#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 3.38 4.16 0.00 0.00 -1.26 -4.88 105.19 106.59 1r48 n GLY 2 Ca 0.00 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.41 0.00 -0.02 0.00 -1.26 -4.83 105.19 98.67 1r48 n GLY 3 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1r48 n GLY 3 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1r48 n ASP 4 N -2.73 0.00 0.00 1.61 2.03 -1.26 -5.06 116.55 111.15 1r48 n ASP 4 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1r48 n ASP 4 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1r48 n ASP 4 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1r48 n ASN 5 N -0.59 0.00 0.05 1.67 5.15 -1.26 -4.82 115.26 115.47 1r48 n ASN 5 Ca 0.00 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.85 1r48 n ASN 5 Cb 0.00 0.04 -0.08 0.00 -0.53 0.00 0.00 39.78 39.21 1r48 n ASN 5 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 1r48 h ILE 6 N 0.00 1.08 -0.88 -1.44 2.04 -1.98 -1.67 117.51 114.67 1r48 h ILE 6 Ca 0.00 -0.60 0.20 0.00 1.00 0.00 0.00 64.86 65.46 1r48 h ILE 6 Cb 0.00 1.47 -0.06 0.00 -0.74 0.00 0.00 36.82 37.49 1r48 h ILE 6 CO 0.00 0.15 0.58 -0.08 0.00 0.00 0.00 178.15 178.80 1r48 h GLU 7 N -0.38 0.37 -0.02 2.37 4.57 -1.91 0.23 114.58 119.81 1r48 h GLU 7 Ca -0.01 -0.02 -0.20 0.00 -1.18 0.00 0.00 59.36 57.95 1r48 h GLU 7 Cb 0.33 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 1r48 h GLU 7 CO 0.02 0.25 -0.84 0.37 -1.18 0.00 0.00 179.01 177.62 1r48 h GLN 8 N 0.38 0.30 -0.76 1.92 5.75 -1.82 -2.72 115.11 118.18 1r48 h GLN 8 Ca 0.45 -0.30 -0.03 0.00 -0.15 0.00 0.00 58.65 58.62 1r48 h GLN 8 Cb 1.15 0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.74 1r48 h GLN 8 CO -0.16 0.98 0.35 0.87 -2.65 0.00 0.00 178.83 178.23 1r48 h LYS 9 N 0.18 1.09 -0.25 1.69 1.57 0.38 -2.88 116.57 118.36 1r48 h LYS 9 Ca -0.05 -0.17 -0.12 0.00 -1.87 0.00 0.00 60.65 58.44 1r48 h LYS 9 Cb 1.45 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 33.57 1r48 h LYS 9 CO 0.14 0.86 -0.31 -0.84 -0.57 0.00 0.00 179.45 178.72 1r48 h ILE 10 N 1.07 1.31 -1.01 1.86 3.07 -1.34 -2.95 117.51 119.52 1r48 h ILE 10 Ca 0.26 -1.50 0.26 0.00 1.55 0.00 0.00 64.86 65.43 1r48 h ILE 10 Cb 0.13 1.68 -0.07 0.00 -0.27 0.00 0.00 36.82 38.30 1r48 h ILE 10 CO -0.03 0.47 0.68 0.44 -1.05 0.00 0.00 178.15 178.66 1r48 h ASP 11 N 0.37 0.31 -0.25 2.16 3.32 -1.29 0.67 116.42 121.71 1r48 h ASP 11 Ca 0.03 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 1r48 h ASP 11 Cb 0.89 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.43 1r48 h ASP 11 CO 0.07 0.08 -0.15 0.44 -1.72 0.00 0.00 179.24 177.96 1r48 h ASP 12 N 0.28 0.56 -0.17 6.45 5.19 -1.35 -2.98 116.42 124.40 1r48 h ASP 12 Ca 0.54 -0.43 -0.00 0.00 -0.62 0.00 0.00 57.03 56.52 1r48 h ASP 12 Cb 1.58 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.92 1r48 h ASP 12 CO -0.18 0.87 0.10 0.40 -3.12 0.00 0.00 179.24 177.30 1r48 h ILE 13 N 0.25 1.09 -1.07 0.35 2.04 0.26 -2.16 117.51 118.27 1r48 h ILE 13 Ca 0.05 -0.22 0.29 0.00 1.00 0.00 0.00 64.86 65.98 1r48 h ILE 13 Cb 0.67 0.92 -0.08 0.00 -0.74 0.00 0.00 36.82 37.59 1r48 h ILE 13 CO 0.04 0.08 0.72 -0.78 0.00 0.00 0.00 178.15 178.21 1r48 h ASP 14 N 0.19 0.27 0.94 1.72 3.58 -0.39 1.28 116.42 124.02 1r48 h ASP 14 Ca 0.06 0.05 -0.11 0.00 0.42 0.00 0.00 57.03 57.46 1r48 h ASP 14 Cb 0.04 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 1r48 h ASP 14 CO -0.01 0.05 -0.50 -0.74 -2.88 0.00 0.00 179.24 175.16 1r48 h HIS 15 N 0.24 0.00 0.10 0.28 2.76 -1.24 -2.95 115.15 114.33 1r48 h HIS 15 Ca 0.57 0.00 -0.32 0.00 -2.20 0.00 0.00 60.37 58.42 1r48 h HIS 15 Cb 1.76 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.70 1r48 h HIS 15 CO -0.00 0.50 -1.69 0.93 -1.30 0.00 0.00 177.93 176.37 1r48 h GLU 16 N 0.00 0.22 -0.19 5.26 4.39 0.16 -2.93 114.58 121.47 1r48 h GLU 16 Ca -0.01 -0.37 -0.02 0.00 0.34 0.00 0.00 59.36 59.30 1r48 h GLU 16 Cb 1.11 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 1r48 h GLU 16 CO 0.07 1.04 0.02 0.82 -1.16 0.00 0.00 179.01 179.79 1r48 h ILE 17 N 0.06 1.12 0.22 3.13 2.04 0.16 -2.50 117.51 121.73 1r48 h ILE 17 Ca -0.30 -0.44 -0.34 0.00 1.00 0.00 0.00 64.86 64.78 1r48 h ILE 17 Cb 2.02 0.95 0.03 0.00 -0.74 0.00 0.00 36.82 39.08 1r48 h ILE 17 CO 0.13 0.15 -1.61 0.00 0.00 0.00 0.00 178.15 176.82 1r48 h ALA 18 N 1.75 -0.01 -0.68 1.87 0.00 -1.64 -3.11 119.26 117.44 1r48 h ALA 18 Ca 0.07 -0.99 0.12 0.00 0.00 0.00 0.00 54.91 54.10 1r48 h ALA 18 Cb 0.16 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1r48 h ALA 18 CO 0.00 0.85 0.46 -0.44 0.00 0.00 0.00 179.25 180.12 1r48 h ASP 19 N 0.13 0.40 0.15 0.00 5.19 -1.28 0.11 116.42 121.12 1r48 h ASP 19 Ca -0.30 0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.12 1r48 h ASP 19 Cb 2.14 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 41.58 1r48 h ASP 19 CO 0.23 0.23 -0.07 -0.07 -3.12 0.00 0.00 179.24 176.43 1r48 h LEU 20 N 0.44 -0.18 -0.76 1.55 3.38 -1.55 -2.63 115.31 115.57 1r48 h LEU 20 Ca 0.32 -0.27 0.13 0.00 0.09 0.00 0.00 57.88 58.16 1r48 h LEU 20 Cb 0.67 0.05 -0.09 0.00 0.09 0.00 0.00 40.66 41.38 1r48 h LEU 20 CO -0.10 0.39 0.35 -0.61 0.09 0.00 0.00 178.44 178.56 1r48 h GLN 21 N -0.97 0.52 -0.00 1.13 5.75 -1.40 0.18 115.11 120.31 1r48 h GLN 21 Ca -0.02 -0.03 -0.06 0.00 -0.15 0.00 0.00 58.65 58.39 1r48 h GLN 21 Cb 0.43 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 1r48 h GLN 21 CO 0.03 0.34 -0.29 0.00 -2.65 0.00 0.00 178.83 176.27 1r48 h ALA 22 N 1.51 1.52 -0.07 3.38 0.00 -0.90 -1.93 119.26 122.78 1r48 h ALA 22 Ca 0.40 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.86 1r48 h ALA 22 Cb 0.55 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1r48 h ALA 22 CO -0.35 0.36 -0.77 -0.22 0.00 0.00 0.00 179.25 178.28 1r48 h LYS 23 N 0.01 0.43 -0.27 0.00 1.63 -0.33 -2.71 116.57 115.32 1r48 h LYS 23 Ca -0.00 -0.37 -0.16 0.00 -0.85 0.00 0.00 60.65 59.27 1r48 h LYS 23 Cb 0.51 0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.22 1r48 h LYS 23 CO 0.04 1.01 -0.46 -0.09 -3.45 0.00 0.00 179.45 176.49 1r48 h ARG 24 N 0.29 0.79 0.52 1.90 2.43 -0.67 -2.92 114.38 116.72 1r48 h ARG 24 Ca -0.04 -0.49 -0.03 0.00 -0.81 0.00 0.00 59.98 58.61 1r48 h ARG 24 Cb 1.36 0.05 0.01 0.00 -0.42 0.00 0.00 29.97 30.96 1r48 h ARG 24 CO 0.13 1.12 -0.25 1.15 -1.51 0.00 0.00 179.97 180.61 1r48 h THR 25 N 0.55 0.44 -1.01 0.20 2.02 -1.40 -1.30 112.91 112.41 1r48 h THR 25 Ca 0.02 -0.24 0.24 0.00 0.77 0.00 0.00 66.41 67.20 1r48 h THR 25 Cb 1.07 0.54 -0.10 0.00 -1.74 0.00 0.00 68.15 67.91 1r48 h THR 25 CO 0.11 0.04 0.63 0.08 0.37 0.00 0.00 175.52 176.74 1r48 h ARG 26 N -0.86 0.51 -0.51 6.66 0.11 -1.57 0.64 114.38 119.35 1r48 h ARG 26 Ca -0.07 -0.03 -0.11 0.00 0.10 0.00 0.00 59.98 59.86 1r48 h ARG 26 Cb 0.60 -0.11 -0.02 0.00 1.11 0.00 0.00 29.97 31.55 1r48 h ARG 26 CO 0.12 0.34 -0.13 -0.07 0.10 0.00 0.00 179.97 180.33 1r48 h LEU 27 N 0.52 0.98 -0.47 0.08 4.07 -1.30 -2.84 115.31 116.36 1r48 h LEU 27 Ca 0.59 -0.33 -0.03 0.00 0.08 0.00 0.00 57.88 58.19 1r48 h LEU 27 Cb 1.26 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 42.72 1r48 h LEU 27 CO -0.34 1.10 0.17 0.58 -1.08 0.00 0.00 178.44 178.87 1r48 h VAL 28 N 0.86 1.21 -0.61 1.22 2.07 0.13 -1.71 116.25 119.43 1r48 h VAL 28 Ca 0.13 -0.68 0.17 0.00 0.82 0.00 0.00 66.70 67.15 1r48 h VAL 28 Cb 0.68 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1r48 h VAL 28 CO 0.05 0.25 0.44 1.56 0.02 0.00 0.00 177.57 179.89 1r48 h GLN 29 N 0.62 0.02 -0.01 1.57 1.08 -0.62 0.63 115.11 118.40 1r48 h GLN 29 Ca 0.15 -0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.21 1r48 h GLN 29 Cb 0.22 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 1r48 h GLN 29 CO -0.01 0.01 -0.68 1.96 -0.95 0.00 0.00 178.83 179.16 1r48 h GLN 30 N 0.02 0.03 -2.03 1.46 1.08 -1.09 -3.36 115.11 111.22 1r48 h GLN 30 Ca 0.29 -0.03 -0.54 0.00 -1.45 0.00 0.00 58.65 56.92 1r48 h GLN 30 Cb 1.15 0.01 -0.40 0.00 -0.05 0.00 0.00 27.48 28.18 1r48 h GLN 30 CO -0.01 0.70 -1.07 -2.39 -0.95 0.00 0.00 178.83 175.11 1r48 n HIS 31 N -3.74 0.33 0.51 2.96 1.44 0.19 -4.92 115.22 111.98 1r48 n HIS 31 Ca -0.01 -3.71 0.13 0.00 -2.01 0.00 0.00 57.72 52.12 1r48 n HIS 31 Cb 0.67 -0.39 0.41 0.00 0.12 0.00 0.00 29.99 30.80 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 3.69 0.00 0.00 -1.40 0.13 -0.91 -3.45 132.00 130.06 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 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1r48 h PRO 32 CO 0.52 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.83