#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r48 s GLY 2 N 0.00 -0.24 0.00 0.00 0.00 -1.26 -5.06 107.32 100.76 1r48 s GLY 2 Ca 0.00 2.77 0.00 0.00 0.00 0.00 0.00 44.72 47.49 1r48 s GLY 2 CO 0.00 2.32 0.00 0.61 0.00 0.00 0.00 173.10 176.03 1r48 n GLY 3 N 3.47 2.02 1.12 0.20 0.00 -1.26 -2.39 105.19 108.35 1r48 n GLY 3 Ca -0.17 -0.41 0.07 0.00 0.00 0.00 0.00 46.02 45.50 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 5.45 3.24 -0.00 1.61 8.00 -1.26 -4.30 116.55 129.29 1r48 n ASP 4 Ca 0.00 -2.25 0.22 0.00 0.71 0.00 0.00 54.79 53.47 1r48 n ASP 4 Cb 0.00 -0.45 0.72 0.00 -0.02 0.00 0.00 41.12 41.37 1r48 n ASP 4 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1r48 h ASN 5 N 2.77 0.00 0.08 -2.24 -0.26 -1.89 0.13 115.58 114.17 1r48 h ASN 5 Ca 0.00 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.59 1r48 h ASN 5 Cb 0.99 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 38.27 1r48 h ASN 5 CO 0.13 0.00 -0.63 0.40 -1.06 0.00 0.00 177.43 176.28 1r48 h ILE 6 N 0.00 1.53 -0.17 2.81 5.03 -1.83 -2.88 117.51 121.99 1r48 h ILE 6 Ca 0.27 -2.36 0.05 0.00 -0.12 0.00 0.00 64.86 62.70 1r48 h ILE 6 Cb 1.20 3.05 -0.01 0.00 -3.03 0.00 0.00 36.82 38.04 1r48 h ILE 6 CO -0.00 0.66 0.13 -0.08 -0.68 0.00 0.00 178.15 178.18 1r48 h GLU 7 N -0.39 0.00 0.09 2.37 4.81 -1.12 -1.09 114.58 119.25 1r48 h GLU 7 Ca -0.10 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.84 1r48 h GLU 7 Cb 1.44 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.85 1r48 h GLU 7 CO 0.12 0.00 -1.17 0.37 -0.73 0.00 0.00 179.01 177.60 1r48 h GLN 8 N 0.00 0.63 -0.93 1.92 4.15 -1.17 -2.68 115.11 117.03 1r48 h GLN 8 Ca 0.08 -0.80 -0.01 0.00 0.77 0.00 0.00 58.65 58.69 1r48 h GLN 8 Cb 0.33 0.26 -0.04 0.00 0.21 0.00 0.00 27.48 28.23 1r48 h GLN 8 CO -0.00 1.36 0.55 0.87 -1.93 0.00 0.00 178.83 179.67 1r48 h LYS 9 N 0.27 1.27 -0.27 1.69 1.57 -1.03 -2.74 116.57 117.33 1r48 h LYS 9 Ca -0.17 -0.12 -0.11 0.00 -1.87 0.00 0.00 60.65 58.37 1r48 h LYS 9 Cb 1.84 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 33.88 1r48 h LYS 9 CO 0.22 0.89 -0.27 -0.84 -0.57 0.00 0.00 179.45 178.89 1r48 h ILE 10 N 1.28 1.31 -1.07 1.86 3.07 -1.30 -2.92 117.51 119.74 1r48 h ILE 10 Ca 0.33 -1.44 0.28 0.00 1.55 0.00 0.00 64.86 65.58 1r48 h ILE 10 Cb -0.04 1.61 -0.09 0.00 -0.27 0.00 0.00 36.82 38.04 1r48 h ILE 10 CO -0.06 0.46 0.70 -0.78 -1.05 0.00 0.00 178.15 177.42 1r48 h ASP 11 N 0.40 0.38 -0.27 2.16 3.58 -1.17 0.89 116.42 122.39 1r48 h ASP 11 Ca 0.04 0.08 -0.06 0.00 0.42 0.00 0.00 57.03 57.51 1r48 h ASP 11 Cb 0.84 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.90 1r48 h ASP 11 CO 0.07 0.06 -0.05 -0.78 -2.88 0.00 0.00 179.24 175.65 1r48 h ASP 12 N 0.33 0.51 -0.23 2.28 3.58 -1.36 -2.98 116.42 118.55 1r48 h ASP 12 Ca 0.60 -0.36 -0.00 0.00 0.42 0.00 0.00 57.03 57.70 1r48 h ASP 12 Cb 1.66 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 42.56 1r48 h ASP 12 CO -0.27 0.75 0.14 0.40 -2.88 0.00 0.00 179.24 177.38 1r48 h ILE 13 N 0.26 1.08 -1.14 2.25 2.04 0.70 -2.10 117.51 120.60 1r48 h ILE 13 Ca 0.07 -0.18 0.32 0.00 1.00 0.00 0.00 64.86 66.07 1r48 h ILE 13 Cb 0.52 0.80 -0.08 0.00 -0.74 0.00 0.00 36.82 37.31 1r48 h ILE 13 CO 0.02 0.08 0.77 -0.78 0.00 0.00 0.00 178.15 178.24 1r48 h ASP 14 N 0.29 0.26 0.83 1.72 3.58 -0.18 1.35 116.42 124.26 1r48 h ASP 14 Ca 0.08 0.06 -0.14 0.00 0.42 0.00 0.00 57.03 57.46 1r48 h ASP 14 Cb 0.00 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 1r48 h ASP 14 CO -0.02 0.02 -0.64 -0.74 -2.88 0.00 0.00 179.24 174.98 1r48 h HIS 15 N 0.21 0.00 0.08 0.28 2.76 -1.24 -2.93 115.15 114.31 1r48 h HIS 15 Ca 0.62 0.00 -0.30 0.00 -2.20 0.00 0.00 60.37 58.49 1r48 h HIS 15 Cb 1.93 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.87 1r48 h HIS 15 CO -0.00 0.64 -1.57 0.93 -1.30 0.00 0.00 177.93 176.63 1r48 h GLU 16 N 0.00 0.17 -0.14 5.26 5.08 0.16 -3.02 114.58 122.09 1r48 h GLU 16 Ca -0.01 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.01 1r48 h GLU 16 Cb 1.23 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 1r48 h GLU 16 CO 0.08 0.98 -0.12 0.82 -1.00 0.00 0.00 179.01 179.77 1r48 h ILE 17 N 0.05 1.17 0.24 3.13 2.04 0.30 -2.82 117.51 121.61 1r48 h ILE 17 Ca -0.25 -0.74 -0.33 0.00 1.00 0.00 0.00 64.86 64.54 1r48 h ILE 17 Cb 1.99 1.20 0.03 0.00 -0.74 0.00 0.00 36.82 39.30 1r48 h ILE 17 CO 0.13 0.23 -1.50 0.00 0.00 0.00 0.00 178.15 177.01 1r48 h ALA 18 N 1.67 -0.09 -0.78 1.87 0.00 -1.62 -3.08 119.26 117.23 1r48 h ALA 18 Ca 0.04 -0.90 0.12 0.00 0.00 0.00 0.00 54.91 54.17 1r48 h ALA 18 Cb 0.35 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.26 1r48 h ALA 18 CO 0.02 0.77 0.39 0.22 0.00 0.00 0.00 179.25 180.65 1r48 h ASP 19 N 0.14 0.49 0.13 0.00 3.58 -1.37 -0.35 116.42 119.03 1r48 h ASP 19 Ca -0.26 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.26 1r48 h ASP 19 Cb 2.15 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.19 1r48 h ASP 19 CO 0.26 0.25 -0.06 -0.07 -2.88 0.00 0.00 179.24 176.73 1r48 h LEU 20 N 0.61 -0.15 -1.62 2.28 3.38 -1.62 -2.83 115.31 115.37 1r48 h LEU 20 Ca 0.40 -0.36 0.21 0.00 0.09 0.00 0.00 57.88 58.22 1r48 h LEU 20 Cb 0.49 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 1r48 h LEU 20 CO -0.31 0.32 0.59 -0.61 0.09 0.00 0.00 178.44 178.51 1r48 h GLN 21 N -0.65 0.31 -0.06 1.13 4.15 -1.37 0.23 115.11 118.85 1r48 h GLN 21 Ca -0.02 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.24 1r48 h GLN 21 Cb 0.50 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1r48 h GLN 21 CO 0.03 0.20 -0.62 0.00 -1.93 0.00 0.00 178.83 176.51 1r48 h ALA 22 N 1.61 0.84 -0.08 3.38 0.00 -1.03 -2.91 119.26 121.08 1r48 h ALA 22 Ca 0.45 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 1r48 h ALA 22 Cb 1.24 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1r48 h ALA 22 CO -0.14 0.75 -0.54 0.87 0.00 0.00 0.00 179.25 180.19 1r48 h LYS 23 N 0.15 0.22 -0.10 0.00 1.57 -0.31 -2.67 116.57 115.43 1r48 h LYS 23 Ca -0.01 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.59 1r48 h LYS 23 Cb 1.13 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 1r48 h LYS 23 CO 0.09 0.70 -0.13 0.00 -0.57 0.00 0.00 179.45 179.55 1r48 h ARG 24 N 0.17 0.27 0.47 3.15 3.08 -1.30 -2.76 114.38 117.47 1r48 h ARG 24 Ca 0.00 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 1r48 h ARG 24 Cb 1.01 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.07 1r48 h ARG 24 CO 0.08 0.71 -0.23 1.15 -1.07 0.00 0.00 179.97 180.61 1r48 h THR 25 N -0.15 0.53 -0.81 2.04 2.02 -1.53 -0.91 112.91 114.11 1r48 h THR 25 Ca 0.01 -0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.36 1r48 h THR 25 Cb 0.67 0.54 -0.10 0.00 -1.74 0.00 0.00 68.15 67.51 1r48 h THR 25 CO 0.03 0.00 0.34 0.08 0.37 0.00 0.00 175.52 176.34 1r48 h ARG 26 N -0.64 0.43 -0.61 6.66 0.11 -1.57 0.47 114.38 119.23 1r48 h ARG 26 Ca -0.07 -0.03 -0.03 0.00 0.10 0.00 0.00 59.98 59.96 1r48 h ARG 26 Cb 0.49 -0.10 -0.03 0.00 1.11 0.00 0.00 29.97 31.44 1r48 h ARG 26 CO 0.11 0.29 0.25 -0.07 0.10 0.00 0.00 179.97 180.64 1r48 h LEU 27 N 0.44 0.82 -0.33 0.08 3.38 -1.18 -2.49 115.31 116.03 1r48 h LEU 27 Ca 0.46 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.28 1r48 h LEU 27 Cb 0.76 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1r48 h LEU 27 CO -0.44 0.73 0.03 0.58 0.09 0.00 0.00 178.44 179.43 1r48 h VAL 28 N 0.88 1.25 -0.88 1.22 2.07 0.12 -2.24 116.25 118.67 1r48 h VAL 28 Ca 0.21 -0.89 0.26 0.00 0.82 0.00 0.00 66.70 67.10 1r48 h VAL 28 Cb 0.17 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 1r48 h VAL 28 CO -0.02 0.29 0.64 1.56 0.02 0.00 0.00 177.57 180.06 1r48 h GLN 29 N 0.38 0.00 -0.02 1.57 4.20 -0.31 0.94 115.11 121.87 1r48 h GLN 29 Ca 0.10 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.62 1r48 h GLN 29 Cb 0.40 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1r48 h GLN 29 CO 0.01 0.00 -0.82 1.96 -0.67 0.00 0.00 178.83 179.31 1r48 h GLN 30 N 0.00 0.26 -2.04 1.46 4.20 -1.19 -3.37 115.11 114.43 1r48 h GLN 30 Ca 0.42 -0.25 -0.52 0.00 0.06 0.00 0.00 58.65 58.35 1r48 h GLN 30 Cb 1.69 0.07 -0.40 0.00 0.30 0.00 0.00 27.48 29.14 1r48 h GLN 30 CO -0.00 0.94 -1.08 -2.39 -0.67 0.00 0.00 178.83 175.63 1r48 n HIS 31 N -3.73 0.58 -1.30 2.96 1.44 0.28 -5.12 115.22 110.33 1r48 n HIS 31 Ca -0.04 -3.77 -0.29 0.00 -2.01 0.00 0.00 57.72 51.61 1r48 n HIS 31 Cb 0.77 -0.41 0.19 0.00 0.12 0.00 0.00 29.99 30.66 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 -2.13 -0.07 0.00 -1.40 0.04 0.16 -4.82 135.00 126.78 1r48 s PRO 32 Ca 0.39 0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.56 1r48 s PRO 32 Cb 0.27 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 33.10 1r48 s PRO 32 CO -0.09 -2.98 0.00 0.54 0.04 0.00 0.00 177.00 174.50