#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 -0.24 4.03 0.00 0.00 -1.26 -4.91 105.19 102.81 1r48 n GLY 2 Ca 0.00 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.65 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 -0.46 0.00 -0.02 0.00 -1.26 -4.82 105.19 98.63 1r48 n GLY 3 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.58 0.00 0.00 1.61 8.00 -1.26 -5.03 116.55 117.29 1r48 n ASP 4 Ca 0.06 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.56 1r48 n ASP 4 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 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 -0.55 0.00 0.08 -2.24 4.05 -1.26 -4.78 115.26 110.57 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 0.03 -0.08 0.00 1.23 0.00 0.00 39.78 40.96 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 0.98 -0.73 -1.44 2.04 -1.97 0.79 117.51 117.18 1r48 h ILE 6 Ca 0.00 -0.54 0.13 0.00 1.00 0.00 0.00 64.86 65.45 1r48 h ILE 6 Cb 0.00 1.32 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 1r48 h ILE 6 CO 0.00 0.13 0.49 -0.08 0.00 0.00 0.00 178.15 178.69 1r48 h GLU 7 N -0.44 0.44 0.05 2.37 4.57 -1.91 0.20 114.58 119.85 1r48 h GLU 7 Ca -0.02 -0.03 -0.23 0.00 -1.18 0.00 0.00 59.36 57.91 1r48 h GLU 7 Cb 0.35 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 1r48 h GLU 7 CO 0.03 0.29 -1.03 0.37 -1.18 0.00 0.00 179.01 177.49 1r48 h GLN 8 N 0.45 0.18 -0.77 1.92 5.75 -1.80 -3.06 115.11 117.78 1r48 h GLN 8 Ca 0.35 -0.26 -0.02 0.00 -0.15 0.00 0.00 58.65 58.58 1r48 h GLN 8 Cb 0.75 0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.35 1r48 h GLN 8 CO -0.12 1.06 0.40 -0.22 -2.65 0.00 0.00 178.83 177.30 1r48 h LYS 9 N 0.07 1.08 -0.21 1.69 3.64 0.12 -2.79 116.57 120.18 1r48 h LYS 9 Ca -0.07 -0.13 -0.12 0.00 -1.27 0.00 0.00 60.65 59.05 1r48 h LYS 9 Cb 1.73 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 33.34 1r48 h LYS 9 CO 0.16 0.81 -0.35 -0.84 -2.27 0.00 0.00 179.45 176.96 1r48 h ILE 10 N 1.09 1.32 -1.00 2.00 3.07 -1.40 -2.99 117.51 119.60 1r48 h ILE 10 Ca 0.27 -1.56 0.26 0.00 1.55 0.00 0.00 64.86 65.38 1r48 h ILE 10 Cb 0.06 1.81 -0.07 0.00 -0.27 0.00 0.00 36.82 38.34 1r48 h ILE 10 CO -0.04 0.48 0.67 -0.78 -1.05 0.00 0.00 178.15 177.43 1r48 h ASP 11 N 0.30 0.33 -0.19 2.16 1.82 -1.39 0.58 116.42 120.03 1r48 h ASP 11 Ca 0.02 0.05 -0.04 0.00 -0.39 0.00 0.00 57.03 56.67 1r48 h ASP 11 Cb 0.94 -0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.94 1r48 h ASP 11 CO 0.08 0.09 -0.03 -0.78 -1.61 0.00 0.00 179.24 176.99 1r48 h ASP 12 N 0.31 0.35 -0.28 2.28 1.82 -1.37 -2.94 116.42 116.58 1r48 h ASP 12 Ca 0.54 -0.35 -0.00 0.00 -0.39 0.00 0.00 57.03 56.83 1r48 h ASP 12 Cb 1.52 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 41.42 1r48 h ASP 12 CO -0.19 0.61 0.17 0.40 -1.61 0.00 0.00 179.24 178.62 1r48 h ILE 13 N 0.08 1.09 -1.13 2.25 2.04 0.04 -1.95 117.51 119.93 1r48 h ILE 13 Ca 0.05 -0.21 0.32 0.00 1.00 0.00 0.00 64.86 66.02 1r48 h ILE 13 Cb 0.45 0.73 -0.07 0.00 -0.74 0.00 0.00 36.82 37.20 1r48 h ILE 13 CO 0.01 0.09 0.78 -0.78 0.00 0.00 0.00 178.15 178.26 1r48 h ASP 14 N 0.36 0.16 0.88 1.72 3.58 -0.24 1.31 116.42 124.19 1r48 h ASP 14 Ca 0.10 0.03 -0.15 0.00 0.42 0.00 0.00 57.03 57.43 1r48 h ASP 14 Cb -0.00 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 1r48 h ASP 14 CO -0.02 0.02 -0.71 -0.74 -2.88 0.00 0.00 179.24 174.91 1r48 h HIS 15 N 0.14 0.00 0.09 0.28 2.76 -1.18 -2.96 115.15 114.27 1r48 h HIS 15 Ca 0.58 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.45 1r48 h HIS 15 Cb 1.99 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.94 1r48 h HIS 15 CO -0.00 0.71 -1.50 0.93 -1.30 0.00 0.00 177.93 176.77 1r48 h GLU 16 N 0.00 0.19 -0.36 5.26 5.08 0.16 -2.99 114.58 121.92 1r48 h GLU 16 Ca -0.01 -0.33 -0.05 0.00 -1.00 0.00 0.00 59.36 57.98 1r48 h GLU 16 Cb 1.34 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.70 1r48 h GLU 16 CO 0.09 1.03 0.03 0.82 -1.00 0.00 0.00 179.01 179.98 1r48 h ILE 17 N 0.05 1.20 0.11 3.13 2.04 0.07 -2.76 117.51 121.35 1r48 h ILE 17 Ca -0.23 -0.76 -0.27 0.00 1.00 0.00 0.00 64.86 64.60 1r48 h ILE 17 Cb 1.99 0.89 0.01 0.00 -0.74 0.00 0.00 36.82 38.97 1r48 h ILE 17 CO 0.15 0.26 -1.20 0.00 0.00 0.00 0.00 178.15 177.36 1r48 h ALA 18 N 1.50 0.11 -0.48 1.87 0.00 -1.62 -3.11 119.26 117.53 1r48 h ALA 18 Ca 0.12 -0.82 0.07 0.00 0.00 0.00 0.00 54.91 54.28 1r48 h ALA 18 Cb 0.31 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 1r48 h ALA 18 CO 0.01 0.85 0.15 0.22 0.00 0.00 0.00 179.25 180.48 1r48 h ASP 19 N 0.16 0.13 0.13 0.00 1.82 -1.33 -1.54 116.42 115.79 1r48 h ASP 19 Ca -0.15 0.06 -0.01 0.00 -0.39 0.00 0.00 57.03 56.55 1r48 h ASP 19 Cb 1.89 0.06 0.00 0.00 0.68 0.00 0.00 39.33 41.96 1r48 h ASP 19 CO 0.21 0.10 -0.06 -0.07 -1.61 0.00 0.00 179.24 177.81 1r48 h LEU 20 N 0.32 -0.15 -1.70 2.28 3.38 -1.61 -2.76 115.31 115.06 1r48 h LEU 20 Ca 0.23 -0.20 0.26 0.00 0.09 0.00 0.00 57.88 58.26 1r48 h LEU 20 Cb 0.26 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 1r48 h LEU 20 CO -0.26 0.11 0.67 -0.61 0.09 0.00 0.00 178.44 178.44 1r48 h GLN 21 N -0.42 0.21 -0.01 1.13 -0.00 -1.41 0.51 115.11 115.11 1r48 h GLN 21 Ca -0.02 -0.01 -0.15 0.00 -0.00 0.00 0.00 58.65 58.47 1r48 h GLN 21 Cb 0.34 -0.05 -0.02 0.00 0.00 0.00 0.00 27.48 27.76 1r48 h GLN 21 CO 0.03 0.14 -0.68 0.00 0.00 0.00 0.00 178.83 178.32 1r48 h ALA 22 N 1.57 0.85 -0.04 3.38 0.00 -1.06 -2.95 119.26 121.01 1r48 h ALA 22 Ca 0.50 -0.61 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1r48 h ALA 22 Cb 1.58 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 1r48 h ALA 22 CO -0.13 0.82 -0.51 0.87 0.00 0.00 0.00 179.25 180.31 1r48 h LYS 23 N 0.04 0.11 -0.03 0.00 1.57 0.27 -2.45 116.57 116.07 1r48 h LYS 23 Ca -0.01 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1r48 h LYS 23 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1r48 h LYS 23 CO 0.09 0.60 -0.14 0.00 -0.57 0.00 0.00 179.45 179.43 1r48 h ARG 24 N 0.09 0.16 0.47 3.15 3.08 -1.34 -2.91 114.38 117.07 1r48 h ARG 24 Ca 0.00 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1r48 h ARG 24 Cb 0.93 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.01 1r48 h ARG 24 CO 0.07 0.77 -0.22 1.15 -1.07 0.00 0.00 179.97 180.67 1r48 h THR 25 N -0.42 0.54 -0.76 2.04 2.02 -1.53 -1.05 112.91 113.74 1r48 h THR 25 Ca -0.01 -0.03 0.16 0.00 0.77 0.00 0.00 66.41 67.30 1r48 h THR 25 Cb 0.79 0.56 -0.11 0.00 -1.74 0.00 0.00 68.15 67.65 1r48 h THR 25 CO 0.03 0.01 0.26 0.08 0.37 0.00 0.00 175.52 176.26 1r48 h ARG 26 N -0.64 0.35 -0.61 6.66 -0.00 -1.56 0.40 114.38 118.97 1r48 h ARG 26 Ca -0.06 -0.02 -0.03 0.00 -0.00 0.00 0.00 59.98 59.86 1r48 h ARG 26 Cb 0.49 -0.08 -0.03 0.00 -0.00 0.00 0.00 29.97 30.35 1r48 h ARG 26 CO 0.11 0.23 0.24 -0.07 -0.00 0.00 0.00 179.97 180.47 1r48 h LEU 27 N 0.36 0.82 -0.51 0.08 3.38 -1.29 -2.36 115.31 115.78 1r48 h LEU 27 Ca 0.43 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.27 1r48 h LEU 27 Cb 0.72 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1r48 h LEU 27 CO -0.47 0.73 0.23 0.58 0.09 0.00 0.00 178.44 179.61 1r48 h VAL 28 N 0.88 1.20 -0.85 1.22 2.07 0.11 -1.51 116.25 119.37 1r48 h VAL 28 Ca 0.21 -0.58 0.22 0.00 0.82 0.00 0.00 66.70 67.36 1r48 h VAL 28 Cb 0.18 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 1r48 h VAL 28 CO -0.02 0.23 0.58 1.56 0.02 0.00 0.00 177.57 179.94 1r48 h GLN 29 N 0.68 0.21 -0.08 1.57 7.50 -0.48 0.84 115.11 125.35 1r48 h GLN 29 Ca 0.17 -0.01 -0.12 0.00 0.50 0.00 0.00 58.65 59.20 1r48 h GLN 29 Cb 0.14 -0.05 -0.01 0.00 0.05 0.00 0.00 27.48 27.61 1r48 h GLN 29 CO -0.02 0.14 -0.48 1.96 -1.50 0.00 0.00 178.83 178.93 1r48 h GLN 30 N 0.22 0.19 -2.15 1.46 4.20 -1.09 -3.36 115.11 114.58 1r48 h GLN 30 Ca 0.43 -0.10 -0.57 0.00 0.06 0.00 0.00 58.65 58.46 1r48 h GLN 30 Cb 1.33 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 28.72 1r48 h GLN 30 CO -0.10 0.63 -1.00 -2.39 -0.67 0.00 0.00 178.83 175.30 1r48 n HIS 31 N -3.97 0.10 0.09 2.96 1.44 0.27 -4.95 115.22 111.17 1r48 n HIS 31 Ca -0.02 -3.60 -0.06 0.00 -2.01 0.00 0.00 57.72 52.04 1r48 n HIS 31 Cb 0.52 -0.25 0.09 0.00 0.12 0.00 0.00 29.99 30.47 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 4.44 0.21 0.00 -1.40 0.13 -1.19 -3.45 132.00 130.75 1r48 h PRO 32 Ca 0.13 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1r48 h PRO 32 Cb 0.86 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1r48 h PRO 32 CO 0.49 0.81 0.00 2.89 -0.23 0.00 0.00 178.00 181.97