#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 2.02 0.00 0.00 0.00 -1.26 -5.05 107.32 103.03 1r48 s GLY 2 Ca 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 44.72 42.82 1r48 s GLY 2 CO 0.00 -1.37 0.00 0.61 0.00 0.00 0.00 173.10 172.34 1r48 n GLY 3 N -0.55 0.22 1.08 0.20 0.00 -1.26 -3.99 105.19 100.90 1r48 n GLY 3 Ca 0.05 -1.40 0.06 0.00 0.00 0.00 0.00 46.02 44.74 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 1.13 3.14 -0.01 1.61 8.00 -1.26 -4.30 116.55 124.87 1r48 n ASP 4 Ca 0.00 -2.23 0.22 0.00 0.71 0.00 0.00 54.79 53.49 1r48 n ASP 4 Cb 0.00 -0.44 0.72 0.00 -0.02 0.00 0.00 41.12 41.39 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 2.71 0.00 0.10 -2.24 -0.00 -1.97 0.10 115.58 114.28 1r48 h ASN 5 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 56.30 56.14 1r48 h ASN 5 Cb 0.96 0.00 0.02 0.00 -0.00 0.00 0.00 38.32 39.29 1r48 h ASN 5 CO 0.12 0.00 -0.70 0.40 -0.00 0.00 0.00 177.43 177.25 1r48 h ILE 6 N 0.00 1.52 -0.29 2.57 2.04 -1.89 -3.09 117.51 118.36 1r48 h ILE 6 Ca 0.27 -2.43 0.09 0.00 1.00 0.00 0.00 64.86 63.79 1r48 h ILE 6 Cb 1.21 3.11 -0.01 0.00 -0.74 0.00 0.00 36.82 40.39 1r48 h ILE 6 CO -0.00 0.69 0.30 -0.08 0.00 0.00 0.00 178.15 179.05 1r48 h GLU 7 N -0.38 0.00 0.15 2.37 4.81 -1.13 0.59 114.58 120.99 1r48 h GLU 7 Ca -0.12 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.83 1r48 h GLU 7 Cb 1.52 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.93 1r48 h GLU 7 CO 0.13 0.00 -1.21 0.37 -0.73 0.00 0.00 179.01 177.57 1r48 h GLN 8 N 0.00 0.56 -0.81 1.92 4.15 -1.33 -2.76 115.11 116.84 1r48 h GLN 8 Ca 0.14 -0.80 -0.02 0.00 0.77 0.00 0.00 58.65 58.74 1r48 h GLN 8 Cb 0.74 0.27 -0.04 0.00 0.21 0.00 0.00 27.48 28.67 1r48 h GLN 8 CO -0.00 1.37 0.42 0.87 -1.93 0.00 0.00 178.83 179.56 1r48 h LYS 9 N 0.15 1.13 -0.28 1.69 1.57 -0.84 -2.74 116.57 117.24 1r48 h LYS 9 Ca -0.19 -0.14 -0.11 0.00 -1.87 0.00 0.00 60.65 58.34 1r48 h LYS 9 Cb 1.91 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 34.00 1r48 h LYS 9 CO 0.23 0.84 -0.24 -0.84 -0.57 0.00 0.00 179.45 178.87 1r48 h ILE 10 N 1.13 1.30 -1.05 1.86 3.07 -1.34 -2.87 117.51 119.62 1r48 h ILE 10 Ca 0.28 -1.40 0.28 0.00 1.55 0.00 0.00 64.86 65.57 1r48 h ILE 10 Cb 0.05 1.57 -0.09 0.00 -0.27 0.00 0.00 36.82 38.09 1r48 h ILE 10 CO -0.04 0.45 0.69 -0.78 -1.05 0.00 0.00 178.15 177.41 1r48 h ASP 11 N 0.41 0.38 -0.32 2.16 3.58 -1.19 0.96 116.42 122.40 1r48 h ASP 11 Ca 0.05 0.07 -0.06 0.00 0.42 0.00 0.00 57.03 57.51 1r48 h ASP 11 Cb 0.80 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.85 1r48 h ASP 11 CO 0.06 0.07 -0.03 0.44 -2.88 0.00 0.00 179.24 176.91 1r48 h ASP 12 N 0.33 0.57 -0.26 2.28 5.19 -1.35 -2.93 116.42 120.25 1r48 h ASP 12 Ca 0.59 -0.33 -0.00 0.00 -0.62 0.00 0.00 57.03 56.67 1r48 h ASP 12 Cb 1.61 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.95 1r48 h ASP 12 CO -0.26 0.76 0.16 0.40 -3.12 0.00 0.00 179.24 177.18 1r48 h ILE 13 N 0.36 1.10 -1.11 0.35 2.04 0.85 -1.96 117.51 119.13 1r48 h ILE 13 Ca 0.09 -0.23 0.31 0.00 1.00 0.00 0.00 64.86 66.02 1r48 h ILE 13 Cb 0.49 0.78 -0.07 0.00 -0.74 0.00 0.00 36.82 37.29 1r48 h ILE 13 CO 0.02 0.09 0.77 -0.78 0.00 0.00 0.00 178.15 178.25 1r48 h ASP 14 N 0.32 0.18 0.88 1.72 3.58 -0.19 1.35 116.42 124.27 1r48 h ASP 14 Ca 0.09 0.04 -0.14 0.00 0.42 0.00 0.00 57.03 57.44 1r48 h ASP 14 Cb 0.02 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 1r48 h ASP 14 CO -0.02 0.03 -0.66 -0.74 -2.88 0.00 0.00 179.24 174.97 1r48 h HIS 15 N 0.15 0.00 0.10 0.28 2.76 -1.19 -2.94 115.15 114.31 1r48 h HIS 15 Ca 0.57 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 58.44 1r48 h HIS 15 Cb 1.94 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.89 1r48 h HIS 15 CO -0.00 0.66 -1.57 0.93 -1.30 0.00 0.00 177.93 176.65 1r48 h GLU 16 N 0.00 0.21 -0.26 5.26 5.08 0.17 -2.96 114.58 122.08 1r48 h GLU 16 Ca -0.01 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 57.95 1r48 h GLU 16 Cb 1.28 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 1r48 h GLU 16 CO 0.09 1.05 -0.00 0.82 -1.00 0.00 0.00 179.01 179.96 1r48 h ILE 17 N 0.06 1.16 0.16 3.13 2.04 0.13 -2.66 117.51 121.54 1r48 h ILE 17 Ca -0.25 -0.63 -0.30 0.00 1.00 0.00 0.00 64.86 64.67 1r48 h ILE 17 Cb 2.01 0.97 0.01 0.00 -0.74 0.00 0.00 36.82 39.07 1r48 h ILE 17 CO 0.14 0.21 -1.36 0.00 0.00 0.00 0.00 178.15 177.14 1r48 h ALA 18 N 1.63 0.05 -0.71 1.87 0.00 -1.62 -3.10 119.26 117.37 1r48 h ALA 18 Ca 0.09 -0.92 0.10 0.00 0.00 0.00 0.00 54.91 54.18 1r48 h ALA 18 Cb 0.26 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 1r48 h ALA 18 CO 0.01 0.92 0.34 -0.44 0.00 0.00 0.00 179.25 180.08 1r48 h ASP 19 N 0.09 0.43 0.06 0.00 5.19 -1.30 -1.02 116.42 119.88 1r48 h ASP 19 Ca -0.19 0.07 -0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1r48 h ASP 19 Cb 2.04 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.55 1r48 h ASP 19 CO 0.22 0.24 -0.03 -0.07 -3.12 0.00 0.00 179.24 176.48 1r48 h LEU 20 N 0.58 -0.07 -1.52 1.55 3.38 -1.61 -2.85 115.31 114.77 1r48 h LEU 20 Ca 0.35 -0.41 0.25 0.00 0.09 0.00 0.00 57.88 58.17 1r48 h LEU 20 Cb 0.40 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.09 1r48 h LEU 20 CO -0.28 0.38 0.66 -0.61 0.09 0.00 0.00 178.44 178.68 1r48 h GLN 21 N -0.54 0.33 -0.10 1.13 -0.00 -1.38 0.43 115.11 114.97 1r48 h GLN 21 Ca -0.01 -0.02 -0.15 0.00 -0.00 0.00 0.00 58.65 58.47 1r48 h GLN 21 Cb 0.47 -0.07 -0.01 0.00 0.00 0.00 0.00 27.48 27.87 1r48 h GLN 21 CO 0.01 0.22 -0.60 0.00 0.00 0.00 0.00 178.83 178.46 1r48 h ALA 22 N 1.59 0.79 -0.26 3.38 0.00 -1.13 -2.67 119.26 120.98 1r48 h ALA 22 Ca 0.54 -0.54 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1r48 h ALA 22 Cb 1.47 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1r48 h ALA 22 CO -0.21 0.72 -0.34 0.87 0.00 0.00 0.00 179.25 180.29 1r48 h LYS 23 N 0.25 0.55 -0.30 0.00 6.56 0.06 -2.23 116.57 121.46 1r48 h LYS 23 Ca -0.01 -0.25 -0.14 0.00 -1.06 0.00 0.00 60.65 59.19 1r48 h LYS 23 Cb 1.12 -0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 32.76 1r48 h LYS 23 CO 0.10 0.82 -0.38 -0.09 -2.06 0.00 0.00 179.45 177.84 1r48 h ARG 24 N 0.47 0.78 0.37 3.15 2.43 -1.21 -2.92 114.38 117.46 1r48 h ARG 24 Ca 0.05 -0.44 -0.02 0.00 -0.81 0.00 0.00 59.98 58.76 1r48 h ARG 24 Cb 0.81 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 1r48 h ARG 24 CO 0.07 1.07 -0.18 1.15 -1.51 0.00 0.00 179.97 180.57 1r48 h THR 25 N 0.54 0.62 -0.81 0.20 2.02 -1.40 -2.12 112.91 111.95 1r48 h THR 25 Ca 0.04 -0.40 0.18 0.00 0.77 0.00 0.00 66.41 66.99 1r48 h THR 25 Cb 0.97 0.81 -0.11 0.00 -1.74 0.00 0.00 68.15 68.08 1r48 h THR 25 CO 0.09 0.08 0.30 0.08 0.37 0.00 0.00 175.52 176.44 1r48 h ARG 26 N -0.74 0.37 -0.73 6.66 0.11 -1.49 0.60 114.38 119.17 1r48 h ARG 26 Ca -0.05 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 60.00 1r48 h ARG 26 Cb 0.51 -0.08 -0.04 0.00 1.11 0.00 0.00 29.97 31.47 1r48 h ARG 26 CO 0.08 0.24 0.41 -0.07 0.10 0.00 0.00 179.97 180.74 1r48 h LEU 27 N 0.38 0.88 -0.60 0.08 4.07 -1.43 -1.87 115.31 116.83 1r48 h LEU 27 Ca 0.47 -0.06 -0.07 0.00 0.08 0.00 0.00 57.88 58.31 1r48 h LEU 27 Cb 0.82 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.31 1r48 h LEU 27 CO -0.49 0.70 0.11 0.58 -1.08 0.00 0.00 178.44 178.27 1r48 h VAL 28 N 1.01 1.26 -0.67 1.22 2.07 0.79 -1.92 116.25 120.00 1r48 h VAL 28 Ca 0.26 -0.96 0.19 0.00 0.82 0.00 0.00 66.70 67.01 1r48 h VAL 28 Cb -0.00 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1r48 h VAL 28 CO -0.04 0.36 0.50 -0.61 0.02 0.00 0.00 177.57 177.79 1r48 h GLN 29 N 0.88 0.00 0.01 1.57 4.15 -0.02 0.95 115.11 122.65 1r48 h GLN 29 Ca 0.18 0.00 -0.19 0.00 0.77 0.00 0.00 58.65 59.41 1r48 h GLN 29 Cb 0.40 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 1r48 h GLN 29 CO 0.01 0.00 -0.88 1.96 -1.93 0.00 0.00 178.83 177.99 1r48 h GLN 30 N 0.00 0.09 -2.04 1.69 4.20 -1.12 -3.37 115.11 114.56 1r48 h GLN 30 Ca 0.32 -0.11 -0.50 0.00 0.06 0.00 0.00 58.65 58.43 1r48 h GLN 30 Cb 1.31 0.03 -0.40 0.00 0.30 0.00 0.00 27.48 28.72 1r48 h GLN 30 CO -0.00 0.91 -1.13 -2.39 -0.67 0.00 0.00 178.83 175.54 1r48 n HIS 31 N -3.58 0.64 0.07 2.96 1.44 0.20 -4.91 115.22 112.04 1r48 n HIS 31 Ca -0.02 -3.84 -0.08 0.00 -2.01 0.00 0.00 57.72 51.78 1r48 n HIS 31 Cb 0.82 -0.43 -0.09 0.00 0.12 0.00 0.00 29.99 30.41 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 3.03 0.04 -0.01 -1.40 0.13 0.42 -3.45 132.00 130.76 1r48 h PRO 32 Ca 0.10 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1r48 h PRO 32 Cb 0.91 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.06 1r48 h PRO 32 CO 0.54 0.99 0.00 0.54 -0.23 0.00 0.00 178.00 179.83