#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jm0 h TYR 2 N 0.00 0.71 -0.17 1.24 -0.00 -2.06 -0.44 116.97 116.26 1jm0 h TYR 2 Ca 0.00 0.01 -0.07 0.00 0.00 0.00 0.00 58.73 58.68 1jm0 h TYR 2 Cb 0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 36.73 36.49 1jm0 h TYR 2 CO 0.00 0.45 -0.15 -0.07 -0.00 0.00 0.00 178.16 178.39 1jm0 h LEU 3 N 0.77 0.43 -1.40 0.10 3.38 -2.01 -2.33 115.31 114.24 1jm0 h LEU 3 Ca 0.21 -0.47 0.10 0.00 0.09 0.00 0.00 57.88 57.80 1jm0 h LEU 3 Cb -0.08 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 1jm0 h LEU 3 CO -0.04 0.81 0.50 0.03 0.09 0.00 0.00 178.44 179.82 1jm0 h ARG 4 N 0.05 0.65 -0.54 1.13 3.08 -1.85 -0.77 114.38 116.14 1jm0 h ARG 4 Ca 0.03 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 1jm0 h ARG 4 Cb 0.68 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 1jm0 h ARG 4 CO 0.04 0.43 -0.09 0.93 -1.07 0.00 0.00 179.97 180.21 1jm0 h GLU 5 N 0.67 1.01 -0.48 0.04 4.39 -0.83 -0.94 114.58 118.44 1jm0 h GLU 5 Ca 0.35 -0.37 -0.10 0.00 0.34 0.00 0.00 59.36 59.58 1jm0 h GLU 5 Cb 0.46 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.03 1jm0 h GLU 5 CO -0.13 1.05 -0.11 -0.07 -1.16 0.00 0.00 179.01 178.60 1jm0 h LEU 6 N 0.89 0.88 -0.46 1.33 3.38 -0.82 -1.76 115.31 118.76 1jm0 h LEU 6 Ca 0.14 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.86 1jm0 h LEU 6 Cb 0.65 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1jm0 h LEU 6 CO 0.05 1.01 0.27 0.25 0.09 0.00 0.00 178.44 180.10 1jm0 h LEU 7 N 0.80 0.43 -0.98 1.67 5.85 -0.82 -1.60 115.31 120.67 1jm0 h LEU 7 Ca 0.13 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1jm0 h LEU 7 Cb 0.63 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1jm0 h LEU 7 CO 0.04 0.31 0.45 0.11 -0.34 0.00 0.00 178.44 179.01 1jm0 h LYS 8 N 0.54 1.17 -0.43 1.25 1.57 -0.83 -0.74 116.57 119.11 1jm0 h LYS 8 Ca 0.18 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1jm0 h LYS 8 Cb 0.02 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.08 1jm0 h LYS 8 CO -0.09 0.86 0.18 -0.07 -0.57 0.00 0.00 179.45 179.76 1jm0 h LEU 9 N 1.17 0.54 -0.39 2.94 3.38 -0.80 -0.73 115.31 121.42 1jm0 h LEU 9 Ca 0.29 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 58.06 1jm0 h LEU 9 Cb 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1jm0 h LEU 9 CO -0.05 0.49 -0.33 -0.33 0.09 0.00 0.00 178.44 178.32 1jm0 h GLU 10 N 0.60 0.91 -0.93 1.13 4.39 -0.40 -1.01 114.58 119.27 1jm0 h GLU 10 Ca 0.15 -0.46 0.01 0.00 0.34 0.00 0.00 59.36 59.40 1jm0 h GLU 10 Cb 0.11 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.72 1jm0 h GLU 10 CO -0.02 1.11 0.62 -0.07 -1.16 0.00 0.00 179.01 179.49 1jm0 h LEU 11 N 0.73 1.06 -0.59 1.33 3.38 -0.72 0.12 115.31 120.62 1jm0 h LEU 11 Ca 0.07 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1jm0 h LEU 11 Cb 0.91 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1jm0 h LEU 11 CO 0.08 0.77 0.16 -0.61 0.09 0.00 0.00 178.44 178.94 1jm0 h GLN 12 N 1.26 0.93 -0.49 1.13 4.15 -1.07 -2.04 115.11 118.97 1jm0 h GLN 12 Ca 0.34 -0.21 -0.12 0.00 0.77 0.00 0.00 58.65 59.43 1jm0 h GLN 12 Cb -0.14 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.41 1jm0 h GLN 12 CO -0.08 0.85 -0.16 0.00 -1.93 0.00 0.00 178.83 177.50 1jm0 h ALA 13 N 1.04 0.77 -0.73 3.38 0.00 -0.57 -2.28 119.26 120.88 1jm0 h ALA 13 Ca 0.19 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1jm0 h ALA 13 Cb 0.32 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1jm0 h ALA 13 CO -0.00 0.66 0.48 0.82 0.00 0.00 0.00 179.25 181.22 1jm0 h ILE 14 N 0.85 1.19 -0.18 0.00 2.04 -0.78 0.21 117.51 120.83 1jm0 h ILE 14 Ca 0.12 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 1jm0 h ILE 14 Cb 0.72 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1jm0 h ILE 14 CO 0.06 0.18 0.11 0.50 0.00 0.00 0.00 178.15 179.00 1jm0 h LYS 15 N 0.99 0.24 -0.52 2.37 3.64 -1.08 -1.03 116.57 121.19 1jm0 h LYS 15 Ca 0.27 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.55 1jm0 h LYS 15 Cb -0.11 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 1jm0 h LYS 15 CO -0.06 0.19 0.03 1.96 -2.27 0.00 0.00 179.45 179.31 1jm0 h GLN 16 N 0.22 0.89 -0.37 1.90 4.20 -1.04 -1.92 115.11 118.98 1jm0 h GLN 16 Ca 0.06 -0.27 -0.14 0.00 0.06 0.00 0.00 58.65 58.37 1jm0 h GLN 16 Cb 0.01 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1jm0 h GLN 16 CO -0.01 0.90 -0.33 1.88 -0.67 0.00 0.00 178.83 180.59 1jm0 h TYR 17 N 0.76 0.99 -0.65 2.96 -1.99 -0.56 -0.22 116.97 118.27 1jm0 h TYR 17 Ca 0.15 -0.27 -0.05 0.00 2.00 0.00 0.00 58.73 60.55 1jm0 h TYR 17 Cb 0.48 -0.22 -0.03 0.00 2.00 0.00 0.00 36.73 38.96 1jm0 h TYR 17 CO 0.04 1.06 0.19 0.00 -0.00 0.00 0.00 178.16 179.44 1jm0 h ARG 18 N 0.70 0.99 -0.52 4.88 3.08 -1.06 0.36 114.38 122.82 1jm0 h ARG 18 Ca 0.07 -0.20 -0.09 0.00 0.07 0.00 0.00 59.98 59.83 1jm0 h ARG 18 Cb 0.89 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.78 1jm0 h ARG 18 CO 0.08 0.86 -0.01 0.93 -1.07 0.00 0.00 179.97 180.76 1jm0 h GLU 19 N 0.96 0.93 -0.61 0.04 5.08 -1.03 -1.76 114.58 118.20 1jm0 h GLU 19 Ca 0.21 -0.30 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 1jm0 h GLU 19 Cb 0.29 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1jm0 h GLU 19 CO -0.01 0.95 0.14 0.00 -1.00 0.00 0.00 179.01 179.10 1jm0 h ALA 20 N 0.94 0.80 -0.59 3.43 0.00 -0.52 -2.25 119.26 121.07 1jm0 h ALA 20 Ca 0.15 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1jm0 h ALA 20 Cb 0.54 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1jm0 h ALA 20 CO 0.03 0.51 0.37 1.25 0.00 0.00 0.00 179.25 181.41 1jm0 h LEU 21 N 0.89 0.61 -2.20 0.00 6.46 -0.87 0.46 115.31 120.65 1jm0 h LEU 21 Ca 0.19 -0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.95 1jm0 h LEU 21 Cb 0.36 -0.14 -0.00 0.00 -0.73 0.00 0.00 40.66 40.15 1jm0 h LEU 21 CO 0.00 0.43 0.03 -0.08 -0.62 0.00 0.00 178.44 178.20 1jm0 h GLU 22 N 0.74 0.00 0.02 1.25 4.81 -0.78 0.60 114.58 121.21 1jm0 h GLU 22 Ca 0.23 0.00 -0.40 0.00 -0.13 0.00 0.00 59.36 59.06 1jm0 h GLU 22 Cb -0.02 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.30 1jm0 h GLU 22 CO -0.08 0.00 -2.31 0.98 -0.73 0.00 0.00 179.01 176.87 1jm0 n TYR 23 N -4.21 0.28 0.55 0.92 9.36 -0.74 -4.71 117.16 118.62 1jm0 n TYR 23 Ca -0.02 0.08 0.06 0.00 3.32 0.00 0.00 57.90 61.34 1jm0 n TYR 23 Cb 0.12 -1.03 -0.03 0.00 -0.63 0.00 0.00 39.34 37.77 1jm0 n TYR 23 CO 0.00 0.00 0.00 1.33 0.22 0.00 0.00 176.86 178.41 1jm0 n VAL 24 N -3.75 0.00 -3.31 2.97 0.24 0.08 -5.01 118.33 109.55 1jm0 n VAL 24 Ca -0.46 -0.30 -0.21 0.00 -2.04 0.00 0.00 64.34 61.33 1jm0 n VAL 24 Cb 0.93 1.08 -0.02 0.00 -1.47 0.00 0.00 33.84 34.36 1jm0 n VAL 24 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1jm0 n LYS 25 N -0.70 -2.73 -2.61 7.34 4.01 0.20 -4.92 118.16 118.74 1jm0 n LYS 25 Ca 0.04 0.32 -0.42 0.00 -0.51 0.00 0.00 58.31 57.74 1jm0 n LYS 25 Cb 0.22 -4.95 -0.03 0.00 -0.51 0.00 0.00 35.03 29.76 1jm0 n LYS 25 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1jm0 s LEU 26 N -6.22 4.34 0.29 -0.35 1.43 -1.26 -4.93 118.68 111.98 1jm0 s LEU 26 Ca 0.36 1.74 0.04 0.00 -1.03 0.00 0.00 54.13 55.23 1jm0 s LEU 26 Cb -0.20 -3.57 0.73 0.00 0.03 0.00 0.00 46.19 43.19 1jm0 s LEU 26 CO 0.44 -0.37 1.68 -0.65 0.23 0.00 0.00 176.35 177.68 1jm0 h PRO 27 N 6.90 0.33 0.00 1.29 0.11 -1.99 -0.21 132.00 138.44 1jm0 h PRO 27 Ca -0.39 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 1jm0 h PRO 27 Cb 1.20 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1jm0 h PRO 27 CO 0.79 0.22 -0.01 -0.24 -0.21 0.00 0.00 178.00 178.56 1jm0 h VAL 28 N 0.34 0.77 -0.10 3.15 3.04 -2.00 0.12 116.25 121.57 1jm0 h VAL 28 Ca 0.56 -0.02 -0.11 0.00 -1.01 0.00 0.00 66.70 66.12 1jm0 h VAL 28 Cb 1.10 1.01 -0.01 0.00 -2.01 0.00 0.00 31.29 31.38 1jm0 h VAL 28 CO -0.56 0.01 -0.42 -0.07 -1.01 0.00 0.00 177.57 175.51 1jm0 h LEU 29 N 0.00 0.23 -0.71 3.16 3.38 -1.42 -2.30 115.31 117.65 1jm0 h LEU 29 Ca -0.00 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 1jm0 h LEU 29 Cb 0.01 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1jm0 h LEU 29 CO 0.00 0.63 -0.33 0.00 0.09 0.00 0.00 178.44 178.84 1jm0 h ALA 30 N 1.38 0.89 -0.41 1.53 0.00 -0.77 -0.72 119.26 121.15 1jm0 h ALA 30 Ca 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1jm0 h ALA 30 Cb 0.82 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1jm0 h ALA 30 CO 0.06 0.63 0.26 -0.22 0.00 0.00 0.00 179.25 179.98 1jm0 h LYS 31 N 0.53 0.55 -0.20 0.00 3.11 -1.01 -1.04 116.57 118.52 1jm0 h LYS 31 Ca 0.06 -0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 57.86 1jm0 h LYS 31 Cb 0.82 -0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 31.92 1jm0 h LYS 31 CO 0.07 0.39 0.12 0.82 -2.81 0.00 0.00 179.45 178.04 1jm0 h ILE 32 N 0.55 1.08 -0.60 2.00 2.04 -1.18 -2.49 117.51 118.91 1jm0 h ILE 32 Ca 0.15 -0.20 0.09 0.00 1.00 0.00 0.00 64.86 65.90 1jm0 h ILE 32 Cb -0.02 0.85 -0.07 0.00 -0.74 0.00 0.00 36.82 36.84 1jm0 h ILE 32 CO -0.03 0.08 0.23 0.25 0.00 0.00 0.00 178.15 178.68 1jm0 h LEU 33 N 0.24 0.25 -0.98 1.44 5.85 -0.95 -0.62 115.31 120.54 1jm0 h LEU 33 Ca 0.07 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.97 1jm0 h LEU 33 Cb 0.02 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.02 1jm0 h LEU 33 CO -0.01 0.15 0.61 -0.08 -0.34 0.00 0.00 178.44 178.77 1jm0 h GLU 34 N 0.42 0.98 -0.32 1.25 4.81 -0.84 -1.45 114.58 119.42 1jm0 h GLU 34 Ca 0.30 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.44 1jm0 h GLU 34 Cb 0.35 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1jm0 h GLU 34 CO -0.29 0.65 0.06 -0.44 -0.73 0.00 0.00 179.01 178.26 1jm0 h ASP 35 N 1.01 0.50 -0.33 1.04 3.32 -0.74 -2.40 116.42 118.83 1jm0 h ASP 35 Ca 0.47 -0.25 -0.10 0.00 0.02 0.00 0.00 57.03 57.17 1jm0 h ASP 35 Cb 0.40 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 1jm0 h ASP 35 CO -0.24 0.62 -0.16 -0.33 -1.72 0.00 0.00 179.24 177.41 1jm0 h GLU 36 N 0.37 0.78 -0.37 3.56 4.39 -0.60 0.16 114.58 122.86 1jm0 h GLU 36 Ca 0.10 -0.28 -0.04 0.00 0.34 0.00 0.00 59.36 59.48 1jm0 h GLU 36 Cb 0.32 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 1jm0 h GLU 36 CO 0.00 0.89 0.07 0.93 -1.16 0.00 0.00 179.01 179.75 1jm0 h GLU 37 N 0.70 0.54 -0.51 2.33 5.08 -1.13 -0.97 114.58 120.61 1jm0 h GLU 37 Ca 0.11 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 1jm0 h GLU 37 Cb 0.65 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1jm0 h GLU 37 CO 0.05 0.51 0.10 -0.22 -1.00 0.00 0.00 179.01 178.45 1jm0 h LYS 38 N 0.53 0.84 -0.57 2.33 3.64 -0.77 -2.14 116.57 120.43 1jm0 h LYS 38 Ca 0.12 -0.22 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1jm0 h LYS 38 Cb 0.23 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 1jm0 h LYS 38 CO -0.00 0.82 0.35 0.45 -2.27 0.00 0.00 179.45 178.79 1jm0 h HIS 39 N 0.72 0.65 -0.27 1.91 3.86 -0.31 -0.87 115.15 120.84 1jm0 h HIS 39 Ca 0.16 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.42 1jm0 h HIS 39 Cb 0.38 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.60 1jm0 h HIS 39 CO 0.03 0.37 0.06 0.82 0.86 0.00 0.00 177.93 180.07 1jm0 h ILE 40 N 0.68 0.89 -0.91 2.45 1.08 -1.02 -0.17 117.51 120.51 1jm0 h ILE 40 Ca 0.23 -0.06 0.03 0.00 -0.39 0.00 0.00 64.86 64.68 1jm0 h ILE 40 Cb 0.03 0.70 -0.05 0.00 -3.07 0.00 0.00 36.82 34.43 1jm0 h ILE 40 CO -0.10 0.03 0.59 -0.33 -0.69 0.00 0.00 178.15 177.65 1jm0 h GLU 41 N 0.17 1.12 -0.23 2.37 5.08 -0.77 0.83 114.58 123.14 1jm0 h GLU 41 Ca 0.12 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1jm0 h GLU 41 Cb 0.12 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1jm0 h GLU 41 CO -0.15 0.74 0.02 -1.49 -1.00 0.00 0.00 179.01 177.13 1jm0 h TRP 42 N 1.15 0.42 -0.54 4.33 6.55 -0.81 -0.66 115.95 126.39 1jm0 h TRP 42 Ca 0.36 -0.06 -0.09 0.00 0.95 0.00 0.00 58.89 60.04 1jm0 h TRP 42 Cb -0.01 -0.11 -0.02 0.00 -0.86 0.00 0.00 29.16 28.16 1jm0 h TRP 42 CO -0.01 0.54 -0.02 -0.07 -1.05 0.00 0.00 178.44 177.83 1jm0 h LEU 43 N 0.18 0.95 -1.09 -4.49 3.38 -0.53 -2.16 115.31 111.56 1jm0 h LEU 43 Ca 0.07 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.75 1jm0 h LEU 43 Cb 0.35 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1jm0 h LEU 43 CO 0.01 1.03 0.62 -0.33 0.09 0.00 0.00 178.44 179.86 1jm0 h GLU 44 N 0.83 1.17 0.26 1.13 5.08 -0.75 -0.20 114.58 122.11 1jm0 h GLU 44 Ca 0.15 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1jm0 h GLU 44 Cb 0.56 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1jm0 h GLU 44 CO 0.03 0.77 -0.22 1.15 -1.00 0.00 0.00 179.01 179.74 1jm0 h THR 45 N 1.20 0.53 -0.90 1.13 2.02 -0.57 -2.61 112.91 113.71 1jm0 h THR 45 Ca 0.37 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.67 1jm0 h THR 45 Cb -0.02 0.53 -0.07 0.00 -1.74 0.00 0.00 68.15 66.85 1jm0 h THR 45 CO -0.10 0.00 0.58 0.40 0.37 0.00 0.00 175.52 176.76 1jm0 h ILE 46 N -0.49 0.88 -2.00 3.11 2.04 -0.87 -3.43 117.51 116.74 1jm0 h ILE 46 Ca -0.01 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1jm0 h ILE 46 Cb 0.44 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 1jm0 h ILE 46 CO -0.03 0.14 0.00 0.18 0.00 0.00 0.00 178.15 178.45 1jm0 n LEU 47 N -4.56 0.00 0.00 1.44 4.77 -0.13 -5.12 117.00 113.40 1jm0 n LEU 47 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1jm0 n LEU 47 Cb 0.41 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1jm0 n LEU 47 CO 0.30 -0.26 0.19 0.61 -1.33 0.00 0.00 177.39 176.89