h ILE 13 CO 0.02 0.11 0.79 -0.78 0.00 0.00 0.00 178.15 178.28 1r48 h ASP 14 N 0.31 0.17 0.87 1.72 3.58 -0.28 1.37 116.42 124.16 1r48 h ASP 14 Ca 0.09 0.04 -0.15 0.00 0.42 0.00 0.00 57.03 57.42 1r48 h ASP 14 Cb 0.05 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 1r48 h ASP 14 CO -0.02 0.02 -0.73 -0.74 -2.88 0.00 0.00 179.24 174.90 1r48 h HIS 15 N 0.14 0.00 0.08 0.28 2.76 -1.21 -2.96 115.15 114.24 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 2.01 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.95 1r48 h HIS 15 CO -0.00 0.73 -1.48 0.93 -1.30 0.00 0.00 177.93 176.81 1r48 h GLU 16 N 0.00 0.17 -0.37 5.26 4.39 0.17 -2.97 114.58 121.23 1r48 h GLU 16 Ca -0.01 -0.29 -0.05 0.00 0.34 0.00 0.00 59.36 59.34 1r48 h GLU 16 Cb 1.36 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 30.10 1r48 h GLU 16 CO 0.09 1.01 0.00 0.82 -1.16 0.00 0.00 179.01 179.78 1r48 h ILE 17 N 0.05 1.21 0.10 3.13 2.04 0.12 -2.77 117.51 121.38 1r48 h ILE 17 Ca -0.21 -0.83 -0.27 0.00 1.00 0.00 0.00 64.86 64.56 1r48 h ILE 17 Cb 1.97 0.92 0.01 0.00 -0.74 0.00 0.00 36.82 38.98 1r48 h ILE 17 CO 0.14 0.29 -1.17 0.00 0.00 0.00 0.00 178.15 177.41 1r48 h ALA 18 N 1.45 0.16 -0.39 1.87 0.00 -1.62 -3.11 119.26 117.62 1r48 h ALA 18 Ca 0.12 -0.82 0.06 0.00 0.00 0.00 0.00 54.91 54.27 1r48 h ALA 18 Cb 0.35 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1r48 h ALA 18 CO 0.01 0.88 0.08 -0.44 0.00 0.00 0.00 179.25 179.79 1r48 h ASP 19 N 0.14 0.02 0.26 0.00 3.32 -1.33 -1.96 116.42 116.87 1r48 h ASP 19 Ca -0.13 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 1r48 h ASP 19 Cb 1.86 0.08 0.00 0.00 0.22 0.00 0.00 39.33 41.49 1r48 h ASP 19 CO 0.20 0.05 -0.12 -0.07 -1.72 0.00 0.00 179.24 177.57 1r48 h LEU 20 N 0.21 -0.29 -1.89 1.55 3.38 -1.61 -2.70 115.31 113.96 1r48 h LEU 20 Ca 0.19 -0.12 0.34 0.00 0.09 0.00 0.00 57.88 58.38 1r48 h LEU 20 Cb 0.22 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 1r48 h LEU 20 CO -0.24 -0.05 0.84 -0.61 0.09 0.00 0.00 178.44 178.47 1r48 h GLN 21 N -0.53 0.06 -0.18 1.13 4.15 -1.42 0.54 115.11 118.85 1r48 h GLN 21 Ca -0.04 -0.00 -0.19 0.00 0.77 0.00 0.00 58.65 59.19 1r48 h GLN 21 Cb 0.39 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.07 1r48 h GLN 21 CO 0.06 0.04 -0.65 0.00 -1.93 0.00 0.00 178.83 176.35 1r48 h ALA 22 N 1.43 0.51 -0.19 3.38 0.00 -1.04 -2.74 119.26 120.61 1r48 h ALA 22 Ca 0.58 -0.56 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1r48 h ALA 22 Cb 2.20 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.92 1r48 h ALA 22 CO -0.06 0.70 -0.25 0.87 0.00 0.00 0.00 179.25 180.51 1r48 h LYS 23 N 0.49 0.36 -0.22 0.00 1.79 0.24 -2.11 116.57 117.12 1r48 h LYS 23 Ca -0.02 -0.13 -0.13 0.00 -2.18 0.00 0.00 60.65 58.19 1r48 h LYS 23 Cb 1.24 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 1r48 h LYS 23 CO 0.13 0.59 -0.39 -0.09 -1.08 0.00 0.00 179.45 178.61 1r48 h ARG 24 N 0.32 0.65 0.48 3.15 2.43 -1.33 -2.94 114.38 117.13 1r48 h ARG 24 Ca 0.05 -0.40 -0.02 0.00 -0.81 0.00 0.00 59.98 58.79 1r48 h ARG 24 Cb 0.62 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1r48 h ARG 24 CO 0.04 1.02 -0.23 1.15 -1.51 0.00 0.00 179.97 180.44 1r48 h THR 25 N 0.34 0.45 -1.01 0.20 2.02 -1.37 -1.86 112.91 111.68 1r48 h THR 25 Ca 0.01 -0.38 0.24 0.00 0.77 0.00 0.00 66.41 67.06 1r48 h THR 25 Cb 0.98 0.60 -0.10 0.00 -1.74 0.00 0.00 68.15 67.89 1r48 h THR 25 CO 0.09 0.06 0.64 0.08 0.37 0.00 0.00 175.52 176.76 1r48 h ARG 26 N -0.90 0.46 -0.33 6.66 0.11 -1.49 0.62 114.38 119.52 1r48 h ARG 26 Ca -0.07 -0.03 -0.13 0.00 0.10 0.00 0.00 59.98 59.85 1r48 h ARG 26 Cb 0.59 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.55 1r48 h ARG 26 CO 0.11 0.30 -0.34 -0.07 0.10 0.00 0.00 179.97 180.07 1r48 h LEU 27 N 0.47 0.77 -0.35 0.08 4.07 -1.39 -2.90 115.31 116.06 1r48 h LEU 27 Ca 0.58 -0.32 -0.02 0.00 0.08 0.00 0.00 57.88 58.20 1r48 h LEU 27 Cb 1.34 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 42.85 1r48 h LEU 27 CO -0.31 1.04 0.16 0.58 -1.08 0.00 0.00 178.44 178.82 1r48 h VAL 28 N 0.61 1.17 -0.72 1.22 2.07 0.10 -1.57 116.25 119.14 1r48 h VAL 28 Ca 0.06 -0.51 0.19 0.00 0.82 0.00 0.00 66.70 67.26 1r48 h VAL 28 Cb 0.87 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 1r48 h VAL 28 CO 0.08 0.18 0.51 1.56 0.02 0.00 0.00 177.57 179.92 1r48 h GLN 29 N 0.42 0.13 -0.00 1.57 1.08 -0.88 0.86 115.11 118.29 1r48 h GLN 29 Ca 0.12 -0.01 -0.12 0.00 -1.45 0.00 0.00 58.65 57.19 1r48 h GLN 29 Cb 0.15 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.53 1r48 h GLN 29 CO -0.01 0.09 -0.55 0.37 -0.95 0.00 0.00 178.83 177.78 1r48 h GLN 30 N 0.14 0.00 -1.52 1.46 4.15 -1.10 -3.36 115.11 114.88 1r48 h GLN 30 Ca 0.35 -0.00 -0.47 0.00 0.77 0.00 0.00 58.65 59.31 1r48 h GLN 30 Cb 1.19 0.00 -0.33 0.00 0.21 0.00 0.00 27.48 28.55 1r48 h GLN 30 CO -0.05 0.55 -0.98 -2.39 -1.93 0.00 0.00 178.83 174.04 1r48 n HIS 31 N -3.88 -0.96 -1.22 3.99 1.44 0.25 -5.01 115.22 109.82 1r48 n HIS 31 Ca -0.01 -3.20 -0.22 0.00 -2.01 0.00 0.00 57.72 52.29 1r48 n HIS 31 Cb 0.56 0.10 -0.11 0.00 0.12 0.00 0.00 29.99 30.66 1r48 n HIS 31 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1r48 n PRO 32 N 1.19 2.55 0.00 -1.40 -0.04 0.15 -4.81 135.00 132.64 1r48 n PRO 32 Ca 0.19 -1.65 0.00 0.00 -0.04 0.00 0.00 63.50 62.00 1r48 n PRO 32 Cb 0.58 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 1r48 n PRO 32 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35