#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 2.73 0.00 0.00 0.00 -1.26 -5.00 105.19 101.66 1r48 n GLY 2 Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 -1.70 -0.21 1.18 -0.02 0.00 -1.26 -4.79 105.19 98.39 1r48 n GLY 3 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.62 3.43 0.05 1.61 9.92 -1.26 -4.32 116.55 125.36 1r48 n ASP 4 Ca 0.00 -2.31 0.21 0.00 -0.53 0.00 0.00 54.79 52.16 1r48 n ASP 4 Cb 0.00 -0.48 0.74 0.00 -0.64 0.00 0.00 41.12 40.74 1r48 n ASP 4 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 1r48 h ASN 5 N 2.82 0.00 0.12 -2.24 -0.00 -1.94 0.74 115.58 115.07 1r48 h ASN 5 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 56.30 56.11 1r48 h ASN 5 Cb 1.08 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.41 1r48 h ASN 5 CO 0.16 0.00 -0.86 0.40 -0.00 0.00 0.00 177.43 177.14 1r48 h ILE 6 N 0.00 1.44 -0.27 2.57 2.04 -1.95 -2.83 117.51 118.51 1r48 h ILE 6 Ca 0.23 -2.49 0.08 0.00 1.00 0.00 0.00 64.86 63.68 1r48 h ILE 6 Cb 1.08 3.11 -0.01 0.00 -0.74 0.00 0.00 36.82 40.25 1r48 h ILE 6 CO -0.00 0.69 0.20 -0.08 0.00 0.00 0.00 178.15 178.96 1r48 h GLU 7 N -0.44 0.00 0.24 2.37 4.22 -1.22 -0.36 114.58 119.39 1r48 h GLU 7 Ca -0.16 0.00 -0.32 0.00 0.08 0.00 0.00 59.36 58.96 1r48 h GLU 7 Cb 1.59 0.00 0.04 0.00 0.50 0.00 0.00 28.75 30.88 1r48 h GLU 7 CO 0.11 0.00 -1.40 0.37 -2.18 0.00 0.00 179.01 175.91 1r48 h GLN 8 N 0.00 0.53 -0.59 1.92 5.75 -1.19 -2.94 115.11 118.59 1r48 h GLN 8 Ca 0.13 -0.89 -0.01 0.00 -0.15 0.00 0.00 58.65 57.73 1r48 h GLN 8 Cb 0.53 0.33 -0.03 0.00 1.07 0.00 0.00 27.48 29.38 1r48 h GLN 8 CO -0.00 1.42 0.32 0.87 -2.65 0.00 0.00 178.83 178.80 1r48 h LYS 9 N 0.11 0.81 -0.21 1.69 1.57 -0.94 -2.62 116.57 116.97 1r48 h LYS 9 Ca -0.24 -0.08 -0.13 0.00 -1.87 0.00 0.00 60.65 58.33 1r48 h LYS 9 Cb 2.10 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 34.25 1r48 h LYS 9 CO 0.26 0.60 -0.36 -0.84 -0.57 0.00 0.00 179.45 178.54 1r48 h ILE 10 N 0.82 1.33 -1.03 1.86 3.07 -1.19 -2.97 117.51 119.40 1r48 h ILE 10 Ca 0.21 -1.58 0.27 0.00 1.55 0.00 0.00 64.86 65.31 1r48 h ILE 10 Cb 0.02 1.83 -0.08 0.00 -0.27 0.00 0.00 36.82 38.33 1r48 h ILE 10 CO -0.03 0.49 0.69 0.44 -1.05 0.00 0.00 178.15 178.69 1r48 h ASP 11 N 0.29 0.31 -0.21 2.16 3.32 -1.28 0.66 116.42 121.68 1r48 h ASP 11 Ca 0.01 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 1r48 h ASP 11 Cb 0.95 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 1r48 h ASP 11 CO 0.08 0.07 -0.07 0.44 -1.72 0.00 0.00 179.24 178.04 1r48 h ASP 12 N 0.28 0.43 -0.21 6.45 3.32 -1.37 -2.94 116.42 122.39 1r48 h ASP 12 Ca 0.55 -0.39 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 1r48 h ASP 12 Cb 1.62 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 41.05 1r48 h ASP 12 CO -0.20 0.72 0.11 0.40 -1.72 0.00 0.00 179.24 178.56 1r48 h ILE 13 N 0.14 1.11 -1.09 0.35 2.04 0.23 -2.18 117.51 118.12 1r48 h ILE 13 Ca 0.05 -0.31 0.30 0.00 1.00 0.00 0.00 64.86 65.91 1r48 h ILE 13 Cb 0.54 0.94 -0.06 0.00 -0.74 0.00 0.00 36.82 37.50 1r48 h ILE 13 CO 0.03 0.11 0.75 -0.78 0.00 0.00 0.00 178.15 178.26 1r48 h ASP 14 N 0.22 0.17 0.92 1.72 3.58 -0.26 1.23 116.42 124.00 1r48 h ASP 14 Ca 0.07 0.03 -0.14 0.00 0.42 0.00 0.00 57.03 57.41 1r48 h ASP 14 Cb 0.07 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 1r48 h ASP 14 CO -0.01 0.03 -0.68 -0.74 -2.88 0.00 0.00 179.24 174.96 1r48 h HIS 15 N 0.15 0.00 0.08 0.28 2.76 -1.22 -2.95 115.15 114.25 1r48 h HIS 15 Ca 0.55 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.44 1r48 h HIS 15 Cb 1.90 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.84 1r48 h HIS 15 CO -0.00 0.68 -1.45 0.93 -1.30 0.00 0.00 177.93 176.79 1r48 h GLU 16 N 0.00 0.17 -0.36 5.26 4.39 0.15 -2.97 114.58 121.23 1r48 h GLU 16 Ca -0.01 -0.30 -0.05 0.00 0.34 0.00 0.00 59.36 59.34 1r48 h GLU 16 Cb 1.32 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 30.06 1r48 h GLU 16 CO 0.09 1.02 -0.01 0.82 -1.16 0.00 0.00 179.01 179.77 1r48 h ILE 17 N 0.05 1.21 0.10 3.13 2.04 -0.04 -2.81 117.51 121.19 1r48 h ILE 17 Ca -0.20 -0.84 -0.27 0.00 1.00 0.00 0.00 64.86 64.55 1r48 h ILE 17 Cb 1.97 0.95 0.01 0.00 -0.74 0.00 0.00 36.82 39.01 1r48 h ILE 17 CO 0.15 0.29 -1.18 0.00 0.00 0.00 0.00 178.15 177.41 1r48 h ALA 18 N 1.46 0.15 -0.34 1.87 0.00 -1.61 -3.12 119.26 117.66 1r48 h ALA 18 Ca 0.11 -0.82 0.06 0.00 0.00 0.00 0.00 54.91 54.25 1r48 h ALA 18 Cb 0.36 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 1r48 h ALA 18 CO 0.01 0.89 0.02 0.22 0.00 0.00 0.00 179.25 180.39 1r48 h ASP 19 N 0.14 -0.09 0.26 0.00 1.82 -1.33 -1.91 116.42 115.31 1r48 h ASP 19 Ca -0.13 0.07 -0.01 0.00 -0.39 0.00 0.00 57.03 56.57 1r48 h ASP 19 Cb 1.87 0.12 0.00 0.00 0.68 0.00 0.00 39.33 42.00 1r48 h ASP 19 CO 0.20 -0.01 -0.13 -0.07 -1.61 0.00 0.00 179.24 177.62 1r48 h LEU 20 N 0.12 -0.30 -1.99 2.28 3.38 -1.62 -2.56 115.31 114.63 1r48 h LEU 20 Ca 0.16 -0.09 0.33 0.00 0.09 0.00 0.00 57.88 58.38 1r48 h LEU 20 Cb 0.21 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 1r48 h LEU 20 CO -0.26 -0.09 0.83 -0.61 0.09 0.00 0.00 178.44 178.40 1r48 h GLN 21 N -0.49 0.01 -0.05 1.13 4.15 -1.43 0.72 115.11 119.16 1r48 h GLN 21 Ca -0.04 -0.00 -0.18 0.00 0.77 0.00 0.00 58.65 59.20 1r48 h GLN 21 Cb 0.37 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 1r48 h GLN 21 CO 0.06 0.01 -0.76 0.00 -1.93 0.00 0.00 178.83 176.21 1r48 h ALA 22 N 1.43 0.61 -0.07 3.38 0.00 -0.95 -3.04 119.26 120.63 1r48 h ALA 22 Ca 0.55 -0.63 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1r48 h ALA 22 Cb 2.19 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.90 1r48 h ALA 22 CO -0.01 0.80 -0.36 0.87 0.00 0.00 0.00 179.25 180.54 1r48 h LYS 23 N 0.21 0.13 -0.19 0.00 1.79 0.67 -2.43 116.57 116.76 1r48 h LYS 23 Ca -0.03 -0.05 -0.15 0.00 -2.18 0.00 0.00 60.65 58.23 1r48 h LYS 23 Cb 1.34 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 1r48 h LYS 23 CO 0.12 0.48 -0.47 0.00 -1.08 0.00 0.00 179.45 178.51 1r48 h ARG 24 N 0.12 0.65 0.55 3.15 3.08 -1.39 -2.96 114.38 117.58 1r48 h ARG 24 Ca 0.01 -0.45 -0.03 0.00 0.07 0.00 0.00 59.98 59.59 1r48 h ARG 24 Cb 0.70 0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.82 1r48 h ARG 24 CO 0.05 1.07 -0.27 1.15 -1.07 0.00 0.00 179.97 180.90 1r48 h THR 25 N 0.34 0.33 -1.01 2.04 2.02 -1.43 -1.71 112.91 113.48 1r48 h THR 25 Ca -0.01 -0.34 0.24 0.00 0.77 0.00 0.00 66.41 67.07 1r48 h THR 25 Cb 1.08 0.44 -0.11 0.00 -1.74 0.00 0.00 68.15 67.82 1r48 h THR 25 CO 0.10 0.04 0.62 0.08 0.37 0.00 0.00 175.52 176.73 1r48 h ARG 26 N -0.99 0.55 -0.48 6.66 -0.00 -1.56 0.58 114.38 119.14 1r48 h ARG 26 Ca -0.08 -0.03 -0.11 0.00 -0.00 0.00 0.00 59.98 59.76 1r48 h ARG 26 Cb 0.64 -0.12 -0.02 0.00 -0.00 0.00 0.00 29.97 30.47 1r48 h ARG 26 CO 0.12 0.36 -0.14 -0.07 -0.00 0.00 0.00 179.97 180.25 1r48 h LEU 27 N 0.56 0.91 -0.42 0.08 4.07 -1.42 -2.91 115.31 116.19 1r48 h LEU 27 Ca 0.62 -0.30 0.00 0.00 0.08 0.00 0.00 57.88 58.28 1r48 h LEU 27 Cb 1.24 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 42.71 1r48 h LEU 27 CO -0.42 1.05 0.27 0.58 -1.08 0.00 0.00 178.44 178.85 1r48 h VAL 28 N 0.81 1.11 -0.89 1.22 2.07 0.11 -1.02 116.25 119.66 1r48 h VAL 28 Ca 0.12 -0.21 0.20 0.00 0.82 0.00 0.00 66.70 67.63 1r48 h VAL 28 Cb 0.67 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 1r48 h VAL 28 CO 0.05 0.11 0.59 1.56 0.02 0.00 0.00 177.57 179.89 1r48 h GLN 29 N 0.57 0.40 -0.04 1.57 4.20 -0.96 0.84 115.11 121.69 1r48 h GLN 29 Ca 0.15 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.77 1r48 h GLN 29 Cb -0.06 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 1r48 h GLN 29 CO -0.03 0.27 -0.28 0.37 -0.67 0.00 0.00 178.83 178.48 1r48 h GLN 30 N 0.41 0.07 -2.43 1.46 5.75 -1.03 -3.37 115.11 115.98 1r48 h GLN 30 Ca 0.46 -0.02 -0.54 0.00 -0.15 0.00 0.00 58.65 58.39 1r48 h GLN 30 Cb 1.13 -0.01 -0.37 0.00 1.07 0.00 0.00 27.48 29.30 1r48 h GLN 30 CO -0.17 0.35 -0.84 -3.38 -2.65 0.00 0.00 178.83 172.13 1r48 s HIS 31 N -4.41 0.58 -1.25 3.99 -3.43 0.29 -5.03 115.29 106.03 1r48 s HIS 31 Ca -0.04 -1.60 -0.08 0.00 -0.80 0.00 0.00 55.06 52.54 1r48 s HIS 31 Cb 0.15 -0.81 -0.09 0.00 -1.43 0.00 0.00 32.58 30.40 1r48 s HIS 31 CO 0.72 -0.86 2.69 -0.35 -2.00 0.00 0.00 174.74 174.95 1r48 n PRO 32 N 3.87 2.99 0.00 -0.38 -0.04 -0.88 -4.73 135.00 135.82 1r48 n PRO 32 Ca 0.15 -1.83 0.00 0.00 -0.04 0.00 0.00 63.50 61.78 1r48 n PRO 32 Cb 0.40 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.26 1r48 n PRO 32 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00