#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 -2.02 0.00 0.00 0.00 -1.26 -5.15 105.19 96.76 1r48 n GLY 2 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 46.02 46.99 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 -0.75 0.63 -0.02 0.00 -1.26 -4.87 105.19 98.93 1r48 n GLY 3 Ca 0.00 -0.11 0.07 0.00 0.00 0.00 0.00 46.02 45.98 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 0.00 3.22 -0.01 1.61 8.00 -1.26 -4.63 116.55 123.48 1r48 n ASP 4 Ca 0.00 -2.60 0.22 0.00 0.71 0.00 0.00 54.79 53.12 1r48 n ASP 4 Cb 0.00 -0.38 0.72 0.00 -0.02 0.00 0.00 41.12 41.44 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 1.50 0.00 0.12 -2.24 -0.00 -2.00 0.48 115.58 113.44 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 1.07 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.41 1r48 h ASN 5 CO 0.10 0.00 -0.90 0.40 -0.00 0.00 0.00 177.43 177.03 1r48 h ILE 6 N 0.00 1.41 -0.21 2.57 5.03 -1.95 -3.12 117.51 121.23 1r48 h ILE 6 Ca 0.27 -2.48 0.06 0.00 -0.12 0.00 0.00 64.86 62.59 1r48 h ILE 6 Cb 1.20 3.08 -0.01 0.00 -3.03 0.00 0.00 36.82 38.06 1r48 h ILE 6 CO -0.00 0.69 0.23 -0.08 -0.68 0.00 0.00 178.15 178.31 1r48 h GLU 7 N -0.43 0.00 0.13 2.37 4.81 -1.28 -0.54 114.58 119.64 1r48 h GLU 7 Ca -0.17 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 58.84 1r48 h GLU 7 Cb 1.61 0.00 0.02 0.00 0.63 0.00 0.00 28.75 31.01 1r48 h GLU 7 CO 0.11 0.00 -0.92 0.37 -0.73 0.00 0.00 179.01 177.84 1r48 h GLN 8 N 0.00 0.39 -0.79 1.92 4.15 -1.25 -2.83 115.11 116.72 1r48 h GLN 8 Ca 0.10 -0.60 0.01 0.00 0.77 0.00 0.00 58.65 58.93 1r48 h GLN 8 Cb 0.56 0.21 -0.04 0.00 0.21 0.00 0.00 27.48 28.42 1r48 h GLN 8 CO -0.00 1.26 0.52 -0.22 -1.93 0.00 0.00 178.83 178.46 1r48 h LYS 9 N -0.17 1.04 -0.27 1.69 3.64 -1.08 -2.52 116.57 118.90 1r48 h LYS 9 Ca -0.15 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.06 1r48 h LYS 9 Cb 1.69 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 33.27 1r48 h LYS 9 CO 0.17 0.69 -0.26 -0.84 -2.27 0.00 0.00 179.45 176.94 1r48 h ILE 10 N 1.07 1.31 -1.05 2.00 3.07 -1.34 -2.92 117.51 119.64 1r48 h ILE 10 Ca 0.29 -1.42 0.28 0.00 1.55 0.00 0.00 64.86 65.55 1r48 h ILE 10 Cb -0.12 1.62 -0.08 0.00 -0.27 0.00 0.00 36.82 37.96 1r48 h ILE 10 CO -0.06 0.45 0.70 -0.78 -1.05 0.00 0.00 178.15 177.41 1r48 h ASP 11 N 0.38 0.35 -0.13 2.16 3.58 -1.18 0.60 116.42 122.17 1r48 h ASP 11 Ca 0.04 0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.53 1r48 h ASP 11 Cb 0.82 0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.88 1r48 h ASP 11 CO 0.06 0.07 -0.02 -0.78 -2.88 0.00 0.00 179.24 175.69 1r48 h ASP 12 N 0.31 0.25 -0.40 2.28 1.82 -1.36 -2.95 116.42 116.36 1r48 h ASP 12 Ca 0.58 -0.34 0.00 0.00 -0.39 0.00 0.00 57.03 56.88 1r48 h ASP 12 Cb 1.64 -0.07 -0.02 0.00 0.68 0.00 0.00 39.33 41.57 1r48 h ASP 12 CO -0.23 0.53 0.26 0.40 -1.61 0.00 0.00 179.24 178.59 1r48 h ILE 13 N -0.04 1.11 -1.10 2.25 2.04 0.07 -1.88 117.51 119.95 1r48 h ILE 13 Ca 0.04 -0.21 0.30 0.00 1.00 0.00 0.00 64.86 65.99 1r48 h ILE 13 Cb 0.42 0.54 -0.08 0.00 -0.74 0.00 0.00 36.82 36.96 1r48 h ILE 13 CO 0.01 0.10 0.74 -0.78 0.00 0.00 0.00 178.15 178.23 1r48 h ASP 14 N 0.53 0.26 0.87 1.72 3.58 -0.17 1.32 116.42 124.52 1r48 h ASP 14 Ca 0.14 0.05 -0.13 0.00 0.42 0.00 0.00 57.03 57.51 1r48 h ASP 14 Cb -0.05 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 1r48 h ASP 14 CO -0.03 0.04 -0.63 -0.74 -2.88 0.00 0.00 179.24 175.00 1r48 h HIS 15 N 0.22 0.00 0.08 0.28 2.76 -1.18 -2.92 115.15 114.39 1r48 h HIS 15 Ca 0.59 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.47 1r48 h HIS 15 Cb 1.85 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.79 1r48 h HIS 15 CO -0.00 0.63 -1.50 0.93 -1.30 0.00 0.00 177.93 176.69 1r48 h GLU 16 N 0.00 0.17 -0.19 5.26 4.39 0.16 -2.99 114.58 121.38 1r48 h GLU 16 Ca -0.01 -0.29 -0.05 0.00 0.34 0.00 0.00 59.36 59.35 1r48 h GLU 16 Cb 1.23 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.98 1r48 h GLU 16 CO 0.08 0.99 -0.12 0.82 -1.16 0.00 0.00 179.01 179.62 1r48 h ILE 17 N 0.05 1.19 0.20 3.13 2.04 0.19 -2.82 117.51 121.47 1r48 h ILE 17 Ca -0.22 -0.82 -0.31 0.00 1.00 0.00 0.00 64.86 64.50 1r48 h ILE 17 Cb 1.98 1.18 0.02 0.00 -0.74 0.00 0.00 36.82 39.26 1r48 h ILE 17 CO 0.14 0.26 -1.39 0.00 0.00 0.00 0.00 178.15 177.16 1r48 h ALA 18 N 1.60 -0.03 -0.71 1.87 0.00 -1.61 -3.10 119.26 117.28 1r48 h ALA 18 Ca 0.06 -0.89 0.10 0.00 0.00 0.00 0.00 54.91 54.18 1r48 h ALA 18 Cb 0.39 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 1r48 h ALA 18 CO 0.02 0.84 0.34 0.22 0.00 0.00 0.00 179.25 180.66 1r48 h ASP 19 N 0.11 0.41 0.11 0.00 3.58 -1.34 -0.88 116.42 118.41 1r48 h ASP 19 Ca -0.21 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.31 1r48 h ASP 19 Cb 2.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.14 1r48 h ASP 19 CO 0.24 0.23 -0.05 -0.07 -2.88 0.00 0.00 179.24 176.70 1r48 h LEU 20 N 0.56 -0.13 -1.48 2.28 3.38 -1.62 -2.84 115.31 115.46 1r48 h LEU 20 Ca 0.36 -0.35 0.24 0.00 0.09 0.00 0.00 57.88 58.21 1r48 h LEU 20 Cb 0.41 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.12 1r48 h LEU 20 CO -0.29 0.31 0.64 -0.61 0.09 0.00 0.00 178.44 178.58 1r48 h GLN 21 N -0.59 0.36 -0.09 1.13 4.15 -1.39 0.36 115.11 119.04 1r48 h GLN 21 Ca -0.02 -0.02 -0.14 0.00 0.77 0.00 0.00 58.65 59.24 1r48 h GLN 21 Cb 0.47 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1r48 h GLN 21 CO 0.03 0.24 -0.56 0.00 -1.93 0.00 0.00 178.83 176.60 1r48 h ALA 22 N 1.60 0.87 -0.19 3.38 0.00 -1.11 -2.67 119.26 121.14 1r48 h ALA 22 Ca 0.53 -0.52 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1r48 h ALA 22 Cb 1.38 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1r48 h ALA 22 CO -0.21 0.70 -0.50 0.87 0.00 0.00 0.00 179.25 180.11 1r48 h LYS 23 N 0.21 0.53 -0.33 0.00 6.56 -0.08 -2.52 116.57 120.94 1r48 h LYS 23 Ca 0.00 -0.31 -0.14 0.00 -1.06 0.00 0.00 60.65 59.14 1r48 h LYS 23 Cb 1.06 0.03 -0.00 0.00 -0.57 0.00 0.00 32.23 32.74 1r48 h LYS 23 CO 0.09 0.90 -0.34 -0.09 -2.06 0.00 0.00 179.45 177.95 1r48 h ARG 24 N 0.42 0.81 0.42 3.15 2.43 -1.22 -2.95 114.38 117.42 1r48 h ARG 24 Ca 0.02 -0.43 -0.02 0.00 -0.81 0.00 0.00 59.98 58.74 1r48 h ARG 24 Cb 1.02 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1r48 h ARG 24 CO 0.09 1.06 -0.20 1.15 -1.51 0.00 0.00 179.97 180.57 1r48 h THR 25 N 0.58 0.56 -0.93 0.20 2.02 -1.46 -1.86 112.91 112.01 1r48 h THR 25 Ca 0.05 -0.36 0.22 0.00 0.77 0.00 0.00 66.41 67.09 1r48 h THR 25 Cb 0.92 0.73 -0.12 0.00 -1.74 0.00 0.00 68.15 67.94 1r48 h THR 25 CO 0.08 0.06 0.48 0.08 0.37 0.00 0.00 175.52 176.60 1r48 h ARG 26 N -0.78 0.50 -0.55 6.66 0.11 -1.53 0.56 114.38 119.34 1r48 h ARG 26 Ca -0.06 -0.03 -0.08 0.00 0.10 0.00 0.00 59.98 59.91 1r48 h ARG 26 Cb 0.53 -0.11 -0.02 0.00 1.11 0.00 0.00 29.97 31.48 1r48 h ARG 26 CO 0.09 0.33 0.03 -0.07 0.10 0.00 0.00 179.97 180.45 1r48 h LEU 27 N 0.51 0.89 -0.41 0.08 4.07 -1.40 -2.78 115.31 116.27 1r48 h LEU 27 Ca 0.58 -0.22 -0.01 0.00 0.08 0.00 0.00 57.88 58.31 1r48 h LEU 27 Cb 1.06 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.55 1r48 h LEU 27 CO -0.48 0.93 0.21 0.58 -1.08 0.00 0.00 178.44 178.60 1r48 h VAL 28 N 0.86 1.17 -0.89 1.22 2.07 0.89 -1.59 116.25 119.97 1r48 h VAL 28 Ca 0.16 -0.45 0.21 0.00 0.82 0.00 0.00 66.70 67.45 1r48 h VAL 28 Cb 0.47 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 1r48 h VAL 28 CO 0.02 0.18 0.60 1.56 0.02 0.00 0.00 177.57 179.95 1r48 h GLN 29 N 0.53 0.32 -0.10 1.57 7.50 -0.76 0.88 115.11 125.05 1r48 h GLN 29 Ca 0.14 -0.02 -0.09 0.00 0.50 0.00 0.00 58.65 59.19 1r48 h GLN 29 Cb 0.09 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 27.53 1r48 h GLN 29 CO -0.02 0.21 -0.33 0.37 -1.50 0.00 0.00 178.83 177.56 1r48 h GLN 30 N 0.33 0.21 -2.20 1.46 4.15 -1.11 -3.35 115.11 114.59 1r48 h GLN 30 Ca 0.46 -0.08 -0.58 0.00 0.77 0.00 0.00 58.65 59.22 1r48 h GLN 30 Cb 1.26 -0.01 -0.39 0.00 0.21 0.00 0.00 27.48 28.56 1r48 h GLN 30 CO -0.15 0.52 -1.03 -2.39 -1.93 0.00 0.00 178.83 173.85 1r48 n HIS 31 N -4.10 -0.58 0.26 3.99 1.44 0.29 -4.96 115.22 111.56 1r48 n HIS 31 Ca -0.01 -3.44 0.12 0.00 -2.01 0.00 0.00 57.72 52.37 1r48 n HIS 31 Cb 0.42 -0.04 0.70 0.00 0.12 0.00 0.00 29.99 31.18 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 4.85 0.00 0.00 -1.40 0.13 -1.19 -3.44 132.00 130.95 1r48 h PRO 32 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1r48 h PRO 32 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1r48 h PRO 32 CO 0.42 0.13 0.00 0.54 -0.23 0.00 0.00 178.00 178.86