#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 0.65 2.90 0.00 0.00 -1.26 -4.95 105.19 102.53 1r48 n GLY 2 Ca 0.00 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.50 0.00 -0.02 0.00 -1.26 -4.83 105.19 98.58 1r48 n GLY 3 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.14 0.00 0.00 1.61 8.00 -1.26 -5.04 116.55 117.72 1r48 n ASP 4 Ca -0.10 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.40 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 -3.20 -0.39 0.00 0.00 177.20 173.61 1r48 n ASN 5 N -0.61 0.00 0.08 -2.24 4.05 -1.26 -4.81 115.26 110.47 1r48 n ASN 5 Ca 0.00 0.00 -0.13 0.00 0.45 0.00 0.00 54.58 54.90 1r48 n ASN 5 Cb 0.00 0.09 -0.08 0.00 1.23 0.00 0.00 39.78 41.01 1r48 n ASN 5 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 1r48 h ILE 6 N 0.00 0.97 -0.79 -1.44 2.04 -1.98 -0.51 117.51 115.81 1r48 h ILE 6 Ca 0.00 -0.46 0.15 0.00 1.00 0.00 0.00 64.86 65.56 1r48 h ILE 6 Cb 0.00 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 1r48 h ILE 6 CO 0.00 0.11 0.52 -0.08 0.00 0.00 0.00 178.15 178.70 1r48 h GLU 7 N -0.40 0.45 0.01 2.37 4.57 -1.91 -0.27 114.58 119.40 1r48 h GLU 7 Ca -0.02 -0.03 -0.24 0.00 -1.18 0.00 0.00 59.36 57.90 1r48 h GLU 7 Cb 0.32 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 28.82 1r48 h GLU 7 CO 0.03 0.30 -0.99 0.37 -1.18 0.00 0.00 179.01 177.54 1r48 h GLN 8 N 0.46 0.47 -0.57 1.92 5.75 -1.81 -2.94 115.11 118.39 1r48 h GLN 8 Ca 0.39 -0.52 0.04 0.00 -0.15 0.00 0.00 58.65 58.41 1r48 h GLN 8 Cb 0.86 0.15 -0.04 0.00 1.07 0.00 0.00 27.48 29.51 1r48 h GLN 8 CO -0.14 1.17 0.32 -0.22 -2.65 0.00 0.00 178.83 177.30 1r48 h LYS 9 N 0.26 0.59 -0.39 1.69 3.64 0.62 -2.57 116.57 120.42 1r48 h LYS 9 Ca -0.10 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.15 1r48 h LYS 9 Cb 1.63 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.31 1r48 h LYS 9 CO 0.18 0.39 -0.14 -0.84 -2.27 0.00 0.00 179.45 176.77 1r48 h ILE 10 N 0.61 1.28 -1.15 2.00 3.07 -1.47 -2.83 117.51 119.03 1r48 h ILE 10 Ca 0.24 -1.25 0.33 0.00 1.55 0.00 0.00 64.86 65.73 1r48 h ILE 10 Cb 0.10 1.28 -0.10 0.00 -0.27 0.00 0.00 36.82 37.83 1r48 h ILE 10 CO -0.14 0.42 0.75 -0.78 -1.05 0.00 0.00 178.15 177.35 1r48 h ASP 11 N 0.58 0.34 -0.11 2.16 1.82 -1.27 0.83 116.42 120.76 1r48 h ASP 11 Ca 0.09 0.09 -0.03 0.00 -0.39 0.00 0.00 57.03 56.79 1r48 h ASP 11 Cb 0.68 0.05 -0.00 0.00 0.68 0.00 0.00 39.33 40.73 1r48 h ASP 11 CO 0.05 -0.01 -0.04 -0.78 -1.61 0.00 0.00 179.24 176.85 1r48 h ASP 12 N 0.26 0.23 -0.15 2.28 1.82 -1.32 -2.97 116.42 116.57 1r48 h ASP 12 Ca 0.67 -0.40 0.00 0.00 -0.39 0.00 0.00 57.03 56.91 1r48 h ASP 12 Cb 1.93 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 41.87 1r48 h ASP 12 CO -0.31 0.58 0.10 0.40 -1.61 0.00 0.00 179.24 178.40 1r48 h ILE 13 N -0.11 1.05 -1.14 2.25 2.04 0.49 -2.09 117.51 120.00 1r48 h ILE 13 Ca 0.03 -0.11 0.32 0.00 1.00 0.00 0.00 64.86 66.09 1r48 h ILE 13 Cb 0.48 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 37.35 1r48 h ILE 13 CO 0.01 0.05 0.78 -0.78 0.00 0.00 0.00 178.15 178.21 1r48 h ASP 14 N 0.19 0.21 0.87 1.72 1.82 -0.11 1.31 116.42 122.43 1r48 h ASP 14 Ca 0.06 0.05 -0.14 0.00 -0.39 0.00 0.00 57.03 56.60 1r48 h ASP 14 Cb -0.00 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 40.00 1r48 h ASP 14 CO -0.01 0.02 -0.67 -0.74 -1.61 0.00 0.00 179.24 176.24 1r48 h HIS 15 N 0.18 0.00 0.09 0.28 2.76 -1.22 -2.94 115.15 114.30 1r48 h HIS 15 Ca 0.60 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.47 1r48 h HIS 15 Cb 1.96 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.91 1r48 h HIS 15 CO -0.00 0.67 -1.51 0.93 -1.30 0.00 0.00 177.93 176.72 1r48 h GLU 16 N 0.00 0.18 -0.31 5.26 4.39 0.16 -2.98 114.58 121.28 1r48 h GLU 16 Ca -0.01 -0.32 -0.05 0.00 0.34 0.00 0.00 59.36 59.33 1r48 h GLU 16 Cb 1.28 0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 30.03 1r48 h GLU 16 CO 0.09 1.02 -0.01 0.82 -1.16 0.00 0.00 179.01 179.76 1r48 h ILE 17 N 0.05 1.19 0.14 3.13 2.04 0.10 -2.75 117.51 121.41 1r48 h ILE 17 Ca -0.23 -0.76 -0.28 0.00 1.00 0.00 0.00 64.86 64.59 1r48 h ILE 17 Cb 1.99 0.97 0.01 0.00 -0.74 0.00 0.00 36.82 39.05 1r48 h ILE 17 CO 0.14 0.26 -1.26 0.00 0.00 0.00 0.00 178.15 177.29 1r48 h ALA 18 N 1.53 0.06 -0.39 1.87 0.00 -1.62 -3.11 119.26 117.61 1r48 h ALA 18 Ca 0.10 -0.85 0.06 0.00 0.00 0.00 0.00 54.91 54.22 1r48 h ALA 18 Cb 0.32 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1r48 h ALA 18 CO 0.01 0.87 0.07 -0.44 0.00 0.00 0.00 179.25 179.76 1r48 h ASP 19 N 0.12 -0.01 0.29 0.00 3.32 -1.33 -1.82 116.42 116.99 1r48 h ASP 19 Ca -0.16 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1r48 h ASP 19 Cb 1.97 0.10 0.00 0.00 0.22 0.00 0.00 39.33 41.62 1r48 h ASP 19 CO 0.22 0.03 -0.14 -0.07 -1.72 0.00 0.00 179.24 177.56 1r48 h LEU 20 N 0.19 -0.33 -1.99 1.55 3.38 -1.61 -2.65 115.31 113.85 1r48 h LEU 20 Ca 0.19 -0.11 0.35 0.00 0.09 0.00 0.00 57.88 58.39 1r48 h LEU 20 Cb 0.23 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1r48 h LEU 20 CO -0.25 -0.08 0.86 -0.61 0.09 0.00 0.00 178.44 178.45 1r48 h GLN 21 N -0.57 0.01 -0.08 1.13 4.15 -1.42 0.69 115.11 119.02 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 0.42 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.10 1r48 h GLN 21 CO 0.06 0.00 -0.76 0.00 -1.93 0.00 0.00 178.83 176.21 1r48 h ALA 22 N 1.40 0.53 -0.09 3.38 0.00 -0.98 -2.83 119.26 120.68 1r48 h ALA 22 Ca 0.57 -0.62 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1r48 h ALA 22 Cb 2.29 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 20.02 1r48 h ALA 22 CO -0.01 0.76 -0.39 0.87 0.00 0.00 0.00 179.25 180.48 1r48 h LYS 23 N 0.31 0.18 -0.13 0.00 1.79 0.58 -2.35 116.57 116.94 1r48 h LYS 23 Ca -0.04 -0.08 -0.14 0.00 -2.18 0.00 0.00 60.65 58.21 1r48 h LYS 23 Cb 1.35 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.00 1r48 h LYS 23 CO 0.13 0.55 -0.47 -0.09 -1.08 0.00 0.00 179.45 178.49 1r48 h ARG 24 N 0.15 0.56 0.45 3.15 2.43 -1.35 -2.99 114.38 116.78 1r48 h ARG 24 Ca 0.02 -0.42 -0.02 0.00 -0.81 0.00 0.00 59.98 58.74 1r48 h ARG 24 Cb 0.76 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 1r48 h ARG 24 CO 0.06 1.04 -0.22 1.15 -1.51 0.00 0.00 179.97 180.49 1r48 h THR 25 N 0.18 0.52 -0.84 0.20 2.02 -1.43 -1.81 112.91 111.75 1r48 h THR 25 Ca -0.02 -0.32 0.19 0.00 0.77 0.00 0.00 66.41 67.03 1r48 h THR 25 Cb 1.10 0.66 -0.12 0.00 -1.74 0.00 0.00 68.15 68.05 1r48 h THR 25 CO 0.10 0.05 0.33 0.08 0.37 0.00 0.00 175.52 176.46 1r48 h ARG 26 N -0.80 0.38 -0.68 6.66 0.11 -1.54 0.49 114.38 119.00 1r48 h ARG 26 Ca -0.06 -0.02 -0.04 0.00 0.10 0.00 0.00 59.98 59.95 1r48 h ARG 26 Cb 0.55 -0.09 -0.03 0.00 1.11 0.00 0.00 29.97 31.52 1r48 h ARG 26 CO 0.10 0.25 0.25 -0.07 0.10 0.00 0.00 179.97 180.60 1r48 h LEU 27 N 0.39 0.93 -0.52 0.08 4.07 -1.42 -2.51 115.31 116.32 1r48 h LEU 27 Ca 0.50 -0.14 -0.00 0.00 0.08 0.00 0.00 57.88 58.32 1r48 h LEU 27 Cb 0.90 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 42.38 1r48 h LEU 27 CO -0.50 0.85 0.31 0.58 -1.08 0.00 0.00 178.44 178.60 1r48 h VAL 28 N 0.99 1.16 -0.85 1.22 2.07 0.80 -1.23 116.25 120.41 1r48 h VAL 28 Ca 0.23 -0.38 0.20 0.00 0.82 0.00 0.00 66.70 67.57 1r48 h VAL 28 Cb 0.23 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 30.40 1r48 h VAL 28 CO -0.02 0.17 0.57 1.56 0.02 0.00 0.00 177.57 179.88 1r48 h GLN 29 N 0.70 0.33 -0.06 1.57 7.50 -0.68 0.80 115.11 125.27 1r48 h GLN 29 Ca 0.19 -0.02 -0.09 0.00 0.50 0.00 0.00 58.65 59.23 1r48 h GLN 29 Cb -0.00 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 27.44 1r48 h GLN 29 CO -0.03 0.22 -0.36 1.96 -1.50 0.00 0.00 178.83 179.11 1r48 h GLN 30 N 0.34 0.12 -2.39 1.46 4.20 -1.04 -3.36 115.11 114.44 1r48 h GLN 30 Ca 0.43 -0.05 -0.59 0.00 0.06 0.00 0.00 58.65 58.51 1r48 h GLN 30 Cb 1.17 -0.01 -0.38 0.00 0.30 0.00 0.00 27.48 28.56 1r48 h GLN 30 CO -0.14 0.47 -0.97 -3.38 -0.67 0.00 0.00 178.83 174.15 1r48 s HIS 31 N -4.23 1.07 0.28 2.96 -3.43 0.27 -4.97 115.29 107.25 1r48 s HIS 31 Ca -0.04 -2.28 0.18 0.00 -0.80 0.00 0.00 55.06 52.12 1r48 s HIS 31 Cb 0.14 -0.93 0.83 0.00 -1.43 0.00 0.00 32.58 31.19 1r48 s HIS 31 CO 0.74 -0.83 1.82 -1.00 -2.00 0.00 0.00 174.74 173.48 1r48 h PRO 32 N 5.74 0.00 0.00 -0.38 0.13 -1.44 -3.44 132.00 132.61 1r48 h PRO 32 Ca 0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.38 1r48 h PRO 32 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1r48 h PRO 32 CO 0.36 0.34 0.00 2.89 -0.23 0.00 0.00 178.00 181.36