#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 -1.97 6.17 0.00 0.00 -1.26 -5.04 105.19 103.09 1r48 n GLY 2 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.74 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 -0.17 1.40 0.07 -0.02 0.00 -1.26 -2.15 105.19 103.06 1r48 n GLY 3 Ca 0.00 0.24 0.04 0.00 0.00 0.00 0.00 46.02 46.30 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 5.86 1.88 -0.00 1.61 8.00 -1.26 -4.72 116.55 127.91 1r48 n ASP 4 Ca 0.00 -2.41 0.22 0.00 0.71 0.00 0.00 54.79 53.31 1r48 n ASP 4 Cb 0.00 -0.20 0.72 0.00 -0.02 0.00 0.00 41.12 41.62 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 0.00 0.00 0.12 -2.24 -0.00 -1.84 0.56 115.58 112.18 1r48 h ASN 5 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 56.30 56.05 1r48 h ASN 5 Cb 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.14 1r48 h ASN 5 CO 0.00 0.00 -1.26 0.40 -0.00 0.00 0.00 177.43 176.57 1r48 h ILE 6 N 0.00 1.15 -0.11 2.57 5.03 -1.85 -3.25 117.51 121.04 1r48 h ILE 6 Ca 0.27 -2.43 0.03 0.00 -0.12 0.00 0.00 64.86 62.62 1r48 h ILE 6 Cb 1.23 2.82 -0.00 0.00 -3.03 0.00 0.00 36.82 37.84 1r48 h ILE 6 CO -0.00 0.70 0.17 -0.08 -0.68 0.00 0.00 178.15 178.25 1r48 h GLU 7 N -0.34 0.00 0.09 2.37 4.57 -1.28 -0.98 114.58 119.02 1r48 h GLU 7 Ca -0.26 0.00 -0.17 0.00 -1.18 0.00 0.00 59.36 57.74 1r48 h GLU 7 Cb 1.72 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 30.32 1r48 h GLU 7 CO 0.07 0.00 -0.74 0.37 -1.18 0.00 0.00 179.01 177.53 1r48 h GLN 8 N 0.00 0.34 -0.99 1.92 5.75 -1.23 -2.72 115.11 118.18 1r48 h GLN 8 Ca 0.05 -0.49 0.01 0.00 -0.15 0.00 0.00 58.65 58.07 1r48 h GLN 8 Cb 0.40 0.17 -0.05 0.00 1.07 0.00 0.00 27.48 29.06 1r48 h GLN 8 CO -0.00 1.19 0.65 -0.22 -2.65 0.00 0.00 178.83 177.80 1r48 h LYS 9 N -0.28 1.30 -0.33 1.69 3.64 -1.25 -2.59 116.57 118.76 1r48 h LYS 9 Ca -0.12 -0.08 -0.11 0.00 -1.27 0.00 0.00 60.65 59.07 1r48 h LYS 9 Cb 1.53 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 33.05 1r48 h LYS 9 CO 0.14 0.87 -0.23 -0.84 -2.27 0.00 0.00 179.45 177.12 1r48 h ILE 10 N 1.34 1.29 -1.07 2.00 3.07 -1.43 -2.85 117.51 119.87 1r48 h ILE 10 Ca 0.36 -1.37 0.28 0.00 1.55 0.00 0.00 64.86 65.68 1r48 h ILE 10 Cb -0.14 1.44 -0.09 0.00 -0.27 0.00 0.00 36.82 37.75 1r48 h ILE 10 CO -0.08 0.45 0.69 0.44 -1.05 0.00 0.00 178.15 178.60 1r48 h ASP 11 N 0.52 0.41 -0.33 2.16 5.19 -1.13 1.02 116.42 124.25 1r48 h ASP 11 Ca 0.07 0.08 -0.06 0.00 -0.62 0.00 0.00 57.03 56.50 1r48 h ASP 11 Cb 0.79 0.02 -0.01 0.00 0.18 0.00 0.00 39.33 40.31 1r48 h ASP 11 CO 0.06 0.06 -0.04 0.44 -3.12 0.00 0.00 179.24 176.64 1r48 h ASP 12 N 0.35 0.61 -0.10 6.45 3.32 -1.36 -2.93 116.42 122.75 1r48 h ASP 12 Ca 0.61 -0.34 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 1r48 h ASP 12 Cb 1.63 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 41.01 1r48 h ASP 12 CO -0.29 0.80 0.05 0.40 -1.72 0.00 0.00 179.24 178.48 1r48 h ILE 13 N 0.41 1.09 -1.19 0.35 2.04 0.94 -2.18 117.51 118.96 1r48 h ILE 13 Ca 0.09 -0.24 0.34 0.00 1.00 0.00 0.00 64.86 66.05 1r48 h ILE 13 Cb 0.51 1.07 -0.06 0.00 -0.74 0.00 0.00 36.82 37.60 1r48 h ILE 13 CO 0.02 0.08 0.84 -0.78 0.00 0.00 0.00 178.15 178.31 1r48 h ASP 14 N 0.07 0.10 0.94 1.72 3.58 -0.09 1.39 116.42 124.12 1r48 h ASP 14 Ca 0.04 0.02 -0.16 0.00 0.42 0.00 0.00 57.03 57.35 1r48 h ASP 14 Cb 0.08 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 1r48 h ASP 14 CO -0.01 0.01 -0.75 -0.74 -2.88 0.00 0.00 179.24 174.87 1r48 h HIS 15 N 0.08 0.00 0.11 0.28 2.76 -1.22 -2.94 115.15 114.22 1r48 h HIS 15 Ca 0.59 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 58.45 1r48 h HIS 15 Cb 2.18 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 31.13 1r48 h HIS 15 CO -0.00 0.75 -1.59 0.93 -1.30 0.00 0.00 177.93 176.72 1r48 h GLU 16 N 0.00 0.22 -0.31 5.26 4.39 0.17 -2.94 114.58 121.38 1r48 h GLU 16 Ca -0.01 -0.38 -0.05 0.00 0.34 0.00 0.00 59.36 59.27 1r48 h GLU 16 Cb 1.42 0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 30.20 1r48 h GLU 16 CO 0.10 1.06 -0.01 0.82 -1.16 0.00 0.00 179.01 179.82 1r48 h ILE 17 N 0.06 1.19 0.16 3.13 2.04 0.14 -2.75 117.51 121.47 1r48 h ILE 17 Ca -0.26 -0.75 -0.29 0.00 1.00 0.00 0.00 64.86 64.56 1r48 h ILE 17 Cb 2.01 0.97 0.02 0.00 -0.74 0.00 0.00 36.82 39.08 1r48 h ILE 17 CO 0.14 0.25 -1.30 0.00 0.00 0.00 0.00 178.15 177.25 1r48 h ALA 18 N 1.54 0.03 -0.82 1.87 0.00 -1.63 -3.10 119.26 117.16 1r48 h ALA 18 Ca 0.10 -0.86 0.12 0.00 0.00 0.00 0.00 54.91 54.27 1r48 h ALA 18 Cb 0.32 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.08 1r48 h ALA 18 CO 0.01 0.87 0.44 -0.44 0.00 0.00 0.00 179.25 180.13 1r48 h ASP 19 N 0.11 0.57 0.01 0.00 5.19 -1.30 0.79 116.42 121.80 1r48 h ASP 19 Ca -0.17 0.07 -0.00 0.00 -0.62 0.00 0.00 57.03 56.31 1r48 h ASP 19 Cb 2.01 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 41.49 1r48 h ASP 19 CO 0.23 0.29 -0.01 -0.07 -3.12 0.00 0.00 179.24 176.56 1r48 h LEU 20 N 0.68 -0.02 -0.99 1.55 3.38 -1.61 -2.78 115.31 115.52 1r48 h LEU 20 Ca 0.42 -0.53 0.14 0.00 0.09 0.00 0.00 57.88 58.00 1r48 h LEU 20 Cb 0.50 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.17 1r48 h LEU 20 CO -0.31 0.53 0.61 -0.61 0.09 0.00 0.00 178.44 178.75 1r48 h GLN 21 N -0.57 0.86 -0.12 1.13 4.15 -1.36 0.16 115.11 119.36 1r48 h GLN 21 Ca -0.00 -0.05 -0.07 0.00 0.77 0.00 0.00 58.65 59.29 1r48 h GLN 21 Cb 0.55 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.03 1r48 h GLN 21 CO 0.00 0.57 -0.26 0.00 -1.93 0.00 0.00 178.83 177.22 1r48 h ALA 22 N 1.57 1.35 -0.08 3.38 0.00 -0.86 -1.67 119.26 122.95 1r48 h ALA 22 Ca 0.52 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 1r48 h ALA 22 Cb 0.63 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1r48 h ALA 22 CO -0.31 0.45 -0.60 0.87 0.00 0.00 0.00 179.25 179.66 1r48 h LYS 23 N 0.19 0.27 -0.06 0.00 1.57 -0.45 -2.59 116.57 115.50 1r48 h LYS 23 Ca 0.03 -0.18 -0.17 0.00 -1.87 0.00 0.00 60.65 58.46 1r48 h LYS 23 Cb 0.57 0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.91 1r48 h LYS 23 CO 0.04 0.79 -0.61 -0.09 -0.57 0.00 0.00 179.45 179.01 1r48 h ARG 24 N 0.20 0.52 0.40 3.15 2.43 -0.85 -3.01 114.38 117.22 1r48 h ARG 24 Ca -0.00 -0.48 -0.02 0.00 -0.81 0.00 0.00 59.98 58.67 1r48 h ARG 24 Cb 1.10 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.77 1r48 h ARG 24 CO 0.09 1.11 -0.19 1.15 -1.51 0.00 0.00 179.97 180.62 1r48 h THR 25 N 0.10 0.61 -0.82 0.20 2.02 -1.33 -0.96 112.91 112.73 1r48 h THR 25 Ca -0.06 -0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.29 1r48 h THR 25 Cb 1.28 0.61 -0.11 0.00 -1.74 0.00 0.00 68.15 68.19 1r48 h THR 25 CO 0.12 0.00 0.35 0.08 0.37 0.00 0.00 175.52 176.44 1r48 h ARG 26 N -0.54 0.43 -0.75 6.66 0.11 -1.57 0.50 114.38 119.23 1r48 h ARG 26 Ca -0.06 -0.03 -0.03 0.00 0.10 0.00 0.00 59.98 59.97 1r48 h ARG 26 Cb 0.41 -0.10 -0.04 0.00 1.11 0.00 0.00 29.97 31.36 1r48 h ARG 26 CO 0.09 0.29 0.36 -0.07 0.10 0.00 0.00 179.97 180.74 1r48 h LEU 27 N 0.45 0.96 -0.36 0.08 3.38 -1.33 -2.43 115.31 116.06 1r48 h LEU 27 Ca 0.47 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.31 1r48 h LEU 27 Cb 0.79 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1r48 h LEU 27 CO -0.45 0.81 0.10 0.58 0.09 0.00 0.00 178.44 179.57 1r48 h VAL 28 N 1.06 1.22 -0.52 1.22 2.07 0.12 -1.80 116.25 119.62 1r48 h VAL 28 Ca 0.26 -0.71 0.15 0.00 0.82 0.00 0.00 66.70 67.21 1r48 h VAL 28 Cb 0.10 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1r48 h VAL 28 CO -0.03 0.25 0.47 1.56 0.02 0.00 0.00 177.57 179.83 1r48 h GLN 29 N 0.44 0.00 0.01 1.57 4.20 -0.32 0.80 115.11 121.81 1r48 h GLN 29 Ca 0.12 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.64 1r48 h GLN 29 Cb 0.27 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1r48 h GLN 29 CO -0.00 0.00 -0.89 0.37 -0.67 0.00 0.00 178.83 177.64 1r48 h GLN 30 N 0.00 0.05 -2.04 1.46 5.75 -1.05 -3.37 115.11 115.91 1r48 h GLN 30 Ca 0.25 -0.06 -0.50 0.00 -0.15 0.00 0.00 58.65 58.18 1r48 h GLN 30 Cb 1.18 0.02 -0.40 0.00 1.07 0.00 0.00 27.48 29.35 1r48 h GLN 30 CO -0.00 0.90 -1.11 -2.39 -2.65 0.00 0.00 178.83 173.58 1r48 n HIS 31 N -3.54 0.74 0.11 3.99 1.44 0.24 -4.91 115.22 113.29 1r48 n HIS 31 Ca -0.01 -3.84 -0.02 0.00 -2.01 0.00 0.00 57.72 51.84 1r48 n HIS 31 Cb 0.83 -0.43 0.06 0.00 0.12 0.00 0.00 29.99 30.57 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 3.03 0.00 -0.02 -1.40 0.13 -0.46 -3.46 132.00 129.83 1r48 h PRO 32 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1r48 h PRO 32 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1r48 h PRO 32 CO 0.55 0.71 0.00 0.54 -0.23 0.00 0.00 178.00 179.57