#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 0.36 -0.24 1.24 -0.00 -2.06 -1.33 116.97 114.94 1jm0 h TYR 2 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 58.69 1jm0 h TYR 2 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 36.73 36.60 1jm0 h TYR 2 CO 0.00 0.25 -0.02 -0.07 -0.00 0.00 0.00 178.16 178.31 1jm0 h LEU 3 N 0.38 0.44 -1.48 0.10 3.38 -2.00 -1.94 115.31 114.19 1jm0 h LEU 3 Ca 0.10 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 1jm0 h LEU 3 Cb -0.01 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1jm0 h LEU 3 CO -0.02 0.67 0.02 0.03 0.09 0.00 0.00 178.44 179.23 1jm0 h ARG 4 N 0.21 0.36 -0.50 1.13 3.08 -1.86 -2.18 114.38 114.62 1jm0 h ARG 4 Ca 0.07 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.95 1jm0 h ARG 4 Cb 0.46 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1jm0 h ARG 4 CO 0.02 0.37 -0.10 0.93 -1.07 0.00 0.00 179.97 180.12 1jm0 h GLU 5 N 0.35 0.95 -0.76 0.04 4.39 -1.03 -1.26 114.58 117.27 1jm0 h GLU 5 Ca 0.08 -0.36 -0.04 0.00 0.34 0.00 0.00 59.36 59.39 1jm0 h GLU 5 Cb 0.20 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 1jm0 h GLU 5 CO 0.00 1.02 0.34 -0.07 -1.16 0.00 0.00 179.01 179.14 1jm0 h LEU 6 N 0.81 1.01 -0.76 1.33 3.38 -0.94 -1.13 115.31 119.02 1jm0 h LEU 6 Ca 0.13 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1jm0 h LEU 6 Cb 0.66 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1jm0 h LEU 6 CO 0.05 0.88 -0.19 0.25 0.09 0.00 0.00 178.44 179.51 1jm0 h LEU 7 N 1.09 0.74 -0.54 1.67 5.85 -1.17 -0.89 115.31 122.06 1jm0 h LEU 7 Ca 0.26 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1jm0 h LEU 7 Cb 0.16 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1jm0 h LEU 7 CO -0.03 0.92 0.21 0.50 -0.34 0.00 0.00 178.44 179.70 1jm0 h LYS 8 N 0.65 0.82 -0.59 1.25 1.63 -0.74 -0.38 116.57 119.21 1jm0 h LYS 8 Ca 0.10 -0.16 -0.07 0.00 -0.85 0.00 0.00 60.65 59.67 1jm0 h LYS 8 Cb 0.68 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.16 1jm0 h LYS 8 CO 0.05 0.72 0.07 -0.07 -3.45 0.00 0.00 179.45 176.77 1jm0 h LEU 9 N 0.74 0.92 -0.37 5.20 3.38 -0.87 -0.59 115.31 123.73 1jm0 h LEU 9 Ca 0.18 -0.22 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 1jm0 h LEU 9 Cb 0.22 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1jm0 h LEU 9 CO -0.01 0.94 -0.23 -0.33 0.09 0.00 0.00 178.44 178.90 1jm0 h GLU 10 N 0.90 0.81 -0.59 1.13 4.39 -0.71 0.00 114.58 120.51 1jm0 h GLU 10 Ca 0.18 -0.38 -0.09 0.00 0.34 0.00 0.00 59.36 59.41 1jm0 h GLU 10 Cb 0.43 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 1jm0 h GLU 10 CO 0.01 1.01 0.02 -0.07 -1.16 0.00 0.00 179.01 178.83 1jm0 h LEU 11 N 0.60 1.00 -0.31 1.33 3.38 -0.89 -0.09 115.31 120.33 1jm0 h LEU 11 Ca 0.07 -0.30 0.07 0.00 0.09 0.00 0.00 57.88 57.82 1jm0 h LEU 11 Cb 0.80 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 41.20 1jm0 h LEU 11 CO 0.07 1.05 -0.22 1.56 0.09 0.00 0.00 178.44 180.98 1jm0 h GLN 12 N 0.92 -0.18 -0.31 1.13 4.20 -1.00 -2.33 115.11 117.53 1jm0 h GLN 12 Ca 0.17 0.01 -0.14 0.00 0.06 0.00 0.00 58.65 58.75 1jm0 h GLN 12 Cb 0.52 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1jm0 h GLN 12 CO 0.03 -0.12 -0.38 0.00 -0.67 0.00 0.00 178.83 177.68 1jm0 h ALA 13 N 0.96 0.74 -0.90 3.87 0.00 -0.63 -2.93 119.26 120.38 1jm0 h ALA 13 Ca 0.16 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1jm0 h ALA 13 Cb 0.44 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1jm0 h ALA 13 CO -0.42 0.66 0.49 0.82 0.00 0.00 0.00 179.25 180.80 1jm0 h ILE 14 N 0.60 1.26 -0.80 0.00 2.04 -0.80 -0.47 117.51 119.34 1jm0 h ILE 14 Ca 0.05 -0.64 0.01 0.00 1.00 0.00 0.00 64.86 65.28 1jm0 h ILE 14 Cb 0.92 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 1jm0 h ILE 14 CO 0.08 0.29 0.53 0.50 0.00 0.00 0.00 178.15 179.55 1jm0 h LYS 15 N 1.26 1.04 -0.15 2.37 3.64 -1.31 -1.66 116.57 121.76 1jm0 h LYS 15 Ca 0.32 -0.06 -0.18 0.00 -1.27 0.00 0.00 60.65 59.45 1jm0 h LYS 15 Cb 0.02 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.61 1jm0 h LYS 15 CO -0.05 0.69 -0.65 1.96 -2.27 0.00 0.00 179.45 179.13 1jm0 h GLN 16 N 1.07 0.56 -0.42 1.90 1.08 -1.18 -2.53 115.11 115.59 1jm0 h GLN 16 Ca 0.29 -0.40 -0.11 0.00 -1.45 0.00 0.00 58.65 56.98 1jm0 h GLN 16 Cb -0.11 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.37 1jm0 h GLN 16 CO -0.07 1.02 -0.19 1.88 -0.95 0.00 0.00 178.83 180.53 1jm0 h TYR 17 N 0.41 0.90 -0.28 2.96 -1.99 -0.99 -0.35 116.97 117.63 1jm0 h TYR 17 Ca -0.02 -0.19 0.04 0.00 2.00 0.00 0.00 58.73 60.56 1jm0 h TYR 17 Cb 1.22 -0.22 -0.04 0.00 2.00 0.00 0.00 36.73 39.70 1jm0 h TYR 17 CO 0.05 0.92 0.06 0.00 -0.00 0.00 0.00 178.16 179.20 1jm0 h ARG 18 N 0.71 0.17 -0.95 4.88 3.08 -1.21 0.90 114.38 121.96 1jm0 h ARG 18 Ca 0.10 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.16 1jm0 h ARG 18 Cb 0.69 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.66 1jm0 h ARG 18 CO 0.05 0.11 0.63 0.93 -1.07 0.00 0.00 179.97 180.62 1jm0 h GLU 19 N 0.17 1.23 -0.54 0.04 5.08 -1.19 -1.02 114.58 118.34 1jm0 h GLU 19 Ca 0.13 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1jm0 h GLU 19 Cb 0.13 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1jm0 h GLU 19 CO -0.17 0.81 0.19 0.00 -1.00 0.00 0.00 179.01 178.85 1jm0 h ALA 20 N 1.42 0.71 -0.25 3.43 0.00 -0.64 -1.66 119.26 122.27 1jm0 h ALA 20 Ca 0.35 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1jm0 h ALA 20 Cb -0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1jm0 h ALA 20 CO -0.08 0.35 -0.03 1.25 0.00 0.00 0.00 179.25 180.74 1jm0 h LEU 21 N 0.75 0.35 -0.25 0.00 6.46 -0.10 -0.22 115.31 122.30 1jm0 h LEU 21 Ca 0.18 -0.06 -0.07 0.00 -0.12 0.00 0.00 57.88 57.81 1jm0 h LEU 21 Cb 0.24 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 1jm0 h LEU 21 CO -0.01 0.43 -0.11 -0.08 -0.62 0.00 0.00 178.44 178.06 1jm0 h GLU 22 N 0.36 0.52 0.17 1.25 4.81 -1.00 -3.21 114.58 117.48 1jm0 h GLU 22 Ca 0.08 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.08 1jm0 h GLU 22 Cb 0.29 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1jm0 h GLU 22 CO 0.01 0.77 -0.08 -0.92 -0.73 0.00 0.00 179.01 178.06 1jm0 h TYR 23 N 0.25 -0.21 -3.27 0.92 3.20 -0.69 -3.43 116.97 113.75 1jm0 h TYR 23 Ca 0.06 -0.00 -0.47 0.00 3.14 0.00 0.00 58.73 61.45 1jm0 h TYR 23 Cb 0.60 0.07 -0.37 0.00 1.54 0.00 0.00 36.73 38.57 1jm0 h TYR 23 CO 0.06 0.13 -0.78 0.54 -1.64 0.00 0.00 178.16 176.47 1jm0 s VAL 24 N -4.71 0.68 -1.26 1.81 0.11 -0.15 -5.06 120.40 111.83 1jm0 s VAL 24 Ca -0.15 -0.10 -0.09 0.00 -2.93 0.00 0.00 61.98 58.72 1jm0 s VAL 24 Cb 0.02 -0.75 -0.07 0.00 -1.53 0.00 0.00 36.38 34.06 1jm0 s VAL 24 CO 0.60 0.30 2.49 0.29 -3.33 0.00 0.00 175.10 175.45 1jm0 n LYS 25 N 4.83 2.82 -2.80 1.54 4.76 -1.21 -4.31 118.16 123.79 1jm0 n LYS 25 Ca -0.13 -1.88 -0.42 0.00 -2.87 0.00 0.00 58.31 53.01 1jm0 n LYS 25 Cb 0.50 -2.69 -0.03 0.00 -1.84 0.00 0.00 35.03 30.97 1jm0 n LYS 25 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1jm0 s LEU 26 N 0.32 4.04 0.60 -0.35 1.43 -1.26 -4.92 118.68 118.54 1jm0 s LEU 26 Ca 0.54 0.94 0.29 0.00 -1.03 0.00 0.00 54.13 54.87 1jm0 s LEU 26 Cb 0.14 -3.31 1.55 0.00 0.03 0.00 0.00 46.19 44.60 1jm0 s LEU 26 CO -0.04 -0.70 1.96 -0.65 0.23 0.00 0.00 176.35 177.15 1jm0 h PRO 27 N 7.96 0.00 0.00 1.29 0.11 -1.99 -0.05 132.00 139.32 1jm0 h PRO 27 Ca -0.22 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.85 1jm0 h PRO 27 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1jm0 h PRO 27 CO 0.95 0.00 -0.19 -0.24 -0.21 0.00 0.00 178.00 178.30 1jm0 h VAL 28 N 0.00 0.64 -0.32 3.15 3.04 -1.99 -1.99 116.25 118.79 1jm0 h VAL 28 Ca 0.15 -0.86 -0.11 0.00 -1.01 0.00 0.00 66.70 64.87 1jm0 h VAL 28 Cb 0.91 1.55 -0.01 0.00 -2.01 0.00 0.00 31.29 31.73 1jm0 h VAL 28 CO -0.00 0.19 -0.25 -0.07 -1.01 0.00 0.00 177.57 176.42 1jm0 h LEU 29 N 0.00 0.66 -1.02 3.16 3.38 -1.39 -1.11 115.31 118.99 1jm0 h LEU 29 Ca -0.00 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 1jm0 h LEU 29 Cb 0.54 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1jm0 h LEU 29 CO 0.03 0.89 -0.08 0.00 0.09 0.00 0.00 178.44 179.37 1jm0 h ALA 30 N 1.16 1.18 -0.41 1.53 0.00 -1.49 -0.78 119.26 120.45 1jm0 h ALA 30 Ca 0.08 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1jm0 h ALA 30 Cb 0.73 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1jm0 h ALA 30 CO 0.06 0.53 -0.09 -0.22 0.00 0.00 0.00 179.25 179.52 1jm0 h LYS 31 N 0.57 0.78 -0.29 0.00 3.11 -0.97 -1.21 116.57 118.56 1jm0 h LYS 31 Ca 0.11 -0.30 -0.01 0.00 -2.81 0.00 0.00 60.65 57.64 1jm0 h LYS 31 Cb 0.48 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.65 1jm0 h LYS 31 CO 0.03 0.91 0.13 0.82 -2.81 0.00 0.00 179.45 178.53 1jm0 h ILE 32 N 0.60 1.16 -0.82 2.00 2.04 -1.00 -2.54 117.51 118.94 1jm0 h ILE 32 Ca 0.10 -0.46 0.18 0.00 1.00 0.00 0.00 64.86 65.68 1jm0 h ILE 32 Cb 0.62 0.93 -0.06 0.00 -0.74 0.00 0.00 36.82 37.57 1jm0 h ILE 32 CO 0.04 0.16 0.55 -0.07 0.00 0.00 0.00 178.15 178.83 1jm0 h LEU 33 N 0.33 0.36 -0.48 1.44 3.38 -0.85 0.41 115.31 119.90 1jm0 h LEU 33 Ca 0.10 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 1jm0 h LEU 33 Cb 0.13 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1jm0 h LEU 33 CO -0.01 0.16 -0.02 -0.33 0.09 0.00 0.00 178.44 178.33 1jm0 h GLU 34 N 0.37 0.86 -0.46 1.13 5.08 -0.82 -1.49 114.58 119.25 1jm0 h GLU 34 Ca 0.41 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1jm0 h GLU 34 Cb 1.06 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 1jm0 h GLU 34 CO -0.13 0.92 0.23 -0.44 -1.00 0.00 0.00 179.01 178.58 1jm0 h ASP 35 N 0.72 0.60 -0.37 1.42 3.32 -0.66 -2.41 116.42 119.03 1jm0 h ASP 35 Ca 0.13 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 1jm0 h ASP 35 Cb 0.54 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 1jm0 h ASP 35 CO 0.03 0.55 0.10 -0.33 -1.72 0.00 0.00 179.24 177.86 1jm0 h GLU 36 N 0.60 0.67 -0.47 3.56 4.39 -0.93 -0.17 114.58 122.23 1jm0 h GLU 36 Ca 0.16 -0.12 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 1jm0 h GLU 36 Cb 0.10 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 1jm0 h GLU 36 CO -0.02 0.62 0.05 1.49 -1.16 0.00 0.00 179.01 179.98 1jm0 h GLU 37 N 0.65 0.75 -0.52 2.33 4.57 -1.08 -0.62 114.58 120.65 1jm0 h GLU 37 Ca 0.15 -0.18 -0.08 0.00 -1.18 0.00 0.00 59.36 58.07 1jm0 h GLU 37 Cb 0.26 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 1jm0 h GLU 37 CO -0.00 0.73 -0.00 -0.22 -1.18 0.00 0.00 179.01 178.34 1jm0 h LYS 38 N 0.71 0.92 -0.67 1.92 1.63 -0.67 -2.19 116.57 118.22 1jm0 h LYS 38 Ca 0.15 -0.29 0.05 0.00 -0.85 0.00 0.00 60.65 59.70 1jm0 h LYS 38 Cb 0.37 -0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 31.87 1jm0 h LYS 38 CO 0.01 0.94 0.40 0.45 -3.45 0.00 0.00 179.45 177.80 1jm0 h HIS 39 N 0.79 0.74 -0.62 1.91 3.86 -0.52 -0.70 115.15 120.61 1jm0 h HIS 39 Ca 0.15 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.34 1jm0 h HIS 39 Cb 0.53 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.74 1jm0 h HIS 39 CO 0.04 0.39 0.21 0.82 0.86 0.00 0.00 177.93 180.25 1jm0 h ILE 40 N 0.76 1.24 -0.41 2.45 2.04 -0.97 -0.59 117.51 122.02 1jm0 h ILE 40 Ca 0.29 -0.80 0.02 0.00 1.00 0.00 0.00 64.86 65.37 1jm0 h ILE 40 Cb 0.11 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1jm0 h ILE 40 CO -0.15 0.31 0.23 -0.08 0.00 0.00 0.00 178.15 178.46 1jm0 h GLU 41 N 0.89 0.45 -0.51 2.37 4.81 -0.90 -0.34 114.58 121.35 1jm0 h GLU 41 Ca 0.20 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.38 1jm0 h GLU 41 Cb 0.26 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1jm0 h GLU 41 CO -0.01 0.30 0.21 -1.49 -0.73 0.00 0.00 179.01 177.29 1jm0 h TRP 42 N 0.46 0.76 -0.65 0.92 6.55 -0.91 -0.91 115.95 122.17 1jm0 h TRP 42 Ca 0.17 -0.05 -0.08 0.00 0.95 0.00 0.00 58.89 59.87 1jm0 h TRP 42 Cb 0.03 -0.23 -0.03 0.00 -0.86 0.00 0.00 29.16 28.08 1jm0 h TRP 42 CO -0.08 0.62 0.08 -0.07 -1.05 0.00 0.00 178.44 177.94 1jm0 h LEU 43 N 0.68 1.05 -1.42 -4.49 3.38 -0.84 -0.65 115.31 113.01 1jm0 h LEU 43 Ca 0.17 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1jm0 h LEU 43 Cb 0.17 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1jm0 h LEU 43 CO -0.02 1.05 0.36 -0.33 0.09 0.00 0.00 178.44 179.60 1jm0 h GLU 44 N 1.01 0.75 -0.17 1.13 5.08 -0.88 -0.25 114.58 121.24 1jm0 h GLU 44 Ca 0.19 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1jm0 h GLU 44 Cb 0.47 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 1jm0 h GLU 44 CO 0.02 0.51 -0.19 1.15 -1.00 0.00 0.00 179.01 179.49 1jm0 h THR 45 N 0.77 1.34 -0.32 1.13 2.02 -0.40 -2.53 112.91 114.93 1jm0 h THR 45 Ca 0.20 -1.37 0.05 0.00 0.77 0.00 0.00 66.41 66.07 1jm0 h THR 45 Cb -0.06 1.84 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 1jm0 h THR 45 CO -0.04 0.41 0.22 0.40 0.37 0.00 0.00 175.52 176.88 1jm0 h ILE 46 N 0.09 0.94 -0.04 3.11 2.04 -0.66 0.57 117.51 123.56 1jm0 h ILE 46 Ca 0.03 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1jm0 h ILE 46 Cb 0.74 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1jm0 h ILE 46 CO 0.05 0.04 0.00 0.18 0.00 0.00 0.00 178.15 178.41 1jm0 n LEU 47 N -4.48 0.45 0.00 1.44 4.77 -0.15 -5.10 117.00 113.93 1jm0 n LEU 47 Ca 0.04 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1jm0 n LEU 47 Cb 0.25 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1jm0 n LEU 47 CO 0.35 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.11