#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 1.69 7.00 0.00 0.00 -1.26 -5.13 105.19 107.49 1r48 n GLY 2 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 0.65 0.94 -0.02 0.00 -1.26 -3.08 105.19 102.42 1r48 n GLY 3 Ca 0.00 -0.79 0.06 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.64 2.72 -0.23 1.61 8.00 -1.26 -4.29 116.55 122.46 1r48 n ASP 4 Ca 0.00 -2.14 0.23 0.00 0.71 0.00 0.00 54.79 53.59 1r48 n ASP 4 Cb 0.00 -0.38 0.59 0.00 -0.02 0.00 0.00 41.12 41.32 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 2.51 0.26 -0.17 -2.24 -0.00 -1.97 0.33 115.58 114.29 1r48 h ASN 5 Ca 0.00 0.03 -0.05 0.00 -0.00 0.00 0.00 56.30 56.29 1r48 h ASN 5 Cb 0.79 -0.01 -0.00 0.00 -0.00 0.00 0.00 38.32 39.09 1r48 h ASN 5 CO 0.08 0.09 -0.07 0.40 -0.00 0.00 0.00 177.43 177.92 1r48 h ILE 6 N 0.25 1.30 -1.00 2.57 2.04 -1.82 0.88 117.51 121.73 1r48 h ILE 6 Ca 0.47 -1.10 0.12 0.00 1.00 0.00 0.00 64.86 65.36 1r48 h ILE 6 Cb 1.44 1.67 -0.08 0.00 -0.74 0.00 0.00 36.82 39.11 1r48 h ILE 6 CO -0.13 0.33 0.63 -0.08 0.00 0.00 0.00 178.15 178.89 1r48 h GLU 7 N 0.03 0.97 0.19 2.37 4.81 -0.71 0.40 114.58 122.64 1r48 h GLU 7 Ca 0.04 -0.06 -0.32 0.00 -0.13 0.00 0.00 59.36 58.89 1r48 h GLU 7 Cb 0.54 -0.22 0.02 0.00 0.63 0.00 0.00 28.75 29.72 1r48 h GLU 7 CO 0.02 0.64 -1.49 0.37 -0.73 0.00 0.00 179.01 177.83 1r48 h GLN 8 N 1.00 0.40 -0.05 1.92 4.15 -1.12 -3.10 115.11 118.31 1r48 h GLN 8 Ca 0.49 -0.68 -0.03 0.00 0.77 0.00 0.00 58.65 59.20 1r48 h GLN 8 Cb 0.47 0.25 -0.01 0.00 0.21 0.00 0.00 27.48 28.41 1r48 h GLN 8 CO -0.26 1.31 -0.11 0.87 -1.93 0.00 0.00 178.83 178.70 1r48 h LYS 9 N 0.11 0.07 0.02 1.69 1.57 0.17 -2.88 116.57 117.32 1r48 h LYS 9 Ca -0.24 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.42 1r48 h LYS 9 Cb 2.08 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 34.39 1r48 h LYS 9 CO 0.22 0.19 -0.43 -0.84 -0.57 0.00 0.00 179.45 178.01 1r48 h ILE 10 N 0.07 1.52 -1.05 1.86 3.07 -0.31 -2.91 117.51 119.76 1r48 h ILE 10 Ca 0.01 -2.11 0.28 0.00 1.55 0.00 0.00 64.86 64.59 1r48 h ILE 10 Cb 0.24 2.82 -0.07 0.00 -0.27 0.00 0.00 36.82 39.54 1r48 h ILE 10 CO 0.02 0.59 0.70 -0.78 -1.05 0.00 0.00 178.15 177.63 1r48 h ASP 11 N -0.39 0.29 -0.02 2.16 1.82 -1.43 0.47 116.42 119.32 1r48 h ASP 11 Ca -0.06 0.05 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 1r48 h ASP 11 Cb 1.20 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.22 1r48 h ASP 11 CO 0.08 0.06 -0.02 0.44 -1.61 0.00 0.00 179.24 178.20 1r48 h ASP 12 N 0.26 0.05 -0.16 2.28 5.19 -1.53 -3.05 116.42 119.46 1r48 h ASP 12 Ca 0.56 -0.50 0.01 0.00 -0.62 0.00 0.00 57.03 56.48 1r48 h ASP 12 Cb 1.68 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 41.16 1r48 h ASP 12 CO -0.19 0.54 0.07 0.40 -3.12 0.00 0.00 179.24 176.94 1r48 h ILE 13 N -0.44 0.99 -1.10 0.35 2.04 -0.38 -2.03 117.51 116.93 1r48 h ILE 13 Ca 0.00 -0.05 0.30 0.00 1.00 0.00 0.00 64.86 66.11 1r48 h ILE 13 Cb 0.53 0.82 -0.09 0.00 -0.74 0.00 0.00 36.82 37.34 1r48 h ILE 13 CO 0.00 0.03 0.72 -0.78 0.00 0.00 0.00 178.15 178.12 1r48 h ASP 14 N 0.15 0.35 0.85 1.72 1.82 -0.29 1.32 116.42 122.34 1r48 h ASP 14 Ca 0.06 0.08 -0.11 0.00 -0.39 0.00 0.00 57.03 56.67 1r48 h ASP 14 Cb 0.02 0.03 -0.02 0.00 0.68 0.00 0.00 39.33 40.04 1r48 h ASP 14 CO -0.05 0.03 -0.52 -0.74 -1.61 0.00 0.00 179.24 176.35 1r48 h HIS 15 N 0.29 0.00 0.09 0.28 2.76 -1.26 -2.93 115.15 114.38 1r48 h HIS 15 Ca 0.62 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 58.48 1r48 h HIS 15 Cb 1.77 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.71 1r48 h HIS 15 CO -0.00 0.52 -1.62 0.93 -1.30 0.00 0.00 177.93 176.46 1r48 h GLU 16 N 0.00 0.19 -0.12 5.26 4.39 0.16 -3.02 114.58 121.44 1r48 h GLU 16 Ca -0.01 -0.32 -0.03 0.00 0.34 0.00 0.00 59.36 59.34 1r48 h GLU 16 Cb 1.09 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.85 1r48 h GLU 16 CO 0.07 0.99 -0.07 0.82 -1.16 0.00 0.00 179.01 179.66 1r48 h ILE 17 N 0.05 1.13 0.24 3.13 2.04 0.32 -2.68 117.51 121.74 1r48 h ILE 17 Ca -0.27 -0.54 -0.34 0.00 1.00 0.00 0.00 64.86 64.71 1r48 h ILE 17 Cb 2.01 1.11 0.03 0.00 -0.74 0.00 0.00 36.82 39.23 1r48 h ILE 17 CO 0.13 0.17 -1.55 0.00 0.00 0.00 0.00 178.15 176.90 1r48 h ALA 18 N 1.76 -0.09 -0.91 1.87 0.00 -1.62 -3.09 119.26 117.18 1r48 h ALA 18 Ca 0.04 -0.93 0.13 0.00 0.00 0.00 0.00 54.91 54.16 1r48 h ALA 18 Cb 0.24 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.19 1r48 h ALA 18 CO 0.01 0.77 0.52 -0.44 0.00 0.00 0.00 179.25 180.12 1r48 h ASP 19 N 0.14 0.71 0.08 0.00 5.19 -1.34 -1.13 116.42 120.06 1r48 h ASP 19 Ca -0.28 0.07 -0.00 0.00 -0.62 0.00 0.00 57.03 56.20 1r48 h ASP 19 Cb 2.16 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 41.61 1r48 h ASP 19 CO 0.25 0.34 -0.04 -0.07 -3.12 0.00 0.00 179.24 176.61 1r48 h LEU 20 N 0.78 -0.09 -1.41 1.55 3.38 -1.61 -2.90 115.31 115.01 1r48 h LEU 20 Ca 0.47 -0.46 0.25 0.00 0.09 0.00 0.00 57.88 58.23 1r48 h LEU 20 Cb 0.58 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.27 1r48 h LEU 20 CO -0.31 0.45 0.65 -0.61 0.09 0.00 0.00 178.44 178.71 1r48 h GLN 21 N -0.67 0.39 -0.22 1.13 -0.00 -1.36 0.34 115.11 114.72 1r48 h GLN 21 Ca -0.01 -0.02 -0.15 0.00 -0.00 0.00 0.00 58.65 58.47 1r48 h GLN 21 Cb 0.55 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.93 1r48 h GLN 21 CO 0.02 0.26 -0.47 0.00 0.00 0.00 0.00 178.83 178.63 1r48 h ALA 22 N 1.61 0.76 -0.29 3.38 0.00 -1.21 -2.57 119.26 120.94 1r48 h ALA 22 Ca 0.56 -0.48 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1r48 h ALA 22 Cb 1.40 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1r48 h ALA 22 CO -0.25 0.67 -0.19 0.87 0.00 0.00 0.00 179.25 180.35 1r48 h LYS 23 N 0.46 0.52 -0.27 0.00 1.57 -0.15 -1.80 116.57 116.90 1r48 h LYS 23 Ca 0.03 -0.17 -0.17 0.00 -1.87 0.00 0.00 60.65 58.46 1r48 h LYS 23 Cb 1.00 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.27 1r48 h LYS 23 CO 0.09 0.69 -0.48 -0.09 -0.57 0.00 0.00 179.45 179.09 1r48 h ARG 24 N 0.47 0.80 0.44 3.15 2.43 -1.18 -2.96 114.38 117.53 1r48 h ARG 24 Ca 0.08 -0.50 -0.02 0.00 -0.81 0.00 0.00 59.98 58.72 1r48 h ARG 24 Cb 0.59 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1r48 h ARG 24 CO 0.04 1.13 -0.21 1.15 -1.51 0.00 0.00 179.97 180.57 1r48 h THR 25 N 0.56 0.47 -1.02 0.20 2.02 -1.31 -2.15 112.91 111.69 1r48 h THR 25 Ca 0.02 -0.46 0.24 0.00 0.77 0.00 0.00 66.41 66.98 1r48 h THR 25 Cb 1.09 0.66 -0.11 0.00 -1.74 0.00 0.00 68.15 68.05 1r48 h THR 25 CO 0.11 0.07 0.63 0.08 0.37 0.00 0.00 175.52 176.78 1r48 h ARG 26 N -0.89 0.51 -0.55 6.66 0.11 -1.43 0.77 114.38 119.55 1r48 h ARG 26 Ca -0.06 -0.03 -0.09 0.00 0.10 0.00 0.00 59.98 59.89 1r48 h ARG 26 Cb 0.57 -0.11 -0.02 0.00 1.11 0.00 0.00 29.97 31.51 1r48 h ARG 26 CO 0.10 0.34 -0.03 -0.07 0.10 0.00 0.00 179.97 180.40 1r48 h LEU 27 N 0.52 0.95 -0.50 0.08 4.07 -1.43 -2.70 115.31 116.30 1r48 h LEU 27 Ca 0.60 -0.27 -0.03 0.00 0.08 0.00 0.00 57.88 58.26 1r48 h LEU 27 Cb 1.29 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.76 1r48 h LEU 27 CO -0.37 1.03 0.19 0.58 -1.08 0.00 0.00 178.44 178.79 1r48 h VAL 28 N 0.89 1.22 -0.64 1.22 2.07 0.11 -1.45 116.25 119.67 1r48 h VAL 28 Ca 0.16 -0.69 0.19 0.00 0.82 0.00 0.00 66.70 67.17 1r48 h VAL 28 Cb 0.56 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1r48 h VAL 28 CO 0.03 0.26 0.50 1.56 0.02 0.00 0.00 177.57 179.94 1r48 h GLN 29 N 0.68 0.00 -0.00 1.57 1.08 -0.49 0.86 115.11 118.80 1r48 h GLN 29 Ca 0.17 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.19 1r48 h GLN 29 Cb 0.21 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 1r48 h GLN 29 CO -0.01 0.00 -0.80 0.37 -0.95 0.00 0.00 178.83 177.44 1r48 h GLN 30 N 0.00 0.10 -2.03 1.46 4.15 -1.04 -3.37 115.11 114.39 1r48 h GLN 30 Ca 0.30 -0.10 -0.50 0.00 0.77 0.00 0.00 58.65 59.12 1r48 h GLN 30 Cb 1.29 0.03 -0.40 0.00 0.21 0.00 0.00 27.48 28.61 1r48 h GLN 30 CO -0.00 0.85 -1.14 -2.39 -1.93 0.00 0.00 178.83 174.22 1r48 n HIS 31 N -3.66 0.55 0.07 3.99 1.44 0.24 -4.93 115.22 112.92 1r48 n HIS 31 Ca -0.02 -3.82 -0.22 0.00 -2.01 0.00 0.00 57.72 51.65 1r48 n HIS 31 Cb 0.76 -0.42 -0.15 0.00 0.12 0.00 0.00 29.99 30.30 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 3.07 0.37 -0.02 -1.40 0.13 -0.02 -3.45 132.00 130.67 1r48 h PRO 32 Ca 0.10 -0.63 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1r48 h PRO 32 Cb 0.92 0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1r48 h PRO 32 CO 0.53 1.30 0.00 0.54 -0.23 0.00 0.00 178.00 180.14