#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 0.86 -0.38 1.24 -0.00 -2.05 -0.20 116.97 116.44 1jm0 h TYR 2 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 58.73 58.54 1jm0 h TYR 2 Cb 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 36.73 36.48 1jm0 h TYR 2 CO 0.00 0.78 -0.04 -0.07 -0.00 0.00 0.00 178.16 178.83 1jm0 h LEU 3 N 0.76 0.70 -1.44 0.10 3.38 -2.01 -1.91 115.31 114.89 1jm0 h LEU 3 Ca 0.15 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1jm0 h LEU 3 Cb 0.43 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1jm0 h LEU 3 CO 0.02 0.87 0.15 0.03 0.09 0.00 0.00 178.44 179.60 1jm0 h ARG 4 N 0.52 0.53 -0.29 1.13 3.08 -1.86 0.36 114.38 117.84 1jm0 h ARG 4 Ca 0.10 -0.06 -0.19 0.00 0.07 0.00 0.00 59.98 59.90 1jm0 h ARG 4 Cb 0.54 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1jm0 h ARG 4 CO 0.03 0.44 -0.56 0.93 -1.07 0.00 0.00 179.97 179.74 1jm0 h GLU 5 N 0.53 0.89 -0.50 0.04 4.39 -0.90 -1.35 114.58 117.68 1jm0 h GLU 5 Ca 0.13 -0.57 -0.04 0.00 0.34 0.00 0.00 59.36 59.22 1jm0 h GLU 5 Cb 0.11 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.81 1jm0 h GLU 5 CO -0.01 1.20 0.14 -0.07 -1.16 0.00 0.00 179.01 179.11 1jm0 h LEU 6 N 0.67 0.74 -0.70 1.33 3.38 -0.85 -1.24 115.31 118.65 1jm0 h LEU 6 Ca 0.01 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.80 1jm0 h LEU 6 Cb 1.17 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.68 1jm0 h LEU 6 CO 0.12 0.77 0.43 0.25 0.09 0.00 0.00 178.44 180.10 1jm0 h LEU 7 N 0.68 0.69 -0.46 1.67 5.85 -0.78 -1.15 115.31 121.80 1jm0 h LEU 7 Ca 0.16 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.92 1jm0 h LEU 7 Cb 0.31 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 1jm0 h LEU 7 CO -0.00 0.47 0.25 0.50 -0.34 0.00 0.00 178.44 179.31 1jm0 h LYS 8 N 0.82 0.48 -0.37 1.25 3.64 -0.89 -1.00 116.57 120.51 1jm0 h LYS 8 Ca 0.29 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.70 1jm0 h LYS 8 Cb 0.06 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.72 1jm0 h LYS 8 CO -0.13 0.32 0.03 -0.07 -2.27 0.00 0.00 179.45 177.34 1jm0 h LEU 9 N 0.50 -0.08 -0.62 5.20 3.38 -0.38 -1.43 115.31 121.89 1jm0 h LEU 9 Ca 0.19 0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.20 1jm0 h LEU 9 Cb 0.07 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1jm0 h LEU 9 CO -0.12 -0.00 0.23 -0.33 0.09 0.00 0.00 178.44 178.31 1jm0 h GLU 10 N 0.14 0.93 -0.59 1.13 4.39 -0.61 -0.43 114.58 119.54 1jm0 h GLU 10 Ca 0.18 -0.18 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1jm0 h GLU 10 Cb 0.23 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1jm0 h GLU 10 CO -0.27 0.80 0.05 -0.07 -1.16 0.00 0.00 179.01 178.36 1jm0 h LEU 11 N 0.87 0.96 -0.66 1.33 3.38 -0.98 -1.34 115.31 118.87 1jm0 h LEU 11 Ca 0.20 -0.24 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 1jm0 h LEU 11 Cb 0.23 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1jm0 h LEU 11 CO -0.01 0.99 -0.30 1.56 0.09 0.00 0.00 178.44 180.77 1jm0 h GLN 12 N 0.93 0.72 0.00 1.13 4.20 -0.99 -3.29 115.11 117.81 1jm0 h GLN 12 Ca 0.18 -0.32 -0.19 0.00 0.06 0.00 0.00 58.65 58.37 1jm0 h GLN 12 Cb 0.47 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1jm0 h GLN 12 CO 0.02 0.93 -0.86 0.00 -0.67 0.00 0.00 178.83 178.25 1jm0 h ALA 13 N 1.05 0.56 0.00 3.87 0.00 -0.79 -2.97 119.26 120.98 1jm0 h ALA 13 Ca 0.07 -0.72 -0.04 0.00 0.00 0.00 0.00 54.91 54.21 1jm0 h ALA 13 Cb 0.81 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1jm0 h ALA 13 CO 0.07 0.94 -0.20 0.97 0.00 0.00 0.00 179.25 181.02 1jm0 h ILE 14 N 0.08 0.80 0.00 0.00 2.10 -1.31 0.17 117.51 119.35 1jm0 h ILE 14 Ca -0.03 -0.81 -0.04 0.00 1.08 0.00 0.00 64.86 65.06 1jm0 h ILE 14 Cb 1.48 1.49 -0.01 0.00 -1.09 0.00 0.00 36.82 38.69 1jm0 h ILE 14 CO 0.13 0.20 -0.17 0.50 -1.08 0.00 0.00 178.15 177.72 1jm0 h LYS 15 N 0.00 0.00 0.13 2.19 3.64 -1.61 -0.25 116.57 120.67 1jm0 h LYS 15 Ca -0.00 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.09 1jm0 h LYS 15 Cb 0.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1jm0 h LYS 15 CO 0.03 0.17 -1.37 1.96 -2.27 0.00 0.00 179.45 177.97 1jm0 h GLN 16 N 0.00 0.28 -0.51 1.90 1.08 -0.70 -2.93 115.11 114.23 1jm0 h GLN 16 Ca -0.00 -0.47 -0.10 0.00 -1.45 0.00 0.00 58.65 56.63 1jm0 h GLN 16 Cb 0.84 0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 28.42 1jm0 h GLN 16 CO 0.02 1.19 -0.08 1.88 -0.95 0.00 0.00 178.83 180.89 1jm0 h TYR 17 N 0.08 1.06 -0.59 2.96 -1.99 -0.91 -1.50 116.97 116.08 1jm0 h TYR 17 Ca -0.18 -0.21 0.01 0.00 2.00 0.00 0.00 58.73 60.35 1jm0 h TYR 17 Cb 2.00 -0.26 -0.03 0.00 2.00 0.00 0.00 36.73 40.43 1jm0 h TYR 17 CO 0.07 1.00 0.38 0.00 -0.00 0.00 0.00 178.16 179.61 1jm0 h ARG 18 N 0.81 0.75 -0.58 4.88 3.08 -1.15 -0.00 114.38 122.18 1jm0 h ARG 18 Ca 0.13 -0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.22 1jm0 h ARG 18 Cb 0.64 -0.17 -0.07 0.00 0.08 0.00 0.00 29.97 30.45 1jm0 h ARG 18 CO 0.04 0.49 0.21 1.49 -1.07 0.00 0.00 179.97 181.14 1jm0 h GLU 19 N 0.77 0.39 -0.44 0.04 4.81 -1.38 -1.05 114.58 117.72 1jm0 h GLU 19 Ca 0.22 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.35 1jm0 h GLU 19 Cb -0.06 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 1jm0 h GLU 19 CO -0.06 0.26 -0.04 0.00 -0.73 0.00 0.00 179.01 178.43 1jm0 h ALA 20 N 1.39 1.12 -0.15 2.92 0.00 -0.69 -2.71 119.26 121.14 1jm0 h ALA 20 Ca 0.28 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1jm0 h ALA 20 Cb 0.33 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1jm0 h ALA 20 CO -0.28 0.56 -0.46 1.25 0.00 0.00 0.00 179.25 180.32 1jm0 h LEU 21 N 0.68 0.39 -1.46 0.00 7.12 -0.37 -0.43 115.31 121.24 1jm0 h LEU 21 Ca 0.13 -0.18 0.02 0.00 0.13 0.00 0.00 57.88 57.97 1jm0 h LEU 21 Cb 0.47 -0.11 -0.03 0.00 -0.53 0.00 0.00 40.66 40.46 1jm0 h LEU 21 CO 0.02 0.80 0.38 -0.33 -0.13 0.00 0.00 178.44 179.18 1jm0 h GLU 22 N 0.30 0.71 0.02 1.25 4.39 -0.91 -3.14 114.58 117.19 1jm0 h GLU 22 Ca 0.02 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 1jm0 h GLU 22 Cb 0.92 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 1jm0 h GLU 22 CO 0.08 0.47 -0.15 -0.92 -1.16 0.00 0.00 179.01 177.32 1jm0 h TYR 23 N 0.73 0.12 -3.13 4.33 3.20 -1.17 -3.45 116.97 117.60 1jm0 h TYR 23 Ca 0.22 -0.08 -0.34 0.00 3.14 0.00 0.00 58.73 61.67 1jm0 h TYR 23 Cb -0.02 -0.01 -0.37 0.00 1.54 0.00 0.00 36.73 37.87 1jm0 h TYR 23 CO -0.00 0.97 -0.68 0.54 -1.64 0.00 0.00 178.16 177.35 1jm0 s VAL 24 N -2.64 -0.20 -1.55 1.81 0.11 -0.21 -5.04 120.40 112.68 1jm0 s VAL 24 Ca -0.17 0.31 -0.12 0.00 -2.93 0.00 0.00 61.98 59.07 1jm0 s VAL 24 Cb -0.01 -0.29 -0.03 0.00 -1.53 0.00 0.00 36.38 34.52 1jm0 s VAL 24 CO 0.72 0.10 2.64 1.17 -3.33 0.00 0.00 175.10 176.40 1jm0 n LYS 25 N 5.31 3.33 -2.73 1.54 4.81 -1.22 -4.33 118.16 124.86 1jm0 n LYS 25 Ca -0.04 -2.37 -0.42 0.00 -0.87 0.00 0.00 58.31 54.60 1jm0 n LYS 25 Cb 0.50 -3.01 -0.03 0.00 0.02 0.00 0.00 35.03 32.51 1jm0 n LYS 25 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1jm0 s LEU 26 N 1.06 4.27 0.34 3.14 1.43 -1.26 -4.95 118.68 122.70 1jm0 s LEU 26 Ca 0.60 1.50 0.12 0.00 -1.03 0.00 0.00 54.13 55.31 1jm0 s LEU 26 Cb 0.16 -3.50 0.94 0.00 0.03 0.00 0.00 46.19 43.83 1jm0 s LEU 26 CO -0.07 -0.39 1.74 -0.65 0.23 0.00 0.00 176.35 177.21 1jm0 h PRO 27 N 7.05 0.52 -0.36 1.29 0.11 -2.00 -0.89 132.00 137.72 1jm0 h PRO 27 Ca -0.33 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.63 1jm0 h PRO 27 Cb 1.16 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1jm0 h PRO 27 CO 0.83 0.34 -0.23 -0.24 -0.21 0.00 0.00 178.00 178.49 1jm0 h VAL 28 N 0.53 1.27 -0.50 3.15 3.04 -1.98 -1.31 116.25 120.45 1jm0 h VAL 28 Ca 0.64 -1.33 -0.04 0.00 -1.01 0.00 0.00 66.70 64.95 1jm0 h VAL 28 Cb 1.30 1.24 -0.02 0.00 -2.01 0.00 0.00 31.29 31.80 1jm0 h VAL 28 CO -0.43 0.44 0.14 -0.07 -1.01 0.00 0.00 177.57 176.63 1jm0 h LEU 29 N 0.63 0.69 -1.02 3.16 3.38 -1.56 -1.45 115.31 119.14 1jm0 h LEU 29 Ca 0.09 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1jm0 h LEU 29 Cb 0.73 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1jm0 h LEU 29 CO 0.06 0.67 0.31 0.00 0.09 0.00 0.00 178.44 179.56 1jm0 h ALA 30 N 1.43 1.23 -0.63 1.53 0.00 -0.90 -0.98 119.26 120.94 1jm0 h ALA 30 Ca 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1jm0 h ALA 30 Cb 0.24 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1jm0 h ALA 30 CO -0.01 0.58 0.34 0.87 0.00 0.00 0.00 179.25 181.04 1jm0 h LYS 31 N 1.00 0.87 -0.18 0.00 1.57 -0.76 -1.54 116.57 117.53 1jm0 h LYS 31 Ca 0.24 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1jm0 h LYS 31 Cb 0.14 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1jm0 h LYS 31 CO -0.03 0.66 0.09 0.82 -0.57 0.00 0.00 179.45 180.42 1jm0 h ILE 32 N 0.85 1.13 -0.59 1.86 2.04 -0.70 -2.29 117.51 119.82 1jm0 h ILE 32 Ca 0.22 -0.38 0.10 0.00 1.00 0.00 0.00 64.86 65.80 1jm0 h ILE 32 Cb 0.04 1.04 -0.07 0.00 -0.74 0.00 0.00 36.82 37.09 1jm0 h ILE 32 CO -0.04 0.12 0.19 0.25 0.00 0.00 0.00 178.15 178.68 1jm0 h LEU 33 N 0.17 0.16 -1.15 1.44 7.12 -0.91 -0.61 115.31 121.53 1jm0 h LEU 33 Ca 0.06 0.08 0.02 0.00 0.13 0.00 0.00 57.88 58.18 1jm0 h LEU 33 Cb 0.12 0.08 -0.05 0.00 -0.53 0.00 0.00 40.66 40.29 1jm0 h LEU 33 CO -0.01 0.10 0.58 -0.33 -0.13 0.00 0.00 178.44 178.65 1jm0 h GLU 34 N 0.36 1.11 -0.65 1.25 4.39 -0.99 -0.50 114.58 119.55 1jm0 h GLU 34 Ca 0.30 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.88 1jm0 h GLU 34 Cb 0.39 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 1jm0 h GLU 34 CO -0.32 0.74 0.18 -0.44 -1.16 0.00 0.00 179.01 178.01 1jm0 h ASP 35 N 1.15 0.94 0.06 1.42 3.32 -0.71 -1.75 116.42 120.86 1jm0 h ASP 35 Ca 0.33 -0.18 -0.17 0.00 0.02 0.00 0.00 57.03 57.04 1jm0 h ASP 35 Cb -0.06 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.24 1jm0 h ASP 35 CO -0.09 0.90 -0.61 -0.33 -1.72 0.00 0.00 179.24 177.39 1jm0 h GLU 36 N 0.97 0.54 -0.94 3.56 4.39 -0.34 -0.52 114.58 122.25 1jm0 h GLU 36 Ca 0.21 -0.37 0.04 0.00 0.34 0.00 0.00 59.36 59.58 1jm0 h GLU 36 Cb 0.31 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.96 1jm0 h GLU 36 CO -0.00 0.99 0.62 0.93 -1.16 0.00 0.00 179.01 180.38 1jm0 h GLU 37 N 0.40 1.14 -0.64 2.33 5.08 -0.88 -1.36 114.58 120.65 1jm0 h GLU 37 Ca -0.01 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 1jm0 h GLU 37 Cb 1.17 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 1jm0 h GLU 37 CO 0.11 0.75 0.21 -0.22 -1.00 0.00 0.00 179.01 178.87 1jm0 h LYS 38 N 1.17 0.99 -0.70 2.33 3.64 -0.51 -1.41 116.57 122.07 1jm0 h LYS 38 Ca 0.38 -0.21 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1jm0 h LYS 38 Cb 0.03 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.67 1jm0 h LYS 38 CO -0.12 0.86 0.47 0.45 -2.27 0.00 0.00 179.45 178.84 1jm0 h HIS 39 N 0.92 0.88 -0.27 1.91 3.86 -0.53 0.13 115.15 122.05 1jm0 h HIS 39 Ca 0.21 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.39 1jm0 h HIS 39 Cb 0.27 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 1jm0 h HIS 39 CO 0.02 0.55 -0.04 0.82 0.86 0.00 0.00 177.93 180.14 1jm0 h ILE 40 N 0.95 1.27 -0.75 2.45 2.04 -0.98 -0.82 117.51 121.66 1jm0 h ILE 40 Ca 0.26 -1.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.07 1jm0 h ILE 40 Cb -0.10 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1jm0 h ILE 40 CO -0.06 0.32 0.31 -0.08 0.00 0.00 0.00 178.15 178.64 1jm0 h GLU 41 N 0.26 1.12 0.07 2.37 4.57 -0.77 0.83 114.58 123.03 1jm0 h GLU 41 Ca 0.07 -0.20 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1jm0 h GLU 41 Cb 0.49 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.88 1jm0 h GLU 41 CO 0.02 0.91 -0.07 -1.49 -1.18 0.00 0.00 179.01 177.20 1jm0 h TRP 42 N 1.08 -0.18 -0.54 0.92 6.55 -0.57 -0.06 115.95 123.15 1jm0 h TRP 42 Ca 0.25 0.00 -0.04 0.00 0.95 0.00 0.00 58.89 60.05 1jm0 h TRP 42 Cb 0.20 0.07 -0.02 0.00 -0.86 0.00 0.00 29.16 28.54 1jm0 h TRP 42 CO 0.02 -0.11 0.17 -0.07 -1.05 0.00 0.00 178.44 177.40 1jm0 h LEU 43 N -0.16 0.79 -0.51 -4.49 3.38 -0.87 -1.88 115.31 111.58 1jm0 h LEU 43 Ca 0.00 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1jm0 h LEU 43 Cb 0.15 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1jm0 h LEU 43 CO -0.02 0.78 0.25 -0.33 0.09 0.00 0.00 178.44 179.21 1jm0 h GLU 44 N 0.75 0.72 -0.55 1.13 5.08 -0.74 -1.66 114.58 119.31 1jm0 h GLU 44 Ca 0.17 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1jm0 h GLU 44 Cb 0.28 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 1jm0 h GLU 44 CO -0.01 0.60 0.34 1.15 -1.00 0.00 0.00 179.01 180.09 1jm0 h THR 45 N 0.67 1.16 0.00 1.13 2.02 -0.68 -2.11 112.91 115.11 1jm0 h THR 45 Ca 0.17 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1jm0 h THR 45 Cb 0.11 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1jm0 h THR 45 CO -0.02 0.17 0.00 0.16 0.37 0.00 0.00 175.52 176.19 1jm0 h ILE 46 N 0.74 0.00 -0.01 3.11 3.07 -1.14 -1.45 117.51 121.84 1jm0 h ILE 46 Ca 0.20 -0.65 0.00 0.00 1.55 0.00 0.00 64.86 65.96 1jm0 h ILE 46 Cb -0.02 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 38.15 1jm0 h ILE 46 CO -0.04 0.00 -0.00 0.18 -1.05 0.00 0.00 178.15 177.24 1jm0 n LEU 47 N -2.90 0.61 0.00 0.16 4.77 -0.64 -5.11 117.00 113.88 1jm0 n LEU 47 Ca 0.03 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1jm0 n LEU 47 Cb 0.39 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1jm0 n LEU 47 CO 0.29 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.06