#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 4.74 7.00 0.00 0.00 -1.26 -5.01 105.19 110.66 1r48 n GLY 2 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 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 0.12 1.02 1.23 -0.02 0.00 -1.26 -3.04 105.19 103.23 1r48 n GLY 3 Ca 0.46 -0.74 0.07 0.00 0.00 0.00 0.00 46.02 45.81 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 0.26 3.58 -0.13 1.61 8.00 -1.26 -4.35 116.55 124.26 1r48 n ASP 4 Ca 0.00 -2.29 0.26 0.00 0.71 0.00 0.00 54.79 53.46 1r48 n ASP 4 Cb 0.00 -0.48 0.71 0.00 -0.02 0.00 0.00 41.12 41.32 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 3.07 0.02 0.17 -2.24 -0.26 -1.98 0.13 115.58 114.48 1r48 h ASN 5 Ca 0.00 0.00 -0.22 0.00 -0.56 0.00 0.00 56.30 55.52 1r48 h ASN 5 Cb 1.10 -0.00 0.03 0.00 -1.06 0.00 0.00 38.32 38.38 1r48 h ASN 5 CO 0.16 0.01 -0.96 0.40 -1.06 0.00 0.00 177.43 175.97 1r48 h ILE 6 N 0.02 1.46 -0.23 2.81 2.04 -1.83 -3.20 117.51 118.58 1r48 h ILE 6 Ca 0.37 -2.57 0.07 0.00 1.00 0.00 0.00 64.86 63.73 1r48 h ILE 6 Cb 1.47 3.17 -0.01 0.00 -0.74 0.00 0.00 36.82 40.71 1r48 h ILE 6 CO -0.01 0.74 0.25 -0.08 0.00 0.00 0.00 178.15 179.05 1r48 h GLU 7 N -0.26 0.00 -0.01 2.37 4.57 -1.09 -0.48 114.58 119.67 1r48 h GLU 7 Ca -0.17 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 57.88 1r48 h GLU 7 Cb 1.76 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 30.36 1r48 h GLU 7 CO 0.18 0.00 -0.51 0.37 -1.18 0.00 0.00 179.01 177.87 1r48 h GLN 8 N 0.00 0.37 -0.64 1.92 5.75 -1.26 -2.21 115.11 119.02 1r48 h GLN 8 Ca 0.11 -0.38 0.01 0.00 -0.15 0.00 0.00 58.65 58.24 1r48 h GLN 8 Cb 0.61 0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.23 1r48 h GLN 8 CO -0.00 1.05 0.43 0.87 -2.65 0.00 0.00 178.83 178.53 1r48 h LYS 9 N -0.17 0.84 -0.41 1.69 1.57 -1.12 -2.69 116.57 116.29 1r48 h LYS 9 Ca -0.06 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.58 1r48 h LYS 9 Cb 1.22 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.33 1r48 h LYS 9 CO 0.10 0.56 -0.08 -0.84 -0.57 0.00 0.00 179.45 178.62 1r48 h ILE 10 N 0.87 1.27 -1.12 1.86 3.07 -1.36 -2.73 117.51 119.37 1r48 h ILE 10 Ca 0.24 -1.16 0.31 0.00 1.55 0.00 0.00 64.86 65.80 1r48 h ILE 10 Cb -0.10 1.19 -0.10 0.00 -0.27 0.00 0.00 36.82 37.55 1r48 h ILE 10 CO -0.05 0.39 0.73 0.44 -1.05 0.00 0.00 178.15 178.61 1r48 h ASP 11 N 0.59 0.35 -0.14 2.16 3.32 -1.06 0.83 116.42 122.47 1r48 h ASP 11 Ca 0.11 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 1r48 h ASP 11 Cb 0.60 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.18 1r48 h ASP 11 CO 0.04 0.02 -0.02 0.44 -1.72 0.00 0.00 179.24 178.00 1r48 h ASP 12 N 0.28 0.26 -0.32 6.45 5.19 -1.33 -2.93 116.42 124.01 1r48 h ASP 12 Ca 0.64 -0.34 0.00 0.00 -0.62 0.00 0.00 57.03 56.71 1r48 h ASP 12 Cb 1.84 -0.07 -0.02 0.00 0.18 0.00 0.00 39.33 41.26 1r48 h ASP 12 CO -0.29 0.54 0.21 0.40 -3.12 0.00 0.00 179.24 176.98 1r48 h ILE 13 N -0.03 1.09 -1.12 0.35 2.04 0.51 -1.86 117.51 118.49 1r48 h ILE 13 Ca 0.04 -0.18 0.31 0.00 1.00 0.00 0.00 64.86 66.03 1r48 h ILE 13 Cb 0.42 0.64 -0.07 0.00 -0.74 0.00 0.00 36.82 37.06 1r48 h ILE 13 CO 0.01 0.09 0.77 -0.78 0.00 0.00 0.00 178.15 178.24 1r48 h ASP 14 N 0.43 0.19 0.84 1.72 3.58 -0.09 1.32 116.42 124.40 1r48 h ASP 14 Ca 0.12 0.04 -0.15 0.00 0.42 0.00 0.00 57.03 57.46 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 0.03 -0.70 -0.74 -2.88 0.00 0.00 179.24 174.92 1r48 h HIS 15 N 0.16 0.00 0.07 0.28 2.76 -1.16 -2.92 115.15 114.34 1r48 h HIS 15 Ca 0.58 0.00 -0.28 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 30.89 1r48 h HIS 15 CO -0.00 0.70 -1.48 0.93 -1.30 0.00 0.00 177.93 176.78 1r48 h GLU 16 N 0.00 0.14 -0.18 5.26 5.08 0.16 -3.00 114.58 122.04 1r48 h GLU 16 Ca -0.01 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.05 1r48 h GLU 16 Cb 1.31 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.63 1r48 h GLU 16 CO 0.09 0.96 -0.16 0.82 -1.00 0.00 0.00 179.01 179.72 1r48 h ILE 17 N 0.04 1.21 0.19 3.13 2.04 0.17 -2.88 117.51 121.40 1r48 h ILE 17 Ca -0.21 -0.93 -0.31 0.00 1.00 0.00 0.00 64.86 64.41 1r48 h ILE 17 Cb 1.97 1.25 0.02 0.00 -0.74 0.00 0.00 36.82 39.32 1r48 h ILE 17 CO 0.13 0.29 -1.38 0.00 0.00 0.00 0.00 178.15 177.19 1r48 h ALA 18 N 1.56 -0.01 -0.67 1.87 0.00 -1.61 -3.09 119.26 117.31 1r48 h ALA 18 Ca 0.05 -0.90 0.11 0.00 0.00 0.00 0.00 54.91 54.17 1r48 h ALA 18 Cb 0.46 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 1r48 h ALA 18 CO 0.03 0.86 0.27 -0.44 0.00 0.00 0.00 179.25 179.97 1r48 h ASP 19 N 0.11 0.29 0.01 0.00 5.19 -1.36 -0.77 116.42 119.88 1r48 h ASP 19 Ca -0.20 0.08 -0.00 0.00 -0.62 0.00 0.00 57.03 56.29 1r48 h ASP 19 Cb 2.07 0.05 0.00 0.00 0.18 0.00 0.00 39.33 41.63 1r48 h ASP 19 CO 0.23 0.15 -0.00 -0.07 -3.12 0.00 0.00 179.24 176.43 1r48 h LEU 20 N 0.46 -0.01 -1.32 1.55 3.38 -1.63 -2.92 115.31 114.82 1r48 h LEU 20 Ca 0.34 -0.43 0.23 0.00 0.09 0.00 0.00 57.88 58.12 1r48 h LEU 20 Cb 0.44 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.10 1r48 h LEU 20 CO -0.32 0.42 0.63 -0.61 0.09 0.00 0.00 178.44 178.65 1r48 h GLN 21 N -0.44 0.47 -0.30 1.13 4.15 -1.35 0.28 115.11 119.06 1r48 h GLN 21 Ca -0.00 -0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.28 1r48 h GLN 21 Cb 0.43 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1r48 h GLN 21 CO 0.00 0.31 -0.29 0.00 -1.93 0.00 0.00 178.83 176.93 1r48 h ALA 22 N 1.62 0.93 -0.24 3.38 0.00 -1.08 -2.36 119.26 121.52 1r48 h ALA 22 Ca 0.55 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1r48 h ALA 22 Cb 1.26 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1r48 h ALA 22 CO -0.28 0.61 -0.08 0.87 0.00 0.00 0.00 179.25 180.37 1r48 h LYS 23 N 0.54 0.38 -0.03 0.00 6.56 -0.26 -1.75 116.57 122.00 1r48 h LYS 23 Ca 0.07 -0.09 -0.07 0.00 -1.06 0.00 0.00 60.65 59.50 1r48 h LYS 23 Cb 0.77 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.38 1r48 h LYS 23 CO 0.06 0.47 -0.27 0.00 -2.06 0.00 0.00 179.45 177.66 1r48 h ARG 24 N 0.36 0.23 0.37 3.15 3.08 -1.17 -2.99 114.38 117.42 1r48 h ARG 24 Ca 0.08 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 1r48 h ARG 24 Cb 0.37 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1r48 h ARG 24 CO 0.02 0.89 -0.21 1.15 -1.07 0.00 0.00 179.97 180.75 1r48 h THR 25 N -0.35 0.57 -0.66 2.04 2.02 -1.31 -0.88 112.91 114.35 1r48 h THR 25 Ca -0.03 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.28 1r48 h THR 25 Cb 0.96 0.57 -0.09 0.00 -1.74 0.00 0.00 68.15 67.85 1r48 h THR 25 CO 0.05 0.00 0.18 0.08 0.37 0.00 0.00 175.52 176.20 1r48 h ARG 26 N -0.54 0.30 -0.52 6.66 -0.00 -1.45 0.36 114.38 119.18 1r48 h ARG 26 Ca -0.04 -0.02 -0.01 0.00 -0.00 0.00 0.00 59.98 59.91 1r48 h ARG 26 Cb 0.43 -0.07 -0.03 0.00 -0.00 0.00 0.00 29.97 30.31 1r48 h ARG 26 CO 0.06 0.20 0.28 -0.07 -0.00 0.00 0.00 179.97 180.44 1r48 h LEU 27 N 0.31 0.64 -0.44 0.08 3.38 -1.33 -2.04 115.31 115.90 1r48 h LEU 27 Ca 0.36 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.23 1r48 h LEU 27 Cb 0.55 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1r48 h LEU 27 CO -0.42 0.52 0.07 0.58 0.09 0.00 0.00 178.44 179.27 1r48 h VAL 28 N 0.72 1.25 -0.91 1.22 2.07 0.11 -2.09 116.25 118.61 1r48 h VAL 28 Ca 0.19 -0.90 0.25 0.00 0.82 0.00 0.00 66.70 67.05 1r48 h VAL 28 Cb 0.03 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 1r48 h VAL 28 CO -0.03 0.31 0.64 1.56 0.02 0.00 0.00 177.57 180.07 1r48 h GLN 29 N 0.59 0.13 -0.08 1.57 1.08 -0.23 0.96 115.11 119.12 1r48 h GLN 29 Ca 0.13 -0.01 -0.17 0.00 -1.45 0.00 0.00 58.65 57.16 1r48 h GLN 29 Cb 0.39 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.78 1r48 h GLN 29 CO 0.01 0.08 -0.66 1.96 -0.95 0.00 0.00 178.83 179.27 1r48 h GLN 30 N 0.13 0.35 -2.03 1.46 1.08 -1.20 -3.37 115.11 111.53 1r48 h GLN 30 Ca 0.45 -0.26 -0.55 0.00 -1.45 0.00 0.00 58.65 56.84 1r48 h GLN 30 Cb 1.57 0.05 -0.40 0.00 -0.05 0.00 0.00 27.48 28.65 1r48 h GLN 30 CO -0.07 0.89 -1.06 -2.39 -0.95 0.00 0.00 178.83 175.25 1r48 n HIS 31 N -3.86 0.33 0.14 2.96 1.44 0.29 -4.93 115.22 111.59 1r48 n HIS 31 Ca -0.03 -3.70 0.01 0.00 -2.01 0.00 0.00 57.72 51.99 1r48 n HIS 31 Cb 0.66 -0.39 0.15 0.00 0.12 0.00 0.00 29.99 30.53 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 3.74 0.00 0.00 -1.40 0.13 -0.33 -3.45 132.00 130.70 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 0.52 0.59 0.00 2.89 -0.23 0.00 0.00 178.00 181.77