#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bx9 h VAL 2 N 0.00 1.27 -3.48 1.12 3.04 -2.09 -3.40 116.25 112.70 2bx9 h VAL 2 Ca 0.00 -1.27 -0.57 0.00 -1.01 0.00 0.00 66.70 63.85 2bx9 h VAL 2 Cb 0.00 1.06 -0.39 0.00 -2.01 0.00 0.00 31.29 29.95 2bx9 h VAL 2 CO 0.00 0.44 -0.78 -0.51 -1.01 0.00 0.00 177.57 175.71 2bx9 s ILE 3 N -4.76 1.17 0.57 3.17 -1.16 -1.26 -5.10 121.20 113.83 2bx9 s ILE 3 Ca -0.10 -0.94 0.02 0.00 -0.51 0.00 0.00 60.65 59.12 2bx9 s ILE 3 Cb 0.13 -1.49 0.05 0.00 0.61 0.00 0.00 42.46 41.76 2bx9 s ILE 3 CO 0.85 -0.10 0.80 0.00 -2.81 0.00 0.00 174.94 173.67 2bx9 s ALA 4 N 1.57 3.96 0.24 1.50 0.00 -1.26 -4.96 121.76 122.81 2bx9 s ALA 4 Ca -0.03 -1.47 -0.05 0.00 0.00 0.00 0.00 51.96 50.40 2bx9 s ALA 4 Cb -0.18 -1.99 0.34 0.00 0.00 0.00 0.00 23.12 21.29 2bx9 s ALA 4 CO -0.07 -0.84 1.84 1.15 0.00 0.00 0.00 175.76 177.84 2bx9 h THR 5 N 0.02 1.01 0.00 0.00 2.02 -1.99 -1.29 112.91 112.67 2bx9 h THR 5 Ca -0.40 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.46 2bx9 h THR 5 Cb 1.29 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 2bx9 h THR 5 CO 0.49 0.17 0.00 0.47 0.37 0.00 0.00 175.52 177.02 2bx9 n ASP 6 N -4.65 0.51 0.19 4.18 8.00 -1.26 -0.27 116.55 123.24 2bx9 n ASP 6 Ca 0.12 0.61 0.07 0.00 0.71 0.00 0.00 54.79 56.30 2bx9 n ASP 6 Cb 0.20 -0.72 0.28 0.00 -0.02 0.00 0.00 41.12 40.85 2bx9 n ASP 6 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2bx9 h ASP 7 N 0.00 0.00 0.00 -2.24 3.32 -1.61 -3.38 116.42 112.51 2bx9 h ASP 7 Ca 0.00 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.63 2bx9 h ASP 7 Cb 0.39 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.87 2bx9 h ASP 7 CO 0.00 0.33 -2.46 0.18 -1.72 0.00 0.00 179.24 175.57 2bx9 n LEU 8 N -3.34 2.46 -4.21 1.55 4.77 0.28 -4.34 117.00 114.18 2bx9 n LEU 8 Ca 0.01 0.11 -0.26 0.00 -0.03 0.00 0.00 56.01 55.84 2bx9 n LEU 8 Cb 0.55 -0.88 -0.15 0.00 -2.33 0.00 0.00 43.42 40.61 2bx9 n LEU 8 CO 0.36 0.75 -0.52 -1.61 -1.33 0.00 0.00 177.39 175.04 2bx9 s GLU 9 N -2.51 1.59 -0.13 3.23 2.02 0.62 -1.33 118.70 122.20 2bx9 s GLU 9 Ca -0.36 -0.72 -0.06 0.00 0.02 0.00 0.00 54.97 53.85 2bx9 s GLU 9 Cb 0.12 -1.55 -0.04 0.00 0.10 0.00 0.00 34.13 32.76 2bx9 s GLU 9 CO 0.56 0.42 0.08 0.08 0.02 0.00 0.00 175.26 176.42 2bx9 s VAL 10 N -0.49 5.02 0.21 2.63 1.01 0.13 -4.29 120.40 124.62 2bx9 s VAL 10 Ca 0.08 0.03 -0.31 0.00 0.00 0.00 0.00 61.98 61.78 2bx9 s VAL 10 Cb -0.08 -3.19 -0.11 0.00 0.00 0.00 0.00 36.38 33.01 2bx9 s VAL 10 CO -0.01 0.58 1.57 0.00 0.00 0.00 0.00 175.10 177.24 2bx9 s ALA 11 N -0.64 3.77 0.18 5.51 0.00 -1.26 0.23 121.76 129.55 2bx9 s ALA 11 Ca 0.12 1.43 -0.31 0.00 0.00 0.00 0.00 51.96 53.20 2bx9 s ALA 11 Cb -0.12 -3.63 -0.10 0.00 0.00 0.00 0.00 23.12 19.28 2bx9 s ALA 11 CO 0.02 -0.83 1.51 0.00 0.00 0.00 0.00 175.76 176.46 2bx9 h PRO 13 N 6.29 0.00 0.17 0.00 0.13 -1.92 -0.82 132.00 135.85 2bx9 h PRO 13 Ca -0.44 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.37 2bx9 h PRO 13 Cb 1.21 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.35 2bx9 h PRO 13 CO 0.87 0.00 -1.54 -0.22 -0.23 0.00 0.00 178.00 176.88 2bx9 h LYS 14 N 0.00 0.36 0.00 0.86 1.63 -1.99 -3.40 116.57 114.03 2bx9 h LYS 14 Ca 0.00 -0.62 0.00 0.00 -0.85 0.00 0.00 60.65 59.18 2bx9 h LYS 14 Cb 0.97 0.23 0.00 0.00 -0.60 0.00 0.00 32.23 32.83 2bx9 h LYS 14 CO 0.00 1.26 0.00 0.00 -3.45 0.00 0.00 179.45 177.26 2bx9 n GLU 16 N -0.12 -0.43 -0.95 0.00 4.71 -0.31 -1.24 120.64 122.29 2bx9 n GLU 16 Ca 0.00 0.07 0.00 0.00 -0.01 0.00 0.00 57.16 57.22 2bx9 n GLU 16 Cb 0.11 -2.81 0.00 0.00 -1.01 0.00 0.00 31.44 27.73 2bx9 n GLU 16 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2bx9 n ARG 17 N -4.95 -0.33 0.09 3.49 1.74 -1.23 -4.94 116.66 110.54 2bx9 n ARG 17 Ca -0.18 0.08 -0.19 0.00 -0.77 0.00 0.00 57.85 56.80 2bx9 n ARG 17 Cb 0.60 -3.34 -0.14 0.00 -1.02 0.00 0.00 32.46 28.56 2bx9 n ARG 17 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bx9 h ALA 18 N 0.00 0.15 0.00 7.54 0.00 -1.43 -3.43 119.26 122.08 2bx9 h ALA 18 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.89 2bx9 h ALA 18 Cb 0.17 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2bx9 h ALA 18 CO 0.00 1.02 0.00 0.41 0.00 0.00 0.00 179.25 180.68 2bx9 n GLY 19 N 1.67 1.57 3.15 0.00 0.00 -1.26 -4.84 105.19 105.47 2bx9 n GLY 19 Ca -0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 2bx9 n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2bx9 s GLU 20 N -0.37 0.45 -0.28 1.61 -1.05 -1.26 -2.51 118.70 115.29 2bx9 s GLU 20 Ca 0.00 -0.03 -0.01 0.00 -0.15 0.00 0.00 54.97 54.79 2bx9 s GLU 20 Cb 0.00 0.20 0.05 0.00 -0.44 0.00 0.00 34.13 33.94 2bx9 s GLU 20 CO 0.00 -0.10 -0.05 0.42 0.95 0.00 0.00 175.26 176.48 2bx9 s ILE 21 N -0.73 2.75 0.00 1.83 -1.09 -0.33 -4.65 121.20 118.97 2bx9 s ILE 21 Ca -0.08 -1.35 0.00 0.00 -2.23 0.00 0.00 60.65 56.99 2bx9 s ILE 21 Cb -0.04 -2.53 0.00 0.00 -1.58 0.00 0.00 42.46 38.30 2bx9 s ILE 21 CO 0.02 -0.00 0.00 -0.62 -1.23 0.00 0.00 174.94 173.11 2bx9 n GLU 22 N 4.59 -0.46 0.00 2.79 1.02 -1.26 -2.25 120.64 125.06 2bx9 n GLU 22 Ca -0.14 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 2bx9 n GLU 22 Cb 0.44 -3.57 0.00 0.00 -0.02 0.00 0.00 31.44 28.29 2bx9 n GLU 22 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bx9 n GLY 23 N -1.67 2.00 3.84 0.62 0.00 -1.26 -5.09 105.19 103.62 2bx9 n GLY 23 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2bx9 n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bx9 s THR 24 N -2.06 4.73 0.08 2.61 2.01 -0.96 -5.00 115.64 117.05 2bx9 s THR 24 Ca 0.00 0.98 -0.37 0.00 0.31 0.00 0.00 61.69 62.61 2bx9 s THR 24 Cb 0.00 -3.75 -0.17 0.00 0.01 0.00 0.00 72.50 68.58 2bx9 s THR 24 CO 0.00 0.14 1.22 -0.81 -0.69 0.00 0.00 174.62 174.48 2bx9 n PRO 25 N 0.52 0.83 -2.12 4.92 -0.04 -1.26 -1.19 135.00 136.67 2bx9 n PRO 25 Ca -0.02 0.30 -0.43 0.00 -0.04 0.00 0.00 63.50 63.31 2bx9 n PRO 25 Cb 0.52 -1.87 -0.03 0.00 -0.04 0.00 0.00 33.50 32.09 2bx9 n PRO 25 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bx9 h PRO 27 N 11.37 0.00 0.10 0.00 0.11 -1.92 0.95 132.00 142.61 2bx9 h PRO 27 Ca -0.33 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.78 2bx9 h PRO 27 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2bx9 h PRO 27 CO 1.02 0.00 -0.05 0.00 -0.21 0.00 0.00 178.00 178.76 2bx9 h ALA 28 N 2.21 -0.14 -0.56 -0.75 0.00 -1.99 -3.36 119.26 114.66 2bx9 h ALA 28 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2bx9 h ALA 28 Cb 0.34 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2bx9 h ALA 28 CO 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.08 2bx9 n SER 30 N 1.12 -4.56 0.00 0.00 2.88 0.32 -2.14 113.62 111.24 2bx9 n SER 30 Ca 0.19 -1.20 0.00 0.00 -1.33 0.00 0.00 58.87 56.53 2bx9 n SER 30 Cb 0.55 -2.21 0.00 0.00 -0.75 0.00 0.00 64.21 61.80 2bx9 n SER 30 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2bx9 n GLY 31 N -1.96 3.03 0.15 0.46 0.00 -1.14 -4.86 105.19 100.87 2bx9 n GLY 31 Ca -0.11 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.94 2bx9 n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bx9 h LYS 32 N 1.18 0.00 0.00 1.61 1.79 -1.68 -3.40 116.57 116.07 2bx9 h LYS 32 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2bx9 h LYS 32 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2bx9 h LYS 32 CO 0.00 0.50 0.00 0.41 -1.08 0.00 0.00 179.45 179.28 2bx9 n GLY 33 N 0.93 0.59 3.26 3.86 0.00 -1.26 -4.77 105.19 107.80 2bx9 n GLY 33 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 2bx9 n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bx9 s VAL 34 N -2.44 0.07 -0.05 1.61 0.11 -1.26 -2.42 120.40 116.02 2bx9 s VAL 34 Ca 0.00 -0.57 0.06 0.00 -2.93 0.00 0.00 61.98 58.54 2bx9 s VAL 34 Cb 0.00 -0.81 -0.01 0.00 -1.53 0.00 0.00 36.38 34.03 2bx9 s VAL 34 CO 0.00 -0.31 -0.22 -0.63 -3.33 0.00 0.00 175.10 170.61 2bx9 s ILE 35 N -2.03 1.80 0.34 7.04 1.01 0.14 -4.77 121.20 124.72 2bx9 s ILE 35 Ca -0.09 -0.93 -0.23 0.00 0.00 0.00 0.00 60.65 59.40 2bx9 s ILE 35 Cb -0.03 -1.52 -0.10 0.00 0.01 0.00 0.00 42.46 40.82 2bx9 s ILE 35 CO 0.00 0.51 0.91 -0.76 0.00 0.00 0.00 174.94 175.59 2bx9 s LEU 36 N -0.13 4.22 0.77 2.97 1.43 -1.26 0.18 118.68 126.86 2bx9 s LEU 36 Ca -0.02 1.71 -0.03 0.00 -1.03 0.00 0.00 54.13 54.76 2bx9 s LEU 36 Cb -0.12 -4.09 0.14 0.00 0.03 0.00 0.00 46.19 42.14 2bx9 s LEU 36 CO 0.03 -0.14 1.05 0.42 0.23 0.00 0.00 176.35 177.94 2bx9 s THR 37 N -1.77 2.09 0.17 5.49 -4.23 -0.44 -4.85 115.64 112.10 2bx9 s THR 37 Ca 0.52 -0.50 -0.15 0.00 -1.18 0.00 0.00 61.69 60.38 2bx9 s THR 37 Cb -0.15 -2.59 0.05 0.00 1.34 0.00 0.00 72.50 71.15 2bx9 s THR 37 CO 0.20 0.00 1.73 0.00 -0.54 0.00 0.00 174.62 176.02 2bx9 h ALA 38 N -0.73 0.45 -0.29 3.99 0.00 -1.89 -0.89 119.26 119.91 2bx9 h ALA 38 Ca -0.37 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.64 2bx9 h ALA 38 Cb 1.26 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 2bx9 h ALA 38 CO 0.39 -0.30 0.10 0.37 0.00 0.00 0.00 179.25 179.81 2bx9 h GLN 39 N 0.24 0.22 -0.22 0.00 5.75 -1.91 -0.44 115.11 118.74 2bx9 h GLN 39 Ca 0.19 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.70 2bx9 h GLN 39 Cb 0.21 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.69 2bx9 h GLN 39 CO -0.23 0.14 0.09 0.78 -2.65 0.00 0.00 178.83 176.96 2bx9 h GLY 40 N 0.22 0.28 0.60 2.39 0.00 -1.64 -1.95 103.07 102.97 2bx9 h GLY 40 Ca 0.13 -0.06 0.07 0.00 0.00 0.00 0.00 47.33 47.47 2bx9 h GLY 40 CO -0.13 0.04 0.36 -0.97 0.00 0.00 0.00 176.54 175.84 2bx9 h TYR 41 N 0.20 0.66 0.13 5.60 0.99 -0.96 -1.73 116.97 121.85 2bx9 h TYR 41 Ca 0.10 0.03 0.02 0.00 2.00 0.00 0.00 58.73 60.87 2bx9 h TYR 41 Cb 0.05 -0.20 -0.03 0.00 1.00 0.00 0.00 36.73 37.56 2bx9 h TYR 41 CO -0.11 0.29 -0.24 1.15 -0.00 0.00 0.00 178.16 179.24 2bx9 h THR 42 N 0.65 0.46 -0.98 -2.88 2.02 -0.47 0.22 112.91 111.94 2bx9 h THR 42 Ca 0.32 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.52 2bx9 h THR 42 Cb 0.26 0.46 -0.05 0.00 -1.74 0.00 0.00 68.15 67.08 2bx9 h THR 42 CO -0.22 0.00 0.65 -0.07 0.37 0.00 0.00 175.52 176.25 2bx9 h LEU 43 N -0.45 1.11 -0.19 2.58 4.07 -1.22 -1.36 115.31 119.84 2bx9 h LEU 43 Ca 0.03 -0.02 -0.12 0.00 0.08 0.00 0.00 57.88 57.85 2bx9 h LEU 43 Cb 0.47 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 41.94 2bx9 h LEU 43 CO -0.13 0.79 -0.33 0.25 -1.08 0.00 0.00 178.44 177.94 2bx9 h LEU 44 N 1.30 0.63 -0.18 1.67 7.12 -0.94 -2.27 115.31 122.63 2bx9 h LEU 44 Ca 0.37 -0.53 -0.02 0.00 0.13 0.00 0.00 57.88 57.82 2bx9 h LEU 44 Cb -0.11 -0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 39.83 2bx9 h LEU 44 CO -0.09 1.04 0.03 0.44 -0.13 0.00 0.00 178.44 179.73 2bx9 h ASP 45 N 0.23 0.28 -0.21 1.25 3.32 -0.86 -0.12 116.42 120.32 2bx9 h ASP 45 Ca 0.01 -0.25 0.06 0.00 0.02 0.00 0.00 57.03 56.87 2bx9 h ASP 45 Cb 0.92 -0.08 -0.07 0.00 0.22 0.00 0.00 39.33 40.33 2bx9 h ASP 45 CO 0.07 0.47 -0.24 0.15 -1.72 0.00 0.00 179.24 177.97 2bx9 h PHE 46 N 0.09 -0.65 -0.33 4.55 3.57 -1.23 0.55 116.94 123.49 2bx9 h PHE 46 Ca 0.06 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 2bx9 h PHE 46 Cb 0.30 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2bx9 h PHE 46 CO 0.02 -0.32 0.08 0.82 -2.23 0.00 0.00 178.31 176.67 2bx9 h ILE 47 N -0.27 1.22 -0.19 1.41 1.08 -1.36 -1.95 117.51 117.45 2bx9 h ILE 47 Ca 0.13 -0.74 -0.02 0.00 -0.39 0.00 0.00 64.86 63.83 2bx9 h ILE 47 Cb 0.46 1.08 -0.01 0.00 -3.07 0.00 0.00 36.82 35.28 2bx9 h ILE 47 CO -0.37 0.25 0.01 -0.61 -0.69 0.00 0.00 178.15 176.74 2bx9 h GLN 48 N 0.37 0.27 -0.03 2.37 4.15 -0.80 0.13 115.11 121.57 2bx9 h GLN 48 Ca 0.10 -0.04 -0.22 0.00 0.77 0.00 0.00 58.65 59.27 2bx9 h GLN 48 Cb 0.30 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.94 2bx9 h GLN 48 CO 0.00 0.29 -0.89 -0.22 -1.93 0.00 0.00 178.83 176.08 2bx9 h LYS 49 N 0.27 0.47 0.00 1.69 3.64 -0.53 -3.39 116.57 118.71 2bx9 h LYS 49 Ca 0.06 -0.46 -0.06 0.00 -1.27 0.00 0.00 60.65 58.93 2bx9 h LYS 49 Cb 0.17 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 2bx9 h LYS 49 CO 0.00 1.11 -1.51 0.72 -2.27 0.00 0.00 179.45 177.50 2bx9 n HIS 50 N -3.79 0.00 -1.72 1.91 8.25 -0.77 -4.88 115.22 114.22 2bx9 n HIS 50 Ca -0.07 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.97 2bx9 n HIS 50 Cb 0.80 -0.30 -0.03 0.00 1.12 0.00 0.00 29.99 31.58 2bx9 n HIS 50 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2bx9 n LEU 51 N -2.01 4.07 -2.17 2.41 7.94 0.42 -1.96 117.00 125.71 2bx9 n LEU 51 Ca -0.06 1.07 -0.17 0.00 -1.11 0.00 0.00 56.01 55.74 2bx9 n LEU 51 Cb 0.44 -1.58 -0.03 0.00 0.53 0.00 0.00 43.42 42.78 2bx9 n LEU 51 CO 0.20 0.19 -0.20 0.59 -1.11 0.00 0.00 177.39 177.07 2bx9 n ASN 52 N 3.74 -4.83 0.00 1.96 5.03 -1.26 -4.99 115.26 114.92 2bx9 n ASN 52 Ca 0.15 0.17 0.00 0.00 0.87 0.00 0.00 54.58 55.77 2bx9 n ASN 52 Cb 0.35 -4.13 0.00 0.00 -1.02 0.00 0.00 39.78 34.98 2bx9 n ASN 52 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72