#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 3.41 0.46 0.00 0.00 -1.26 -4.41 105.19 103.39 1r48 n GLY 2 Ca 0.00 -0.83 0.27 0.00 0.00 0.00 0.00 46.02 45.46 1r48 n GLY 2 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1r48 h GLY 3 N 0.00 0.00 0.00 -0.02 0.00 -1.99 0.16 103.07 101.21 1r48 h GLY 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1r48 h GLY 3 CO 0.00 0.00 -1.15 1.22 0.00 0.00 0.00 176.54 176.61 1r48 n ASP 4 N -3.96 1.97 -0.63 0.19 8.00 -1.26 -4.99 116.55 115.87 1r48 n ASP 4 Ca 0.17 -0.23 -0.05 0.00 0.71 0.00 0.00 54.79 55.38 1r48 n ASP 4 Cb 0.97 1.32 -0.00 0.00 -0.02 0.00 0.00 41.12 43.38 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 -1.66 -2.29 0.13 -2.24 4.05 0.55 -4.78 115.26 109.03 1r48 n ASN 5 Ca -0.01 -0.01 0.00 0.00 0.45 0.00 0.00 54.58 55.01 1r48 n ASN 5 Cb 0.23 -1.62 0.00 0.00 1.23 0.00 0.00 39.78 39.62 1r48 n ASN 5 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1r48 n ILE 6 N -3.96 0.00 0.00 -1.44 5.41 -1.26 -4.80 119.36 113.31 1r48 n ILE 6 Ca -0.06 0.00 0.23 0.00 1.00 0.00 0.00 62.75 63.92 1r48 n ILE 6 Cb 0.55 -0.18 0.72 0.00 -0.71 0.00 0.00 39.64 40.01 1r48 n ILE 6 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 1r48 h GLU 7 N 0.00 0.00 0.17 0.38 4.81 -1.92 0.22 114.58 118.24 1r48 h GLU 7 Ca 0.00 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 58.99 1r48 h GLU 7 Cb 0.00 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.40 1r48 h GLU 7 CO 0.00 0.00 -1.08 0.37 -0.73 0.00 0.00 179.01 177.57 1r48 h GLN 8 N 0.00 0.35 -0.46 1.92 5.75 -1.90 -3.04 115.11 117.74 1r48 h GLN 8 Ca 0.27 -0.60 0.02 0.00 -0.15 0.00 0.00 58.65 58.19 1r48 h GLN 8 Cb 1.38 0.23 -0.02 0.00 1.07 0.00 0.00 27.48 30.13 1r48 h GLN 8 CO -0.00 1.29 0.30 -0.22 -2.65 0.00 0.00 178.83 177.55 1r48 h LYS 9 N -0.23 0.52 -0.12 1.69 3.64 -0.85 -2.42 116.57 118.81 1r48 h LYS 9 Ca -0.20 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.02 1r48 h LYS 9 Cb 1.80 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.50 1r48 h LYS 9 CO 0.17 0.35 -0.43 -0.84 -2.27 0.00 0.00 179.45 176.43 1r48 h ILE 10 N 0.54 1.36 -1.06 2.00 3.07 -1.26 -3.02 117.51 119.14 1r48 h ILE 10 Ca 0.18 -1.73 0.28 0.00 1.55 0.00 0.00 64.86 65.14 1r48 h ILE 10 Cb 0.06 2.11 -0.08 0.00 -0.27 0.00 0.00 36.82 38.64 1r48 h ILE 10 CO -0.04 0.52 0.70 0.44 -1.05 0.00 0.00 178.15 178.72 1r48 h ASP 11 N 0.12 0.33 -0.15 2.16 5.19 -1.31 0.60 116.42 123.35 1r48 h ASP 11 Ca -0.02 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.42 1r48 h ASP 11 Cb 1.05 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.57 1r48 h ASP 11 CO 0.09 0.06 -0.06 -0.78 -3.12 0.00 0.00 179.24 175.43 1r48 h ASP 12 N 0.29 0.31 -0.19 6.45 3.58 -1.44 -3.02 116.42 122.40 1r48 h ASP 12 Ca 0.58 -0.39 -0.00 0.00 0.42 0.00 0.00 57.03 57.64 1r48 h ASP 12 Cb 1.68 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 42.63 1r48 h ASP 12 CO -0.23 0.64 0.11 0.40 -2.88 0.00 0.00 179.24 177.28 1r48 h ILE 13 N -0.01 1.09 -1.13 2.25 2.04 0.08 -2.34 117.51 119.50 1r48 h ILE 13 Ca 0.04 -0.24 0.31 0.00 1.00 0.00 0.00 64.86 65.97 1r48 h ILE 13 Cb 0.51 0.90 -0.09 0.00 -0.74 0.00 0.00 36.82 37.40 1r48 h ILE 13 CO 0.02 0.09 0.74 -0.78 0.00 0.00 0.00 178.15 178.22 1r48 h ASP 14 N 0.22 0.32 0.83 1.72 3.58 -0.28 1.32 116.42 124.12 1r48 h ASP 14 Ca 0.07 0.08 -0.14 0.00 0.42 0.00 0.00 57.03 57.46 1r48 h ASP 14 Cb 0.04 0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 1r48 h ASP 14 CO -0.01 0.02 -0.65 -0.74 -2.88 0.00 0.00 179.24 174.98 1r48 h HIS 15 N 0.26 0.00 0.06 0.28 2.76 -1.30 -2.96 115.15 114.25 1r48 h HIS 15 Ca 0.63 0.00 -0.28 0.00 -2.20 0.00 0.00 60.37 58.52 1r48 h HIS 15 Cb 1.87 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.81 1r48 h HIS 15 CO -0.00 0.65 -1.44 0.93 -1.30 0.00 0.00 177.93 176.76 1r48 h GLU 16 N 0.00 0.13 -0.23 5.26 4.39 0.16 -3.05 114.58 121.24 1r48 h GLU 16 Ca -0.01 -0.23 -0.05 0.00 0.34 0.00 0.00 59.36 59.41 1r48 h GLU 16 Cb 1.24 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.96 1r48 h GLU 16 CO 0.08 0.95 -0.10 0.82 -1.16 0.00 0.00 179.01 179.61 1r48 h ILE 17 N 0.04 1.19 0.17 3.13 2.04 0.36 -2.89 117.51 121.54 1r48 h ILE 17 Ca -0.20 -0.83 -0.31 0.00 1.00 0.00 0.00 64.86 64.52 1r48 h ILE 17 Cb 1.95 1.13 0.03 0.00 -0.74 0.00 0.00 36.82 39.20 1r48 h ILE 17 CO 0.13 0.27 -1.33 0.00 0.00 0.00 0.00 178.15 177.22 1r48 h ALA 18 N 1.56 -0.06 -0.72 1.87 0.00 -1.61 -3.09 119.26 117.21 1r48 h ALA 18 Ca 0.07 -0.80 0.11 0.00 0.00 0.00 0.00 54.91 54.28 1r48 h ALA 18 Cb 0.39 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.23 1r48 h ALA 18 CO 0.02 0.70 0.34 0.22 0.00 0.00 0.00 179.25 180.53 1r48 h ASP 19 N 0.23 0.42 0.22 0.00 3.58 -1.40 -1.42 116.42 118.05 1r48 h ASP 19 Ca -0.21 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.30 1r48 h ASP 19 Cb 2.01 0.01 0.00 0.00 1.72 0.00 0.00 39.33 43.07 1r48 h ASP 19 CO 0.25 0.22 -0.11 -0.07 -2.88 0.00 0.00 179.24 176.66 1r48 h LEU 20 N 0.56 -0.25 -1.90 2.28 3.38 -1.62 -2.86 115.31 114.91 1r48 h LEU 20 Ca 0.37 -0.24 0.26 0.00 0.09 0.00 0.00 57.88 58.36 1r48 h LEU 20 Cb 0.44 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1r48 h LEU 20 CO -0.30 0.13 0.66 -0.61 0.09 0.00 0.00 178.44 178.41 1r48 h GLN 21 N -0.68 0.07 -0.04 1.13 4.15 -1.39 0.35 115.11 118.70 1r48 h GLN 21 Ca -0.03 -0.00 -0.18 0.00 0.77 0.00 0.00 58.65 59.21 1r48 h GLN 21 Cb 0.48 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 1r48 h GLN 21 CO 0.05 0.05 -0.76 0.00 -1.93 0.00 0.00 178.83 176.24 1r48 h ALA 22 N 1.55 0.63 -0.08 3.38 0.00 -1.16 -2.82 119.26 120.76 1r48 h ALA 22 Ca 0.46 -0.64 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 1r48 h ALA 22 Cb 1.69 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 1r48 h ALA 22 CO -0.05 0.81 -0.58 0.87 0.00 0.00 0.00 179.25 180.31 1r48 h LYS 23 N 0.18 0.25 -0.15 0.00 1.57 -0.11 -2.69 116.57 115.62 1r48 h LYS 23 Ca -0.03 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.46 1r48 h LYS 23 Cb 1.33 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.67 1r48 h LYS 23 CO 0.12 0.76 -0.41 -0.09 -0.57 0.00 0.00 179.45 179.26 1r48 h ARG 24 N 0.19 0.54 0.33 3.15 2.43 -1.35 -3.02 114.38 116.65 1r48 h ARG 24 Ca -0.00 -0.38 -0.02 0.00 -0.81 0.00 0.00 59.98 58.77 1r48 h ARG 24 Cb 1.07 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1r48 h ARG 24 CO 0.09 1.00 -0.16 1.15 -1.51 0.00 0.00 179.97 180.54 1r48 h THR 25 N 0.17 0.69 -0.83 0.20 2.02 -1.51 -1.68 112.91 111.97 1r48 h THR 25 Ca -0.01 -0.22 0.18 0.00 0.77 0.00 0.00 66.41 67.12 1r48 h THR 25 Cb 1.03 0.81 -0.11 0.00 -1.74 0.00 0.00 68.15 68.14 1r48 h THR 25 CO 0.09 0.05 0.34 0.08 0.37 0.00 0.00 175.52 176.44 1r48 h ARG 26 N -0.57 0.41 -0.48 6.66 0.11 -1.58 0.44 114.38 119.38 1r48 h ARG 26 Ca -0.05 -0.02 -0.06 0.00 0.10 0.00 0.00 59.98 59.95 1r48 h ARG 26 Cb 0.42 -0.09 -0.02 0.00 1.11 0.00 0.00 29.97 31.38 1r48 h ARG 26 CO 0.07 0.27 0.06 -0.07 0.10 0.00 0.00 179.97 180.40 1r48 h LEU 27 N 0.43 0.71 -0.43 0.08 4.07 -1.38 -2.64 115.31 116.15 1r48 h LEU 27 Ca 0.48 -0.15 -0.03 0.00 0.08 0.00 0.00 57.88 58.27 1r48 h LEU 27 Cb 0.82 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.36 1r48 h LEU 27 CO -0.47 0.75 0.17 0.58 -1.08 0.00 0.00 178.44 178.39 1r48 h VAL 28 N 0.72 1.20 -0.84 1.22 2.07 0.75 -1.83 116.25 119.53 1r48 h VAL 28 Ca 0.15 -0.63 0.20 0.00 0.82 0.00 0.00 66.70 67.24 1r48 h VAL 28 Cb 0.36 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 30.88 1r48 h VAL 28 CO 0.01 0.23 0.57 -0.61 0.02 0.00 0.00 177.57 177.79 1r48 h GLN 29 N 0.56 0.30 -0.03 1.57 4.15 -0.68 0.80 115.11 121.77 1r48 h GLN 29 Ca 0.14 -0.02 -0.10 0.00 0.77 0.00 0.00 58.65 59.44 1r48 h GLN 29 Cb 0.20 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.81 1r48 h GLN 29 CO -0.01 0.20 -0.46 0.37 -1.93 0.00 0.00 178.83 176.99 1r48 h GLN 30 N 0.31 0.08 -2.03 1.69 4.15 -1.15 -3.38 115.11 114.77 1r48 h GLN 30 Ca 0.43 -0.04 -0.47 0.00 0.77 0.00 0.00 58.65 59.34 1r48 h GLN 30 Cb 1.19 0.00 -0.32 0.00 0.21 0.00 0.00 27.48 28.56 1r48 h GLN 30 CO -0.12 0.53 -0.83 -3.38 -1.93 0.00 0.00 178.83 173.09 1r48 s HIS 31 N -4.00 0.30 -1.02 3.99 -3.43 0.26 -5.04 115.29 106.35 1r48 s HIS 31 Ca -0.03 -1.70 -0.09 0.00 -0.80 0.00 0.00 55.06 52.44 1r48 s HIS 31 Cb 0.14 -0.58 -0.07 0.00 -1.43 0.00 0.00 32.58 30.64 1r48 s HIS 31 CO 0.75 -0.94 2.20 -0.35 -2.00 0.00 0.00 174.74 174.40 1r48 n PRO 32 N 3.14 2.25 0.00 -0.38 -0.04 -0.20 -4.72 135.00 135.04 1r48 n PRO 32 Ca 0.24 -1.67 0.00 0.00 -0.04 0.00 0.00 63.50 62.03 1r48 n PRO 32 Cb 0.48 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.34 1r48 n PRO 32 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00