#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 1.14 -3.08 3.17 3.04 -2.09 -3.38 116.25 115.05 2bx9 h VAL 2 Ca 0.00 -0.65 -0.53 0.00 -1.01 0.00 0.00 66.70 64.52 2bx9 h VAL 2 Cb 0.00 1.23 -0.40 0.00 -2.01 0.00 0.00 31.29 30.11 2bx9 h VAL 2 CO 0.00 0.20 -0.76 -0.51 -1.01 0.00 0.00 177.57 175.48 2bx9 s ILE 3 N -4.73 0.34 0.42 3.17 2.07 -1.26 -5.09 121.20 116.13 2bx9 s ILE 3 Ca -0.05 -0.75 0.04 0.00 -1.41 0.00 0.00 60.65 58.48 2bx9 s ILE 3 Cb 0.16 -1.10 0.00 0.00 0.13 0.00 0.00 42.46 41.65 2bx9 s ILE 3 CO 0.71 -0.48 0.60 0.00 -1.91 0.00 0.00 174.94 173.87 2bx9 s ALA 4 N 1.91 4.07 0.28 1.50 0.00 -1.26 -4.97 121.76 123.29 2bx9 s ALA 4 Ca 0.05 -1.34 0.02 0.00 0.00 0.00 0.00 51.96 50.69 2bx9 s ALA 4 Cb -0.17 -1.89 0.59 0.00 0.00 0.00 0.00 23.12 21.66 2bx9 s ALA 4 CO -0.20 -0.30 1.80 1.15 0.00 0.00 0.00 175.76 178.20 2bx9 h THR 5 N 0.55 0.82 0.00 0.00 2.02 -1.98 -0.29 112.91 114.03 2bx9 h THR 5 Ca -0.44 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.45 2bx9 h THR 5 Cb 1.27 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 2bx9 h THR 5 CO 0.53 0.15 0.00 0.47 0.37 0.00 0.00 175.52 177.04 2bx9 n ASP 6 N -4.72 0.51 0.15 4.18 8.00 -1.26 -0.47 116.55 122.94 2bx9 n ASP 6 Ca 0.20 0.60 0.13 0.00 0.71 0.00 0.00 54.79 56.43 2bx9 n ASP 6 Cb 0.43 -0.72 0.37 0.00 -0.02 0.00 0.00 41.12 41.18 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 5.19 -1.42 -3.37 116.42 114.58 2bx9 h ASP 7 Ca 0.00 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.30 2bx9 h ASP 7 Cb 0.43 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.92 2bx9 h ASP 7 CO 0.00 0.00 -1.42 0.18 -3.12 0.00 0.00 179.24 174.88 2bx9 n LEU 8 N -2.52 1.51 -4.24 1.55 4.77 -0.47 -4.38 117.00 113.21 2bx9 n LEU 8 Ca 0.05 -0.02 -0.30 0.00 -0.03 0.00 0.00 56.01 55.71 2bx9 n LEU 8 Cb 0.43 -0.06 -0.16 0.00 -2.33 0.00 0.00 43.42 41.29 2bx9 n LEU 8 CO 0.30 0.39 -0.55 -1.61 -1.33 0.00 0.00 177.39 174.59 2bx9 s GLU 9 N -2.15 2.16 0.01 3.23 2.02 0.38 -1.22 118.70 123.13 2bx9 s GLU 9 Ca -0.07 -0.83 0.05 0.00 0.02 0.00 0.00 54.97 54.15 2bx9 s GLU 9 Cb 0.02 -1.92 -0.03 0.00 0.10 0.00 0.00 34.13 32.30 2bx9 s GLU 9 CO 0.21 0.40 -0.12 0.08 0.02 0.00 0.00 175.26 175.85 2bx9 s VAL 10 N -0.28 3.23 0.21 2.63 1.01 0.17 -4.34 120.40 123.03 2bx9 s VAL 10 Ca 0.01 -0.93 -0.31 0.00 0.00 0.00 0.00 61.98 60.75 2bx9 s VAL 10 Cb -0.11 -2.37 -0.11 0.00 0.00 0.00 0.00 36.38 33.78 2bx9 s VAL 10 CO 0.02 0.40 1.62 0.00 0.00 0.00 0.00 175.10 177.14 2bx9 s ALA 11 N -0.93 3.82 -0.04 5.51 0.00 -1.26 -0.07 121.76 128.79 2bx9 s ALA 11 Ca 0.15 1.49 -0.30 0.00 0.00 0.00 0.00 51.96 53.30 2bx9 s ALA 11 Cb -0.11 -3.65 -0.05 0.00 0.00 0.00 0.00 23.12 19.31 2bx9 s ALA 11 CO 0.06 -0.87 1.58 0.00 0.00 0.00 0.00 175.76 176.53 2bx9 h PRO 13 N 9.01 0.40 -0.07 0.00 0.13 -1.92 -0.25 132.00 139.31 2bx9 h PRO 13 Ca -0.38 -0.29 -0.02 0.00 -0.87 0.00 0.00 66.00 64.44 2bx9 h PRO 13 Cb 1.17 0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2bx9 h PRO 13 CO 0.95 0.91 -0.04 -0.22 -0.23 0.00 0.00 178.00 179.36 2bx9 h LYS 14 N 0.29 0.15 -0.00 0.86 3.64 -1.99 -3.34 116.57 116.18 2bx9 h LYS 14 Ca -0.01 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2bx9 h LYS 14 Cb 1.18 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2bx9 h LYS 14 CO 0.11 0.55 -0.83 0.00 -2.27 0.00 0.00 179.45 177.00 2bx9 n GLU 16 N -1.22 -4.09 -0.99 0.00 1.02 -0.11 -2.71 120.64 112.55 2bx9 n GLU 16 Ca 0.04 0.73 0.00 0.00 -0.02 0.00 0.00 57.16 57.91 2bx9 n GLU 16 Cb 0.32 -5.39 0.00 0.00 -0.02 0.00 0.00 31.44 26.35 2bx9 n GLU 16 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2bx9 n ARG 17 N -3.93 -0.79 0.01 3.49 1.74 -1.23 -4.91 116.66 111.04 2bx9 n ARG 17 Ca -0.20 0.20 -0.14 0.00 -0.77 0.00 0.00 57.85 56.93 2bx9 n ARG 17 Cb 0.65 -3.80 -0.14 0.00 -1.02 0.00 0.00 32.46 28.15 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 0.55 0.00 7.54 0.00 -1.76 -3.44 119.26 122.16 2bx9 h ALA 18 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 54.91 53.55 2bx9 h ALA 18 Cb 0.39 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2bx9 h ALA 18 CO 0.00 1.40 0.00 0.41 0.00 0.00 0.00 179.25 181.06 2bx9 n GLY 19 N 1.71 2.38 3.05 0.00 0.00 -1.26 -4.83 105.19 106.24 2bx9 n GLY 19 Ca -0.21 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.66 2bx9 n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bx9 s GLU 20 N -0.18 0.56 -0.24 1.61 2.02 -1.26 -1.00 118.70 120.21 2bx9 s GLU 20 Ca 0.00 -0.63 0.01 0.00 0.02 0.00 0.00 54.97 54.37 2bx9 s GLU 20 Cb 0.00 -0.41 0.06 0.00 0.10 0.00 0.00 34.13 33.88 2bx9 s GLU 20 CO 0.00 0.09 -0.05 0.42 0.02 0.00 0.00 175.26 175.74 2bx9 s ILE 21 N -1.02 1.50 -1.70 -1.63 -1.09 -0.56 -4.79 121.20 111.91 2bx9 s ILE 21 Ca -0.06 -1.22 0.00 0.00 -2.23 0.00 0.00 60.65 57.14 2bx9 s ILE 21 Cb -0.08 -1.79 0.00 0.00 -1.58 0.00 0.00 42.46 39.01 2bx9 s ILE 21 CO 0.00 -0.12 0.00 -0.62 -1.23 0.00 0.00 174.94 172.97 2bx9 n GLU 22 N 4.68 -1.28 0.00 2.79 1.02 -1.26 -2.90 120.64 123.69 2bx9 n GLU 22 Ca -0.11 1.01 0.00 0.00 -0.02 0.00 0.00 57.16 58.03 2bx9 n GLU 22 Cb 0.44 -5.34 0.00 0.00 -0.02 0.00 0.00 31.44 26.52 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 -0.91 3.10 3.77 0.62 0.00 -1.26 -5.06 105.19 105.45 2bx9 n GLY 23 Ca -0.19 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 44.57 2bx9 n GLY 23 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bx9 s THR 24 N -0.25 3.37 0.30 2.61 -4.23 -1.14 -4.95 115.64 111.34 2bx9 s THR 24 Ca 0.00 1.15 -0.30 0.00 -1.18 0.00 0.00 61.69 61.36 2bx9 s THR 24 Cb 0.00 -3.64 -0.12 0.00 1.34 0.00 0.00 72.50 70.08 2bx9 s THR 24 CO 0.00 0.10 1.47 -0.81 -0.54 0.00 0.00 174.62 174.85 2bx9 n PRO 25 N 0.19 2.42 -2.12 3.99 -0.04 -1.26 -1.50 135.00 136.68 2bx9 n PRO 25 Ca 0.04 0.86 -0.42 0.00 -0.04 0.00 0.00 63.50 63.93 2bx9 n PRO 25 Cb 0.47 -2.56 -0.03 0.00 -0.04 0.00 0.00 33.50 31.34 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 8.85 0.96 -0.30 0.00 0.11 -1.90 -1.86 132.00 137.86 2bx9 h PRO 27 Ca -0.37 -0.32 0.03 0.00 0.11 0.00 0.00 66.00 65.45 2bx9 h PRO 27 Cb 1.17 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2bx9 h PRO 27 CO 0.94 0.99 0.10 0.00 -0.21 0.00 0.00 178.00 179.82 2bx9 h ALA 28 N 0.94 0.34 -0.29 -0.75 0.00 -1.99 -3.01 119.26 114.50 2bx9 h ALA 28 Ca 0.15 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2bx9 h ALA 28 Cb 0.57 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2bx9 h ALA 28 CO 0.03 -0.30 0.00 0.00 0.00 0.00 0.00 179.25 178.98 2bx9 n SER 30 N 0.99 -4.99 0.00 0.00 7.64 -0.72 -3.02 113.62 113.52 2bx9 n SER 30 Ca 0.14 -1.07 0.00 0.00 1.01 0.00 0.00 58.87 58.95 2bx9 n SER 30 Cb 0.47 -3.08 0.00 0.00 -1.01 0.00 0.00 64.21 60.59 2bx9 n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bx9 n GLY 31 N -1.76 3.19 0.22 0.23 0.00 -1.08 -4.92 105.19 101.08 2bx9 n GLY 31 Ca -0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.76 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 1.76 0.75 0.00 1.61 1.79 -1.82 -3.41 116.57 117.25 2bx9 h LYS 32 Ca 0.00 -0.58 0.00 0.00 -2.18 0.00 0.00 60.65 57.89 2bx9 h LYS 32 Cb 0.00 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 2bx9 h LYS 32 CO 0.00 1.19 0.00 0.41 -1.08 0.00 0.00 179.45 179.97 2bx9 n GLY 33 N 0.60 0.65 3.37 3.86 0.00 -1.26 -4.70 105.19 107.71 2bx9 n GLY 33 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 2bx9 n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bx9 s VAL 34 N -2.48 0.01 -0.07 1.61 1.01 -1.26 -2.14 120.40 117.08 2bx9 s VAL 34 Ca 0.00 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 61.91 2bx9 s VAL 34 Cb 0.00 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 2bx9 s VAL 34 CO 0.00 -0.06 -0.16 -0.63 0.00 0.00 0.00 175.10 174.25 2bx9 s ILE 35 N -0.28 2.86 0.26 2.22 1.01 0.91 -4.85 121.20 123.33 2bx9 s ILE 35 Ca -0.04 -0.78 -0.21 0.00 0.00 0.00 0.00 60.65 59.62 2bx9 s ILE 35 Cb -0.03 -2.13 -0.09 0.00 0.01 0.00 0.00 42.46 40.22 2bx9 s ILE 35 CO 0.03 0.57 0.79 -0.76 0.00 0.00 0.00 174.94 175.56 2bx9 s LEU 36 N -0.36 4.30 0.63 2.97 1.43 -1.26 0.41 118.68 126.80 2bx9 s LEU 36 Ca 0.03 1.52 -0.06 0.00 -1.03 0.00 0.00 54.13 54.59 2bx9 s LEU 36 Cb -0.12 -3.77 0.03 0.00 0.03 0.00 0.00 46.19 42.36 2bx9 s LEU 36 CO 0.02 -0.03 0.94 0.42 0.23 0.00 0.00 176.35 177.94 2bx9 s THR 37 N -1.61 3.15 0.27 5.49 -4.23 -0.36 -4.86 115.64 113.50 2bx9 s THR 37 Ca 0.46 -0.10 0.01 0.00 -1.18 0.00 0.00 61.69 60.88 2bx9 s THR 37 Cb -0.16 -3.29 0.26 0.00 1.34 0.00 0.00 72.50 70.65 2bx9 s THR 37 CO 0.21 -0.30 1.73 0.00 -0.54 0.00 0.00 174.62 175.73 2bx9 h ALA 38 N -0.32 1.34 -0.66 3.99 0.00 -1.90 0.76 119.26 122.47 2bx9 h ALA 38 Ca -0.45 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 2bx9 h ALA 38 Cb 1.28 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.09 2bx9 h ALA 38 CO 0.60 -0.20 0.21 0.37 0.00 0.00 0.00 179.25 180.23 2bx9 h GLN 39 N 0.53 1.03 -0.51 0.00 5.75 -1.92 0.48 115.11 120.47 2bx9 h GLN 39 Ca 0.50 -0.22 -0.05 0.00 -0.15 0.00 0.00 58.65 58.73 2bx9 h GLN 39 Cb 0.83 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 29.21 2bx9 h GLN 39 CO -0.43 0.90 0.11 0.78 -2.65 0.00 0.00 178.83 177.54 2bx9 h GLY 40 N 0.97 0.88 0.81 2.39 0.00 -1.21 -2.06 103.07 104.84 2bx9 h GLY 40 Ca 0.21 -0.56 -0.04 0.00 0.00 0.00 0.00 47.33 46.94 2bx9 h GLY 40 CO -0.01 0.52 -0.02 -0.97 0.00 0.00 0.00 176.54 176.06 2bx9 h TYR 41 N 0.71 0.41 -0.42 5.60 -1.99 -0.79 -1.29 116.97 119.20 2bx9 h TYR 41 Ca 0.16 -0.08 0.06 0.00 2.00 0.00 0.00 58.73 60.87 2bx9 h TYR 41 Cb 0.35 -0.10 -0.09 0.00 2.00 0.00 0.00 36.73 38.89 2bx9 h TYR 41 CO 0.02 0.59 -0.48 1.15 -0.00 0.00 0.00 178.16 179.44 2bx9 h THR 42 N 0.11 0.06 -0.02 -2.88 2.02 -0.81 0.24 112.91 111.63 2bx9 h THR 42 Ca 0.05 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.27 2bx9 h THR 42 Cb 0.45 0.06 -0.05 0.00 -1.74 0.00 0.00 68.15 66.87 2bx9 h THR 42 CO 0.02 0.00 -0.26 -0.07 0.37 0.00 0.00 175.52 175.58 2bx9 h LEU 43 N -0.35 -0.76 -0.40 2.58 -0.00 -1.37 -2.24 115.31 112.77 2bx9 h LEU 43 Ca 0.11 0.11 -0.05 0.00 -0.00 0.00 0.00 57.88 58.05 2bx9 h LEU 43 Cb 0.59 0.32 -0.02 0.00 -0.00 0.00 0.00 40.66 41.55 2bx9 h LEU 43 CO -0.59 -0.32 0.06 0.25 -0.00 0.00 0.00 178.44 177.83 2bx9 h LEU 44 N -0.38 0.65 -0.67 1.67 5.85 -0.61 -1.82 115.31 119.98 2bx9 h LEU 44 Ca 0.07 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 2bx9 h LEU 44 Cb 0.48 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 2bx9 h LEU 44 CO -0.24 0.75 0.20 0.44 -0.34 0.00 0.00 178.44 179.25 2bx9 h ASP 45 N 0.52 0.99 -0.14 1.25 3.32 -0.56 -0.70 116.42 121.10 2bx9 h ASP 45 Ca 0.12 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2bx9 h ASP 45 Cb 0.38 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 2bx9 h ASP 45 CO 0.01 0.94 0.09 0.15 -1.72 0.00 0.00 179.24 178.71 2bx9 h PHE 46 N 0.99 0.18 -0.49 4.55 3.57 -1.12 -1.40 116.94 123.22 2bx9 h PHE 46 Ca 0.22 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.71 2bx9 h PHE 46 Cb 0.31 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 2bx9 h PHE 46 CO 0.02 0.13 0.29 0.82 -2.23 0.00 0.00 178.31 177.34 2bx9 h ILE 47 N 0.18 1.16 0.00 1.41 1.08 -1.09 -2.17 117.51 118.08 2bx9 h ILE 47 Ca 0.05 -0.37 -0.05 0.00 -0.39 0.00 0.00 64.86 64.10 2bx9 h ILE 47 Cb -0.01 0.52 -0.01 0.00 -3.07 0.00 0.00 36.82 34.25 2bx9 h ILE 47 CO -0.01 0.16 -0.24 1.56 -0.69 0.00 0.00 178.15 178.93 2bx9 h GLN 48 N 0.65 0.00 0.07 2.37 4.20 -0.99 0.49 115.11 121.90 2bx9 h GLN 48 Ca 0.18 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.64 2bx9 h GLN 48 Cb 0.01 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 2bx9 h GLN 48 CO -0.03 0.24 -1.12 -0.22 -0.67 0.00 0.00 178.83 177.03 2bx9 h LYS 49 N 0.00 0.16 0.00 1.46 3.64 -0.82 -3.39 116.57 117.62 2bx9 h LYS 49 Ca -0.00 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 2bx9 h LYS 49 Cb 0.48 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 2bx9 h LYS 49 CO 0.03 1.12 -0.77 0.72 -2.27 0.00 0.00 179.45 178.28 2bx9 n HIS 50 N -3.47 0.00 -1.68 1.91 8.25 -0.86 -4.92 115.22 114.45 2bx9 n HIS 50 Ca -0.05 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 56.97 2bx9 n HIS 50 Cb 0.98 -0.06 -0.04 0.00 1.12 0.00 0.00 29.99 31.99 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 -1.41 3.79 -3.92 2.41 0.00 0.15 -2.85 117.00 115.17 2bx9 n LEU 51 Ca -0.00 1.00 -0.29 0.00 0.00 0.00 0.00 56.01 56.72 2bx9 n LEU 51 Cb 0.10 -1.50 0.01 0.00 0.00 0.00 0.00 43.42 42.04 2bx9 n LEU 51 CO 0.09 0.06 0.01 0.59 0.00 0.00 0.00 177.39 178.14 2bx9 n ASN 52 N 5.46 -3.24 -0.22 1.96 3.02 -1.26 -5.00 115.26 115.97 2bx9 n ASN 52 Ca 0.19 -0.85 0.03 0.00 -0.03 0.00 0.00 54.58 53.91 2bx9 n ASN 52 Cb 0.35 -3.66 0.02 0.00 -0.61 0.00 0.00 39.78 35.88 2bx9 n ASN 52 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93