#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 -2.23 3.45 0.00 0.00 -1.26 -4.62 105.19 100.53 1r48 n GLY 2 Ca 0.00 -0.45 -0.24 0.00 0.00 0.00 0.00 46.02 45.33 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 1.02 -0.48 0.00 -0.02 0.00 -1.26 -4.80 105.19 99.66 1r48 n GLY 3 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1r48 n GLY 3 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1r48 n ASP 4 N -2.25 0.00 0.00 1.61 -0.08 -1.26 -5.05 116.55 109.52 1r48 n ASP 4 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1r48 n ASP 4 Cb 0.53 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.99 1r48 n ASP 4 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1r48 n ASN 5 N -0.61 0.00 0.05 1.67 4.05 -1.26 -4.83 115.26 114.32 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 0.07 -0.08 0.00 1.23 0.00 0.00 39.78 41.00 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 1.09 -0.86 -1.44 2.04 -1.98 -1.70 117.51 114.66 1r48 h ILE 6 Ca 0.00 -0.54 0.20 0.00 1.00 0.00 0.00 64.86 65.52 1r48 h ILE 6 Cb 0.00 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 37.47 1r48 h ILE 6 CO 0.00 0.14 0.58 -0.08 0.00 0.00 0.00 178.15 178.79 1r48 h GLU 7 N -0.33 0.31 -0.00 2.37 4.22 -1.90 0.17 114.58 119.42 1r48 h GLU 7 Ca -0.01 -0.02 -0.22 0.00 0.08 0.00 0.00 59.36 59.19 1r48 h GLU 7 Cb 0.29 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1r48 h GLU 7 CO 0.01 0.21 -0.93 0.37 -2.18 0.00 0.00 179.01 176.49 1r48 h GLN 8 N 0.32 0.41 -0.84 1.92 5.75 -1.81 -2.73 115.11 118.14 1r48 h GLN 8 Ca 0.44 -0.44 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1r48 h GLN 8 Cb 1.21 0.12 -0.04 0.00 1.07 0.00 0.00 27.48 29.84 1r48 h GLN 8 CO -0.14 1.10 0.49 0.87 -2.65 0.00 0.00 178.83 178.50 1r48 h LYS 9 N 0.23 1.15 -0.26 1.69 1.57 0.25 -2.79 116.57 118.42 1r48 h LYS 9 Ca -0.08 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 58.46 1r48 h LYS 9 Cb 1.56 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 33.64 1r48 h LYS 9 CO 0.16 0.82 -0.32 -0.84 -0.57 0.00 0.00 179.45 178.70 1r48 h ILE 10 N 1.16 1.31 -1.06 1.86 3.07 -1.36 -2.94 117.51 119.55 1r48 h ILE 10 Ca 0.30 -1.51 0.28 0.00 1.55 0.00 0.00 64.86 65.48 1r48 h ILE 10 Cb -0.02 1.68 -0.08 0.00 -0.27 0.00 0.00 36.82 38.14 1r48 h ILE 10 CO -0.05 0.48 0.71 0.44 -1.05 0.00 0.00 178.15 178.67 1r48 h ASP 11 N 0.39 0.30 -0.11 2.16 5.19 -1.22 0.58 116.42 123.72 1r48 h ASP 11 Ca 0.03 0.06 -0.03 0.00 -0.62 0.00 0.00 57.03 56.47 1r48 h ASP 11 Cb 0.90 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.42 1r48 h ASP 11 CO 0.08 0.06 -0.04 0.44 -3.12 0.00 0.00 179.24 176.66 1r48 h ASP 12 N 0.27 0.21 -0.22 6.45 3.32 -1.34 -2.94 116.42 122.17 1r48 h ASP 12 Ca 0.57 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 57.25 1r48 h ASP 12 Cb 1.70 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 41.18 1r48 h ASP 12 CO -0.20 0.55 0.12 0.40 -1.72 0.00 0.00 179.24 178.38 1r48 h ILE 13 N -0.13 1.01 -1.09 0.35 2.04 0.03 -1.70 117.51 118.03 1r48 h ILE 13 Ca 0.03 -0.08 0.30 0.00 1.00 0.00 0.00 64.86 66.10 1r48 h ILE 13 Cb 0.46 0.74 -0.06 0.00 -0.74 0.00 0.00 36.82 37.22 1r48 h ILE 13 CO 0.01 0.04 0.75 -0.78 0.00 0.00 0.00 178.15 178.18 1r48 h ASP 14 N 0.24 0.17 0.87 1.72 3.58 -0.31 1.30 116.42 123.99 1r48 h ASP 14 Ca 0.09 0.03 -0.13 0.00 0.42 0.00 0.00 57.03 57.44 1r48 h ASP 14 Cb 0.01 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.05 1r48 h ASP 14 CO -0.05 0.03 -0.62 -0.74 -2.88 0.00 0.00 179.24 174.98 1r48 h HIS 15 N 0.15 0.00 0.12 0.28 2.76 -1.13 -2.93 115.15 114.40 1r48 h HIS 15 Ca 0.55 0.00 -0.32 0.00 -2.20 0.00 0.00 60.37 58.41 1r48 h HIS 15 Cb 1.90 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.85 1r48 h HIS 15 CO -0.00 0.62 -1.62 0.93 -1.30 0.00 0.00 177.93 176.56 1r48 h GLU 16 N 0.00 0.25 -0.19 5.26 5.08 0.16 -2.99 114.58 122.16 1r48 h GLU 16 Ca -0.01 -0.42 -0.04 0.00 -1.00 0.00 0.00 59.36 57.90 1r48 h GLU 16 Cb 1.22 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 1r48 h GLU 16 CO 0.08 1.10 -0.04 0.82 -1.00 0.00 0.00 179.01 179.96 1r48 h ILE 17 N 0.07 1.15 0.20 3.13 2.04 0.00 -2.73 117.51 121.37 1r48 h ILE 17 Ca -0.28 -0.60 -0.32 0.00 1.00 0.00 0.00 64.86 64.66 1r48 h ILE 17 Cb 2.03 1.06 0.02 0.00 -0.74 0.00 0.00 36.82 39.19 1r48 h ILE 17 CO 0.15 0.19 -1.47 0.00 0.00 0.00 0.00 178.15 177.02 1r48 h ALA 18 N 1.69 -0.02 -0.76 1.87 0.00 -1.62 -3.10 119.26 117.32 1r48 h ALA 18 Ca 0.06 -0.93 0.11 0.00 0.00 0.00 0.00 54.91 54.15 1r48 h ALA 18 Cb 0.26 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.16 1r48 h ALA 18 CO 0.01 0.85 0.38 -0.44 0.00 0.00 0.00 179.25 180.05 1r48 h ASP 19 N 0.12 0.47 0.07 0.00 3.32 -1.33 -0.39 116.42 118.68 1r48 h ASP 19 Ca -0.24 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 1r48 h ASP 19 Cb 2.10 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.65 1r48 h ASP 19 CO 0.24 0.24 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.89 1r48 h LEU 20 N 0.60 -0.08 -1.37 1.55 3.38 -1.62 -2.80 115.31 114.97 1r48 h LEU 20 Ca 0.39 -0.41 0.21 0.00 0.09 0.00 0.00 57.88 58.16 1r48 h LEU 20 Cb 0.48 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.17 1r48 h LEU 20 CO -0.31 0.38 0.61 -0.61 0.09 0.00 0.00 178.44 178.61 1r48 h GLN 21 N -0.57 0.48 -0.06 1.13 4.15 -1.37 0.34 115.11 119.21 1r48 h GLN 21 Ca -0.01 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.26 1r48 h GLN 21 Cb 0.48 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 1r48 h GLN 21 CO 0.02 0.32 -0.50 0.00 -1.93 0.00 0.00 178.83 176.73 1r48 h ALA 22 N 1.61 1.04 -0.28 3.38 0.00 -1.03 -2.88 119.26 121.10 1r48 h ALA 22 Ca 0.51 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1r48 h ALA 22 Cb 1.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1r48 h ALA 22 CO -0.24 0.65 -0.26 0.87 0.00 0.00 0.00 179.25 180.28 1r48 h LYS 23 N 0.13 0.54 -0.17 0.00 6.56 -0.08 -1.90 116.57 121.65 1r48 h LYS 23 Ca 0.00 -0.21 -0.06 0.00 -1.06 0.00 0.00 60.65 59.32 1r48 h LYS 23 Cb 0.94 -0.03 -0.00 0.00 -0.57 0.00 0.00 32.23 32.57 1r48 h LYS 23 CO 0.07 0.76 -0.13 0.00 -2.06 0.00 0.00 179.45 178.09 1r48 h ARG 24 N 0.48 0.40 0.56 3.15 3.08 -1.26 -2.57 114.38 118.21 1r48 h ARG 24 Ca 0.07 -0.19 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 1r48 h ARG 24 Cb 0.70 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.76 1r48 h ARG 24 CO 0.05 0.74 -0.27 1.15 -1.07 0.00 0.00 179.97 180.57 1r48 h THR 25 N 0.05 0.38 -0.84 2.04 2.02 -1.46 -1.46 112.91 113.65 1r48 h THR 25 Ca 0.03 -0.24 0.19 0.00 0.77 0.00 0.00 66.41 67.15 1r48 h THR 25 Cb 0.65 0.47 -0.11 0.00 -1.74 0.00 0.00 68.15 67.42 1r48 h THR 25 CO 0.04 0.03 0.35 0.08 0.37 0.00 0.00 175.52 176.39 1r48 h ARG 26 N -0.92 0.41 -0.72 6.66 -0.00 -1.44 0.51 114.38 118.87 1r48 h ARG 26 Ca -0.08 -0.02 -0.03 0.00 -0.00 0.00 0.00 59.98 59.85 1r48 h ARG 26 Cb 0.63 -0.09 -0.03 0.00 -0.00 0.00 0.00 29.97 30.48 1r48 h ARG 26 CO 0.13 0.27 0.34 -0.07 -0.00 0.00 0.00 179.97 180.64 1r48 h LEU 27 N 0.42 0.94 -0.34 0.08 4.07 -1.33 -2.49 115.31 116.66 1r48 h LEU 27 Ca 0.50 -0.11 0.00 0.00 0.08 0.00 0.00 57.88 58.35 1r48 h LEU 27 Cb 0.86 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.35 1r48 h LEU 27 CO -0.48 0.80 0.22 0.58 -1.08 0.00 0.00 178.44 178.48 1r48 h VAL 28 N 1.03 1.09 -0.83 1.22 2.07 0.11 -0.79 116.25 120.15 1r48 h VAL 28 Ca 0.25 -0.16 0.22 0.00 0.82 0.00 0.00 66.70 67.83 1r48 h VAL 28 Cb 0.11 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 1r48 h VAL 28 CO -0.03 0.08 0.58 1.56 0.02 0.00 0.00 177.57 179.79 1r48 h GLN 29 N 0.46 0.11 -0.02 1.57 7.50 -0.75 0.90 115.11 124.88 1r48 h GLN 29 Ca 0.12 -0.01 -0.12 0.00 0.50 0.00 0.00 58.65 59.15 1r48 h GLN 29 Cb -0.05 -0.03 -0.02 0.00 0.05 0.00 0.00 27.48 27.44 1r48 h GLN 29 CO -0.03 0.07 -0.53 0.37 -1.50 0.00 0.00 178.83 177.22 1r48 h GLN 30 N 0.11 0.05 -2.09 1.46 4.15 -0.95 -3.35 115.11 114.49 1r48 h GLN 30 Ca 0.41 -0.03 -0.57 0.00 0.77 0.00 0.00 58.65 59.22 1r48 h GLN 30 Cb 1.43 0.00 -0.39 0.00 0.21 0.00 0.00 27.48 28.73 1r48 h GLN 30 CO -0.05 0.57 -1.02 -2.39 -1.93 0.00 0.00 178.83 174.00 1r48 n HIS 31 N -3.91 0.06 -1.72 3.99 1.44 0.30 -5.13 115.22 110.25 1r48 n HIS 31 Ca -0.02 -3.60 -0.32 0.00 -2.01 0.00 0.00 57.72 51.78 1r48 n HIS 31 Cb 0.55 -0.29 0.04 0.00 0.12 0.00 0.00 29.99 30.40 1r48 n HIS 31 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 1r48 s PRO 32 N -1.15 3.04 0.00 -1.40 0.04 -0.37 -4.82 135.00 130.34 1r48 s PRO 32 Ca 0.35 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.43 1r48 s PRO 32 Cb 0.14 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.68 1r48 s PRO 32 CO -0.11 -1.02 0.00 2.89 0.04 0.00 0.00 177.00 178.80