#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 0.66 -0.01 1.24 -0.00 -2.06 0.29 116.97 117.09 1jm0 h TYR 2 Ca 0.00 0.02 -0.23 0.00 0.00 0.00 0.00 58.73 58.52 1jm0 h TYR 2 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 36.73 36.51 1jm0 h TYR 2 CO 0.00 0.40 -0.93 -0.07 -0.00 0.00 0.00 178.16 177.56 1jm0 h LEU 3 N 0.70 0.59 -1.78 0.10 3.38 -1.99 -2.53 115.31 113.78 1jm0 h LEU 3 Ca 0.21 -0.46 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1jm0 h LEU 3 Cb -0.01 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1jm0 h LEU 3 CO -0.05 1.26 -0.16 0.03 0.09 0.00 0.00 178.44 179.61 1jm0 h ARG 4 N 0.27 0.00 -0.01 1.13 3.08 -1.79 -0.22 114.38 116.84 1jm0 h ARG 4 Ca -0.08 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1jm0 h ARG 4 Cb 1.57 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.62 1jm0 h ARG 4 CO 0.17 0.16 -0.00 0.93 -1.07 0.00 0.00 179.97 180.15 1jm0 h GLU 5 N 0.00 0.02 -0.66 0.04 5.08 -0.72 -1.03 114.58 117.31 1jm0 h GLU 5 Ca -0.00 -0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.47 1jm0 h GLU 5 Cb 0.36 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.52 1jm0 h GLU 5 CO 0.02 0.41 0.19 -0.07 -1.00 0.00 0.00 179.01 178.56 1jm0 h LEU 6 N -0.37 0.10 -0.81 1.33 3.38 -1.22 -0.60 115.31 117.12 1jm0 h LEU 6 Ca 0.00 0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1jm0 h LEU 6 Cb 0.40 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1jm0 h LEU 6 CO 0.00 0.04 0.29 0.25 0.09 0.00 0.00 178.44 179.11 1jm0 h LEU 7 N 0.33 1.08 -0.45 1.67 5.85 -0.98 -0.51 115.31 122.30 1jm0 h LEU 7 Ca 0.35 -0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.94 1jm0 h LEU 7 Cb 0.52 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1jm0 h LEU 7 CO -0.40 0.97 0.19 0.50 -0.34 0.00 0.00 178.44 179.36 1jm0 h LYS 8 N 1.13 0.38 -0.31 1.25 3.64 -0.43 0.03 116.57 122.26 1jm0 h LYS 8 Ca 0.25 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.53 1jm0 h LYS 8 Cb 0.25 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 1jm0 h LYS 8 CO -0.02 0.25 -0.17 -0.07 -2.27 0.00 0.00 179.45 177.17 1jm0 h LEU 9 N 0.39 0.55 -0.25 5.20 3.38 -0.50 -0.31 115.31 123.77 1jm0 h LEU 9 Ca 0.20 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1jm0 h LEU 9 Cb 0.16 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1jm0 h LEU 9 CO -0.18 0.74 0.12 -0.33 0.09 0.00 0.00 178.44 178.88 1jm0 h GLU 10 N 0.50 0.36 -0.49 1.13 4.39 -0.44 -1.80 114.58 118.24 1jm0 h GLU 10 Ca 0.08 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 1jm0 h GLU 10 Cb 0.58 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 1jm0 h GLU 10 CO 0.04 0.37 0.21 -0.07 -1.16 0.00 0.00 179.01 178.40 1jm0 h LEU 11 N 0.27 0.66 -0.44 1.33 3.38 -0.67 -0.23 115.31 119.61 1jm0 h LEU 11 Ca 0.09 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 57.97 1jm0 h LEU 11 Cb 0.13 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 1jm0 h LEU 11 CO -0.01 0.63 0.11 -0.61 0.09 0.00 0.00 178.44 178.66 1jm0 h GLN 12 N 0.64 0.25 -0.62 1.13 4.15 -0.95 -2.43 115.11 117.29 1jm0 h GLN 12 Ca 0.16 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.55 1jm0 h GLN 12 Cb 0.17 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 1jm0 h GLN 12 CO -0.02 0.17 0.31 0.00 -1.93 0.00 0.00 178.83 177.36 1jm0 h ALA 13 N 1.32 0.79 -0.94 3.38 0.00 -0.48 -1.99 119.26 121.35 1jm0 h ALA 13 Ca 0.21 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1jm0 h ALA 13 Cb 0.25 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 17.73 1jm0 h ALA 13 CO -0.26 0.35 0.60 0.82 0.00 0.00 0.00 179.25 180.76 1jm0 h ILE 14 N 0.84 1.00 -0.51 0.00 2.04 -0.79 0.94 117.51 121.03 1jm0 h ILE 14 Ca 0.21 -0.34 -0.03 0.00 1.00 0.00 0.00 64.86 65.71 1jm0 h ILE 14 Cb 0.10 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.09 1jm0 h ILE 14 CO -0.03 0.18 0.21 0.50 0.00 0.00 0.00 178.15 179.01 1jm0 h LYS 15 N 0.98 0.76 -0.23 2.37 3.64 -0.88 -0.57 116.57 122.63 1jm0 h LYS 15 Ca 0.43 -0.13 -0.19 0.00 -1.27 0.00 0.00 60.65 59.49 1jm0 h LYS 15 Cb 0.34 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1jm0 h LYS 15 CO -0.19 0.67 -0.60 1.96 -2.27 0.00 0.00 179.45 179.02 1jm0 h GLN 16 N 0.68 0.78 -0.57 1.90 1.08 -1.04 -1.98 115.11 115.96 1jm0 h GLN 16 Ca 0.17 -0.52 -0.03 0.00 -1.45 0.00 0.00 58.65 56.82 1jm0 h GLN 16 Cb 0.18 0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.66 1jm0 h GLN 16 CO -0.02 1.15 0.23 1.88 -0.95 0.00 0.00 178.83 181.12 1jm0 h TYR 17 N 0.58 0.86 -0.69 2.96 -1.99 -0.62 -1.85 116.97 116.21 1jm0 h TYR 17 Ca -0.00 -0.06 -0.06 0.00 2.00 0.00 0.00 58.73 60.61 1jm0 h TYR 17 Cb 1.20 -0.26 -0.03 0.00 2.00 0.00 0.00 36.73 39.64 1jm0 h TYR 17 CO 0.07 0.69 0.21 0.00 -0.00 0.00 0.00 178.16 179.13 1jm0 h ARG 18 N 0.77 1.07 0.32 4.88 3.08 -1.08 -1.97 114.38 121.46 1jm0 h ARG 18 Ca 0.19 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1jm0 h ARG 18 Cb 0.19 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1jm0 h ARG 18 CO -0.02 0.91 -0.19 0.93 -1.07 0.00 0.00 179.97 180.53 1jm0 h GLU 19 N 1.03 -0.48 -0.39 0.04 5.08 -1.06 -2.48 114.58 116.32 1jm0 h GLU 19 Ca 0.23 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.69 1jm0 h GLU 19 Cb 0.29 0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.56 1jm0 h GLU 19 CO -0.01 -0.32 -0.41 0.00 -1.00 0.00 0.00 179.01 177.28 1jm0 h ALA 20 N 0.17 -0.38 0.00 3.43 0.00 -1.10 -1.31 119.26 120.06 1jm0 h ALA 20 Ca -0.03 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1jm0 h ALA 20 Cb 0.40 0.85 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1jm0 h ALA 20 CO 0.04 -0.84 0.00 1.28 0.00 0.00 0.00 179.25 179.73 1jm0 n LEU 21 N -5.42 0.00 0.18 0.00 4.77 -0.76 -0.53 117.00 115.24 1jm0 n LEU 21 Ca -0.00 0.47 0.12 0.00 -0.03 0.00 0.00 56.01 56.57 1jm0 n LEU 21 Cb 0.35 -0.47 0.12 0.00 -2.33 0.00 0.00 43.42 41.09 1jm0 n LEU 21 CO 0.05 -0.41 0.56 1.05 -1.33 0.00 0.00 177.39 177.31 1jm0 h GLU 22 N 0.00 0.00 0.01 3.23 4.11 -0.77 -3.37 114.58 117.80 1jm0 h GLU 22 Ca 0.00 0.00 -0.38 0.00 0.07 0.00 0.00 59.36 59.05 1jm0 h GLU 22 Cb 0.06 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 1jm0 h GLU 22 CO 0.00 0.00 -2.41 0.98 0.07 0.00 0.00 179.01 177.65 1jm0 n TYR 23 N -2.96 0.14 -4.31 2.06 9.36 0.31 -4.99 117.16 116.78 1jm0 n TYR 23 Ca 0.03 0.03 -0.18 0.00 3.32 0.00 0.00 57.90 61.10 1jm0 n TYR 23 Cb 0.54 -1.02 -0.14 0.00 -0.63 0.00 0.00 39.34 38.09 1jm0 n TYR 23 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1jm0 s VAL 24 N -2.52 0.78 -0.84 2.97 0.11 -0.45 -5.08 120.40 115.36 1jm0 s VAL 24 Ca -0.30 -0.66 -0.17 0.00 -2.93 0.00 0.00 61.98 57.93 1jm0 s VAL 24 Cb 0.08 -0.70 0.17 0.00 -1.53 0.00 0.00 36.38 34.40 1jm0 s VAL 24 CO 0.65 0.05 0.91 -0.54 -3.33 0.00 0.00 175.10 172.84 1jm0 s LYS 25 N -0.68 3.54 -0.27 1.54 3.01 -1.26 -4.06 119.74 121.56 1jm0 s LYS 25 Ca 0.01 -2.04 -0.04 0.00 -1.01 0.00 0.00 55.97 52.89 1jm0 s LYS 25 Cb -0.06 -4.61 0.02 0.00 -1.01 0.00 0.00 37.83 32.17 1jm0 s LYS 25 CO 0.00 -1.52 0.01 -0.51 0.51 0.00 0.00 175.35 173.84 1jm0 s LEU 26 N 1.50 3.54 0.42 3.17 1.43 -1.26 -5.00 118.68 122.48 1jm0 s LEU 26 Ca 0.23 -0.83 0.10 0.00 -1.03 0.00 0.00 54.13 52.60 1jm0 s LEU 26 Cb -0.10 -1.76 0.93 0.00 0.03 0.00 0.00 46.19 45.29 1jm0 s LEU 26 CO -0.07 -0.17 2.01 -0.65 0.23 0.00 0.00 176.35 177.70 1jm0 h PRO 27 N 8.11 0.49 -0.88 1.29 0.11 -2.00 -1.48 132.00 137.64 1jm0 h PRO 27 Ca -0.31 -0.03 0.11 0.00 0.11 0.00 0.00 66.00 65.88 1jm0 h PRO 27 Cb 1.11 -0.11 -0.08 0.00 0.11 0.00 0.00 31.00 32.03 1jm0 h PRO 27 CO 0.58 0.32 0.51 -0.24 -0.21 0.00 0.00 178.00 178.97 1jm0 h VAL 28 N 0.51 0.89 -0.40 3.15 3.04 -1.99 -0.31 116.25 121.14 1jm0 h VAL 28 Ca 0.23 -0.29 -0.13 0.00 -1.01 0.00 0.00 66.70 65.50 1jm0 h VAL 28 Cb 0.27 -0.01 -0.01 0.00 -2.01 0.00 0.00 31.29 29.52 1jm0 h VAL 28 CO -0.06 0.15 -0.28 -0.07 -1.01 0.00 0.00 177.57 176.30 1jm0 h LEU 29 N 0.83 0.88 -1.42 3.16 3.38 -1.70 -0.86 115.31 119.58 1jm0 h LEU 29 Ca 0.43 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1jm0 h LEU 29 Cb 0.43 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1jm0 h LEU 29 CO -0.26 1.10 0.43 0.00 0.09 0.00 0.00 178.44 179.80 1jm0 h ALA 30 N 0.96 1.68 -0.00 1.53 0.00 -1.16 0.06 119.26 122.32 1jm0 h ALA 30 Ca 0.09 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.71 1jm0 h ALA 30 Cb 0.83 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.43 1jm0 h ALA 30 CO 0.07 0.23 -1.03 -0.22 0.00 0.00 0.00 179.25 178.31 1jm0 h LYS 31 N 0.73 0.67 -0.45 0.00 1.63 -0.76 -1.77 116.57 116.63 1jm0 h LYS 31 Ca 0.27 -0.72 -0.02 0.00 -0.85 0.00 0.00 60.65 59.33 1jm0 h LYS 31 Cb 0.14 0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 31.96 1jm0 h LYS 31 CO -0.08 1.30 0.21 0.82 -3.45 0.00 0.00 179.45 178.25 1jm0 h ILE 32 N 0.38 1.19 -0.78 2.00 2.04 -0.71 -1.63 117.51 119.99 1jm0 h ILE 32 Ca -0.12 -0.54 0.14 0.00 1.00 0.00 0.00 64.86 65.34 1jm0 h ILE 32 Cb 1.68 0.72 -0.09 0.00 -0.74 0.00 0.00 36.82 38.38 1jm0 h ILE 32 CO 0.20 0.21 0.35 0.25 0.00 0.00 0.00 178.15 179.15 1jm0 h LEU 33 N 0.58 0.37 -0.71 1.44 6.46 -0.97 -0.71 115.31 121.77 1jm0 h LEU 33 Ca 0.15 0.10 -0.00 0.00 -0.12 0.00 0.00 57.88 58.01 1jm0 h LEU 33 Cb 0.13 0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 1jm0 h LEU 33 CO -0.02 0.15 0.43 -0.08 -0.62 0.00 0.00 178.44 178.31 1jm0 h GLU 34 N 0.51 0.97 -0.62 1.25 4.81 -0.86 -1.36 114.58 119.28 1jm0 h GLU 34 Ca 0.43 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.59 1jm0 h GLU 34 Cb 0.62 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.76 1jm0 h GLU 34 CO -0.38 0.68 0.39 -0.44 -0.73 0.00 0.00 179.01 178.53 1jm0 h ASP 35 N 0.97 0.65 0.33 1.04 3.32 -0.28 -1.72 116.42 120.73 1jm0 h ASP 35 Ca 0.26 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.19 1jm0 h ASP 35 Cb -0.04 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1jm0 h ASP 35 CO -0.05 0.45 -0.47 -0.33 -1.72 0.00 0.00 179.24 177.12 1jm0 h GLU 36 N 0.78 0.17 -0.59 3.56 4.39 -0.61 -0.08 114.58 122.19 1jm0 h GLU 36 Ca 0.25 -0.09 -0.07 0.00 0.34 0.00 0.00 59.36 59.79 1jm0 h GLU 36 Cb -0.00 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 1jm0 h GLU 36 CO -0.09 0.61 0.10 0.93 -1.16 0.00 0.00 179.01 179.40 1jm0 h GLU 37 N 0.14 0.95 -0.40 2.33 5.08 -0.95 -0.77 114.58 120.96 1jm0 h GLU 37 Ca 0.01 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.13 1jm0 h GLU 37 Cb 0.89 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1jm0 h GLU 37 CO 0.07 0.87 0.20 -0.22 -1.00 0.00 0.00 179.01 178.93 1jm0 h LYS 38 N 0.90 0.57 -0.59 2.33 3.64 -0.76 -2.17 116.57 120.49 1jm0 h LYS 38 Ca 0.18 -0.08 0.11 0.00 -1.27 0.00 0.00 60.65 59.59 1jm0 h LYS 38 Cb 0.38 -0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 32.02 1jm0 h LYS 38 CO 0.01 0.49 0.13 0.45 -2.27 0.00 0.00 179.45 178.26 1jm0 h HIS 39 N 0.51 0.21 -0.26 1.91 3.86 -0.61 -1.03 115.15 119.74 1jm0 h HIS 39 Ca 0.14 0.04 0.02 0.00 -1.16 0.00 0.00 60.37 59.41 1jm0 h HIS 39 Cb 0.10 -0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.54 1jm0 h HIS 39 CO -0.02 -0.02 0.10 0.82 0.86 0.00 0.00 177.93 179.67 1jm0 h ILE 40 N 0.27 0.95 -0.79 2.45 2.04 -0.87 -0.36 117.51 121.20 1jm0 h ILE 40 Ca 0.31 -0.08 0.05 0.00 1.00 0.00 0.00 64.86 66.15 1jm0 h ILE 40 Cb 0.45 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.18 1jm0 h ILE 40 CO -0.39 0.04 0.49 -0.33 0.00 0.00 0.00 178.15 177.96 1jm0 h GLU 41 N 0.22 0.88 -0.56 2.37 5.08 -0.82 0.15 114.58 121.89 1jm0 h GLU 41 Ca 0.11 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1jm0 h GLU 41 Cb 0.07 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1jm0 h GLU 41 CO -0.10 0.58 -0.01 -1.49 -1.00 0.00 0.00 179.01 176.99 1jm0 h TRP 42 N 0.90 1.09 -0.45 4.33 6.55 -0.92 -1.33 115.95 126.12 1jm0 h TRP 42 Ca 0.34 -0.19 -0.09 0.00 0.95 0.00 0.00 58.89 59.90 1jm0 h TRP 42 Cb 0.14 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 28.14 1jm0 h TRP 42 CO -0.04 0.98 -0.07 -0.07 -1.05 0.00 0.00 178.44 178.19 1jm0 h LEU 43 N 0.88 0.85 -1.34 -4.49 3.38 -0.59 -1.77 115.31 112.23 1jm0 h LEU 43 Ca 0.16 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.80 1jm0 h LEU 43 Cb 0.55 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 1jm0 h LEU 43 CO 0.03 0.99 0.46 -0.33 0.09 0.00 0.00 178.44 179.68 1jm0 h GLU 44 N 0.69 0.87 -0.57 1.13 5.08 -0.41 -0.42 114.58 120.94 1jm0 h GLU 44 Ca 0.12 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 1jm0 h GLU 44 Cb 0.60 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1jm0 h GLU 44 CO 0.04 0.58 0.01 1.15 -1.00 0.00 0.00 179.01 179.78 1jm0 h THR 45 N 0.90 1.26 0.00 1.13 2.02 -0.78 -2.16 112.91 115.29 1jm0 h THR 45 Ca 0.26 -1.11 -0.08 0.00 0.77 0.00 0.00 66.41 66.25 1jm0 h THR 45 Cb -0.05 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1jm0 h THR 45 CO -0.06 0.40 -0.40 0.40 0.37 0.00 0.00 175.52 176.22 1jm0 h ILE 46 N 0.91 1.09 -0.00 3.11 2.04 -0.35 -1.80 117.51 122.51 1jm0 h ILE 46 Ca 0.17 -1.49 0.00 0.00 1.00 0.00 0.00 64.86 64.54 1jm0 h ILE 46 Cb 0.52 1.85 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 1jm0 h ILE 46 CO 0.03 0.40 -0.04 0.18 0.00 0.00 0.00 178.15 178.72 1jm0 n LEU 47 N -3.77 0.27 0.00 1.44 4.77 -0.30 -5.11 117.00 114.30 1jm0 n LEU 47 Ca -0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1jm0 n LEU 47 Cb 0.48 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1jm0 n LEU 47 CO 0.38 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.10