#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 0.31 2.98 0.00 0.00 -1.26 -5.00 105.19 102.23 1r48 n GLY 2 Ca 0.00 -1.66 -0.18 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.49 0.00 -0.02 0.00 -1.26 -4.82 105.19 98.60 1r48 n GLY 3 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.10 0.00 0.00 1.61 8.00 -1.26 -5.01 116.55 117.79 1r48 n ASP 4 Ca -0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.43 1r48 n ASP 4 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 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 -0.59 0.00 0.10 -2.24 4.05 -1.26 -4.77 115.26 110.55 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 0.06 -0.08 0.00 1.23 0.00 0.00 39.78 40.99 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 0.91 -0.58 -1.44 2.04 -1.97 0.11 117.51 116.57 1r48 h ILE 6 Ca 0.00 -0.56 0.10 0.00 1.00 0.00 0.00 64.86 65.40 1r48 h ILE 6 Cb 0.00 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1r48 h ILE 6 CO 0.00 0.13 0.39 -0.08 0.00 0.00 0.00 178.15 178.59 1r48 h GLU 7 N -0.53 0.36 0.09 2.37 4.57 -1.91 -0.96 114.58 118.57 1r48 h GLU 7 Ca -0.03 -0.02 -0.26 0.00 -1.18 0.00 0.00 59.36 57.87 1r48 h GLU 7 Cb 0.40 -0.08 0.01 0.00 -0.16 0.00 0.00 28.75 28.92 1r48 h GLU 7 CO 0.04 0.24 -1.14 0.37 -1.18 0.00 0.00 179.01 177.34 1r48 h GLN 8 N 0.37 0.40 -0.98 1.92 4.15 -1.81 -2.99 115.11 116.17 1r48 h GLN 8 Ca 0.27 -0.54 0.01 0.00 0.77 0.00 0.00 58.65 59.15 1r48 h GLN 8 Cb 0.58 0.18 -0.05 0.00 0.21 0.00 0.00 27.48 28.40 1r48 h GLN 8 CO -0.07 1.22 0.64 -0.22 -1.93 0.00 0.00 178.83 178.46 1r48 h LYS 9 N 0.17 1.30 -0.27 1.69 1.63 0.54 -2.68 116.57 118.95 1r48 h LYS 9 Ca -0.13 -0.09 -0.12 0.00 -0.85 0.00 0.00 60.65 59.47 1r48 h LYS 9 Cb 1.82 -0.29 -0.00 0.00 -0.60 0.00 0.00 32.23 33.16 1r48 h LYS 9 CO 0.20 0.87 -0.29 -0.84 -3.45 0.00 0.00 179.45 175.94 1r48 h ILE 10 N 1.34 1.31 -1.00 2.00 3.07 -1.43 -2.94 117.51 119.86 1r48 h ILE 10 Ca 0.36 -1.46 0.26 0.00 1.55 0.00 0.00 64.86 65.57 1r48 h ILE 10 Cb -0.13 1.62 -0.07 0.00 -0.27 0.00 0.00 36.82 37.96 1r48 h ILE 10 CO -0.08 0.46 0.67 0.44 -1.05 0.00 0.00 178.15 178.60 1r48 h ASP 11 N 0.41 0.30 -0.15 2.16 5.19 -1.32 0.51 116.42 123.52 1r48 h ASP 11 Ca 0.04 0.05 -0.03 0.00 -0.62 0.00 0.00 57.03 56.46 1r48 h ASP 11 Cb 0.86 -0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.36 1r48 h ASP 11 CO 0.07 0.08 -0.04 -0.78 -3.12 0.00 0.00 179.24 175.45 1r48 h ASP 12 N 0.28 0.29 -0.31 6.45 1.82 -1.34 -2.94 116.42 120.67 1r48 h ASP 12 Ca 0.53 -0.38 0.00 0.00 -0.39 0.00 0.00 57.03 56.79 1r48 h ASP 12 Cb 1.55 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 41.47 1r48 h ASP 12 CO -0.17 0.60 0.20 0.40 -1.61 0.00 0.00 179.24 178.65 1r48 h ILE 13 N -0.02 1.10 -1.10 2.25 2.04 -0.12 -1.93 117.51 119.72 1r48 h ILE 13 Ca 0.04 -0.21 0.31 0.00 1.00 0.00 0.00 64.86 65.99 1r48 h ILE 13 Cb 0.47 0.68 -0.07 0.00 -0.74 0.00 0.00 36.82 37.16 1r48 h ILE 13 CO 0.02 0.10 0.76 -0.78 0.00 0.00 0.00 178.15 178.24 1r48 h ASP 14 N 0.41 0.21 0.84 1.72 3.58 -0.23 1.32 116.42 124.27 1r48 h ASP 14 Ca 0.11 0.04 -0.14 0.00 0.42 0.00 0.00 57.03 57.47 1r48 h ASP 14 Cb -0.01 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.03 1r48 h ASP 14 CO -0.02 0.03 -0.65 -0.74 -2.88 0.00 0.00 179.24 174.98 1r48 h HIS 15 N 0.18 0.00 0.10 0.28 2.76 -1.18 -2.93 115.15 114.36 1r48 h HIS 15 Ca 0.58 0.00 -0.30 0.00 -2.20 0.00 0.00 60.37 58.44 1r48 h HIS 15 Cb 1.90 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.84 1r48 h HIS 15 CO -0.00 0.65 -1.55 0.93 -1.30 0.00 0.00 177.93 176.65 1r48 h GLU 16 N 0.00 0.21 -0.15 5.26 4.39 0.16 -2.99 114.58 121.45 1r48 h GLU 16 Ca -0.01 -0.35 -0.04 0.00 0.34 0.00 0.00 59.36 59.30 1r48 h GLU 16 Cb 1.24 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 30.01 1r48 h GLU 16 CO 0.08 1.04 -0.11 0.82 -1.16 0.00 0.00 179.01 179.69 1r48 h ILE 17 N 0.06 1.17 0.20 3.13 2.04 0.14 -2.75 117.51 121.49 1r48 h ILE 17 Ca -0.25 -0.72 -0.32 0.00 1.00 0.00 0.00 64.86 64.58 1r48 h ILE 17 Cb 2.00 1.17 0.02 0.00 -0.74 0.00 0.00 36.82 39.27 1r48 h ILE 17 CO 0.15 0.23 -1.43 0.00 0.00 0.00 0.00 178.15 177.09 1r48 h ALA 18 N 1.67 -0.01 -0.77 1.87 0.00 -1.62 -3.07 119.26 117.33 1r48 h ALA 18 Ca 0.05 -0.91 0.11 0.00 0.00 0.00 0.00 54.91 54.16 1r48 h ALA 18 Cb 0.34 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.20 1r48 h ALA 18 CO 0.02 0.86 0.39 0.22 0.00 0.00 0.00 179.25 180.74 1r48 h ASP 19 N 0.11 0.50 0.16 0.00 1.82 -1.34 0.44 116.42 118.12 1r48 h ASP 19 Ca -0.22 0.07 -0.01 0.00 -0.39 0.00 0.00 57.03 56.48 1r48 h ASP 19 Cb 2.09 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 42.09 1r48 h ASP 19 CO 0.23 0.26 -0.08 -0.07 -1.61 0.00 0.00 179.24 177.98 1r48 h LEU 20 N 0.63 -0.19 -1.55 2.28 3.38 -1.62 -2.75 115.31 115.49 1r48 h LEU 20 Ca 0.40 -0.34 0.21 0.00 0.09 0.00 0.00 57.88 58.24 1r48 h LEU 20 Cb 0.47 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 1r48 h LEU 20 CO -0.30 0.30 0.60 -0.61 0.09 0.00 0.00 178.44 178.52 1r48 h GLN 21 N -0.74 0.36 -0.02 1.13 -0.00 -1.37 0.31 115.11 114.78 1r48 h GLN 21 Ca -0.02 -0.02 -0.14 0.00 -0.00 0.00 0.00 58.65 58.47 1r48 h GLN 21 Cb 0.51 -0.08 -0.02 0.00 0.00 0.00 0.00 27.48 27.90 1r48 h GLN 21 CO 0.04 0.24 -0.64 0.00 0.00 0.00 0.00 178.83 178.47 1r48 h ALA 22 N 1.61 0.91 -0.03 3.38 0.00 -0.90 -2.73 119.26 121.51 1r48 h ALA 22 Ca 0.47 -0.58 -0.17 0.00 0.00 0.00 0.00 54.91 54.63 1r48 h ALA 22 Cb 1.23 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1r48 h ALA 22 CO -0.17 0.78 -0.75 0.87 0.00 0.00 0.00 179.25 179.99 1r48 h LYS 23 N 0.05 0.18 -0.19 0.00 1.57 -0.13 -2.75 116.57 115.30 1r48 h LYS 23 Ca -0.01 -0.16 -0.18 0.00 -1.87 0.00 0.00 60.65 58.43 1r48 h LYS 23 Cb 1.14 0.04 0.01 0.00 0.08 0.00 0.00 32.23 33.49 1r48 h LYS 23 CO 0.09 0.85 -0.59 -0.09 -0.57 0.00 0.00 179.45 179.13 1r48 h ARG 24 N 0.12 0.73 0.43 3.15 2.43 -1.20 -3.00 114.38 117.04 1r48 h ARG 24 Ca -0.02 -0.54 -0.02 0.00 -0.81 0.00 0.00 59.98 58.59 1r48 h ARG 24 Cb 1.32 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 1r48 h ARG 24 CO 0.11 1.16 -0.21 1.15 -1.51 0.00 0.00 179.97 180.67 1r48 h THR 25 N 0.45 0.52 -0.88 0.20 2.02 -1.52 -2.08 112.91 111.62 1r48 h THR 25 Ca -0.02 -0.42 0.20 0.00 0.77 0.00 0.00 66.41 66.94 1r48 h THR 25 Cb 1.22 0.70 -0.12 0.00 -1.74 0.00 0.00 68.15 68.21 1r48 h THR 25 CO 0.13 0.07 0.39 0.08 0.37 0.00 0.00 175.52 176.55 1r48 h ARG 26 N -0.84 0.42 -0.78 6.66 0.11 -1.60 0.63 114.38 118.98 1r48 h ARG 26 Ca -0.06 -0.03 -0.03 0.00 0.10 0.00 0.00 59.98 59.97 1r48 h ARG 26 Cb 0.56 -0.10 -0.04 0.00 1.11 0.00 0.00 29.97 31.50 1r48 h ARG 26 CO 0.10 0.28 0.38 -0.07 0.10 0.00 0.00 179.97 180.76 1r48 h LEU 27 N 0.44 1.01 -0.37 0.08 4.07 -1.45 -2.43 115.31 116.66 1r48 h LEU 27 Ca 0.53 -0.11 -0.02 0.00 0.08 0.00 0.00 57.88 58.36 1r48 h LEU 27 Cb 0.96 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.43 1r48 h LEU 27 CO -0.49 0.84 0.16 0.58 -1.08 0.00 0.00 178.44 178.45 1r48 h VAL 28 N 1.10 1.18 -0.63 1.22 2.07 0.89 -1.44 116.25 120.64 1r48 h VAL 28 Ca 0.27 -0.53 0.18 0.00 0.82 0.00 0.00 66.70 67.44 1r48 h VAL 28 Cb 0.10 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 1r48 h VAL 28 CO -0.04 0.19 0.53 1.56 0.02 0.00 0.00 177.57 179.84 1r48 h GLN 29 N 0.46 0.00 0.00 1.57 4.20 -0.47 0.91 115.11 121.78 1r48 h GLN 29 Ca 0.13 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.66 1r48 h GLN 29 Cb 0.15 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 1r48 h GLN 29 CO -0.01 0.00 -0.83 0.37 -0.67 0.00 0.00 178.83 177.69 1r48 h GLN 30 N 0.00 0.04 -2.03 1.46 5.75 -1.01 -3.37 115.11 115.96 1r48 h GLN 30 Ca 0.30 -0.05 -0.51 0.00 -0.15 0.00 0.00 58.65 58.24 1r48 h GLN 30 Cb 1.35 0.01 -0.40 0.00 1.07 0.00 0.00 27.48 29.52 1r48 h GLN 30 CO -0.00 0.84 -1.11 -2.39 -2.65 0.00 0.00 178.83 173.52 1r48 n HIS 31 N -3.59 0.47 0.14 3.99 1.44 0.28 -4.92 115.22 113.03 1r48 n HIS 31 Ca -0.01 -3.78 -0.00 0.00 -2.01 0.00 0.00 57.72 51.92 1r48 n HIS 31 Cb 0.79 -0.41 0.15 0.00 0.12 0.00 0.00 29.99 30.64 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 3.29 0.00 0.00 -1.40 0.13 -0.65 -3.45 132.00 129.91 1r48 h PRO 32 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1r48 h PRO 32 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1r48 h PRO 32 CO 0.53 0.61 0.00 0.54 -0.23 0.00 0.00 178.00 179.45