#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 0.28 -3.34 1.12 2.07 -2.09 -3.39 116.25 110.90 2bx9 h VAL 2 Ca 0.00 0.00 -0.56 0.00 0.82 0.00 0.00 66.70 66.96 2bx9 h VAL 2 Cb 0.00 0.28 -0.38 0.00 -1.52 0.00 0.00 31.29 29.68 2bx9 h VAL 2 CO 0.00 0.00 -0.80 -0.51 0.02 0.00 0.00 177.57 176.28 2bx9 s ILE 3 N -6.10 1.21 0.40 4.57 2.07 -1.26 -5.08 121.20 117.01 2bx9 s ILE 3 Ca -0.14 -0.69 0.08 0.00 -1.41 0.00 0.00 60.65 58.49 2bx9 s ILE 3 Cb 0.17 -1.36 -0.01 0.00 0.13 0.00 0.00 42.46 41.39 2bx9 s ILE 3 CO 0.71 0.15 0.44 0.00 -1.91 0.00 0.00 174.94 174.32 2bx9 s ALA 4 N 1.59 4.21 0.26 1.50 0.00 -1.26 -4.96 121.76 123.09 2bx9 s ALA 4 Ca 0.01 -1.76 -0.02 0.00 0.00 0.00 0.00 51.96 50.19 2bx9 s ALA 4 Cb -0.15 -1.28 0.51 0.00 0.00 0.00 0.00 23.12 22.19 2bx9 s ALA 4 CO -0.08 -0.20 1.77 1.15 0.00 0.00 0.00 175.76 178.40 2bx9 h THR 5 N 0.91 0.76 0.00 0.00 2.02 -1.99 0.11 112.91 114.72 2bx9 h THR 5 Ca -0.42 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.54 2bx9 h THR 5 Cb 1.27 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2bx9 h THR 5 CO 0.53 0.12 0.00 -0.90 0.37 0.00 0.00 175.52 175.64 2bx9 n ASP 6 N -4.85 0.00 0.14 4.18 5.68 -1.26 -0.76 116.55 119.67 2bx9 n ASP 6 Ca 0.16 -0.08 0.03 0.00 -0.50 0.00 0.00 54.79 54.40 2bx9 n ASP 6 Cb 0.41 -0.25 0.02 0.00 -1.14 0.00 0.00 41.12 40.16 2bx9 n ASP 6 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2bx9 h ASP 7 N 0.00 0.00 0.01 -1.12 3.32 -1.16 -3.40 116.42 114.06 2bx9 h ASP 7 Ca 0.00 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.67 2bx9 h ASP 7 Cb 0.17 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.65 2bx9 h ASP 7 CO 0.00 0.50 -2.44 0.18 -1.72 0.00 0.00 179.24 175.75 2bx9 n LEU 8 N -3.20 2.24 -4.10 1.55 4.77 0.06 -4.36 117.00 113.96 2bx9 n LEU 8 Ca 0.01 -0.09 -0.18 0.00 -0.03 0.00 0.00 56.01 55.72 2bx9 n LEU 8 Cb 0.74 -0.57 -0.13 0.00 -2.33 0.00 0.00 43.42 41.13 2bx9 n LEU 8 CO 0.41 0.83 -0.44 -1.61 -1.33 0.00 0.00 177.39 175.24 2bx9 s GLU 9 N -2.51 0.76 -0.05 3.23 2.02 -0.24 -1.43 118.70 120.48 2bx9 s GLU 9 Ca -0.28 -0.68 -0.02 0.00 0.02 0.00 0.00 54.97 54.00 2bx9 s GLU 9 Cb 0.08 -0.71 -0.04 0.00 0.10 0.00 0.00 34.13 33.57 2bx9 s GLU 9 CO 0.66 0.17 0.08 0.08 0.02 0.00 0.00 175.26 176.27 2bx9 s VAL 10 N -0.88 4.84 0.20 2.63 1.01 0.18 -4.38 120.40 124.00 2bx9 s VAL 10 Ca -0.01 -0.23 -0.32 0.00 0.00 0.00 0.00 61.98 61.41 2bx9 s VAL 10 Cb -0.08 -3.16 -0.13 0.00 0.00 0.00 0.00 36.38 33.02 2bx9 s VAL 10 CO 0.01 0.46 1.68 0.00 0.00 0.00 0.00 175.10 177.24 2bx9 n ALA 11 N 1.54 2.41 -1.67 5.51 0.00 -1.26 -0.34 120.51 126.70 2bx9 n ALA 11 Ca -0.15 0.41 -0.45 0.00 0.00 0.00 0.00 53.44 53.25 2bx9 n ALA 11 Cb 0.53 -2.47 -0.03 0.00 0.00 0.00 0.00 19.45 17.48 2bx9 n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bx9 h PRO 13 N 5.24 0.44 0.55 0.00 0.13 -1.91 -1.53 132.00 134.92 2bx9 h PRO 13 Ca -0.45 -0.64 -0.02 0.00 -0.87 0.00 0.00 66.00 64.02 2bx9 h PRO 13 Cb 1.26 0.22 -0.01 0.00 0.13 0.00 0.00 31.00 32.60 2bx9 h PRO 13 CO 0.84 1.28 -0.45 -0.22 -0.23 0.00 0.00 178.00 179.21 2bx9 h LYS 14 N -0.08 -0.93 -0.08 0.86 3.64 -2.00 -3.29 116.57 114.68 2bx9 h LYS 14 Ca -0.16 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2bx9 h LYS 14 Cb 1.72 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.75 2bx9 h LYS 14 CO 0.18 -0.62 0.00 0.00 -2.27 0.00 0.00 179.45 176.74 2bx9 n GLU 16 N 1.18 -2.61 -0.22 0.00 2.13 -0.58 -1.74 120.64 118.81 2bx9 n GLU 16 Ca 0.13 0.31 0.00 0.00 0.66 0.00 0.00 57.16 58.26 2bx9 n GLU 16 Cb 0.52 -4.41 0.00 0.00 0.27 0.00 0.00 31.44 27.83 2bx9 n GLU 16 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2bx9 n ARG 17 N -4.43 0.00 0.23 5.31 0.63 -1.24 -4.90 116.66 112.26 2bx9 n ARG 17 Ca -0.23 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 56.83 2bx9 n ARG 17 Cb 0.65 -1.08 0.33 0.00 0.45 0.00 0.00 32.46 32.81 2bx9 n ARG 17 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2bx9 h ALA 18 N 0.00 0.98 0.00 5.13 0.00 -1.62 -3.42 119.26 120.33 2bx9 h ALA 18 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2bx9 h ALA 18 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2bx9 h ALA 18 CO 0.00 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.71 2bx9 n GLY 19 N 0.74 2.44 2.97 0.00 0.00 -1.26 -4.92 105.19 105.16 2bx9 n GLY 19 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 0.00 0.13 -0.68 1.61 -1.05 -1.26 -1.52 118.70 115.92 2bx9 s GLU 20 Ca 0.00 0.35 -0.18 0.00 -0.15 0.00 0.00 54.97 54.99 2bx9 s GLU 20 Cb 0.00 -0.10 0.13 0.00 -0.44 0.00 0.00 34.13 33.71 2bx9 s GLU 20 CO 0.00 -0.13 0.78 0.96 0.95 0.00 0.00 175.26 177.82 2bx9 s ILE 21 N 0.90 4.93 -1.10 1.83 -4.36 0.26 -4.69 121.20 118.97 2bx9 s ILE 21 Ca -0.07 -1.32 -0.06 0.00 -0.26 0.00 0.00 60.65 58.95 2bx9 s ILE 21 Cb -0.09 -4.53 -0.05 0.00 1.25 0.00 0.00 42.46 39.05 2bx9 s ILE 21 CO -0.05 -1.17 0.92 -0.62 0.24 0.00 0.00 174.94 174.26 2bx9 n GLU 22 N 5.99 -3.30 0.00 0.37 -0.58 -1.26 -3.10 120.64 118.76 2bx9 n GLU 22 Ca -0.01 0.82 0.00 0.00 -0.42 0.00 0.00 57.16 57.55 2bx9 n GLU 22 Cb 0.44 -5.67 0.00 0.00 -0.57 0.00 0.00 31.44 25.64 2bx9 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2bx9 n GLY 23 N -1.26 2.80 3.75 0.62 0.00 -1.26 -5.03 105.19 104.80 2bx9 n GLY 23 Ca -0.13 -0.74 -0.39 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.79 4.96 0.35 2.61 2.01 -1.18 -5.04 115.64 118.55 2bx9 s THR 24 Ca 0.00 1.28 -0.29 0.00 0.31 0.00 0.00 61.69 62.99 2bx9 s THR 24 Cb 0.00 -3.95 -0.12 0.00 0.01 0.00 0.00 72.50 68.44 2bx9 s THR 24 CO 0.00 0.37 1.45 -0.81 -0.69 0.00 0.00 174.62 174.94 2bx9 n PRO 25 N 3.09 2.50 -2.54 4.92 -0.04 -1.26 -0.57 135.00 141.10 2bx9 n PRO 25 Ca -0.05 0.88 -0.43 0.00 -0.04 0.00 0.00 63.50 63.86 2bx9 n PRO 25 Cb 0.51 -2.58 -0.02 0.00 -0.04 0.00 0.00 33.50 31.37 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 7.56 0.00 -0.84 0.00 0.11 -1.91 -1.91 132.00 135.01 2bx9 h PRO 27 Ca -0.29 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 2bx9 h PRO 27 Cb 1.13 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 2bx9 h PRO 27 CO 0.91 0.46 0.40 0.00 -0.21 0.00 0.00 178.00 179.56 2bx9 h ALA 28 N 1.54 1.08 -0.14 -0.75 0.00 -2.00 -3.30 119.26 115.69 2bx9 h ALA 28 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2bx9 h ALA 28 Cb 0.91 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2bx9 h ALA 28 CO 0.06 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.96 2bx9 n SER 30 N 0.29 -6.03 0.00 0.00 2.88 -0.76 -1.63 113.62 108.36 2bx9 n SER 30 Ca 0.06 -0.37 0.00 0.00 -1.33 0.00 0.00 58.87 57.23 2bx9 n SER 30 Cb 0.30 -4.85 0.00 0.00 -0.75 0.00 0.00 64.21 58.91 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 -1.63 0.86 0.07 0.46 0.00 -0.95 -4.90 105.19 99.10 2bx9 n GLY 31 Ca -0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 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 2.48 0.02 0.00 1.61 1.57 -1.57 -3.41 116.57 117.27 2bx9 h LYS 32 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2bx9 h LYS 32 Cb 0.01 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2bx9 h LYS 32 CO 0.00 1.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.29 2bx9 n GLY 33 N 1.33 0.56 3.50 3.86 0.00 -1.26 -4.74 105.19 108.44 2bx9 n GLY 33 Ca -0.01 -0.27 -0.15 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.00 0.01 0.01 1.61 0.11 -1.26 -2.05 120.40 116.82 2bx9 s VAL 34 Ca 0.00 -0.05 0.08 0.00 -2.93 0.00 0.00 61.98 59.08 2bx9 s VAL 34 Cb 0.00 -0.89 -0.02 0.00 -1.53 0.00 0.00 36.38 33.94 2bx9 s VAL 34 CO 0.00 -0.03 -0.25 -0.63 -3.33 0.00 0.00 175.10 170.86 2bx9 s ILE 35 N -0.32 1.99 0.32 7.04 1.01 0.54 -4.74 121.20 127.05 2bx9 s ILE 35 Ca -0.05 -1.19 -0.23 0.00 0.00 0.00 0.00 60.65 59.18 2bx9 s ILE 35 Cb -0.03 -1.68 -0.10 0.00 0.01 0.00 0.00 42.46 40.66 2bx9 s ILE 35 CO 0.04 0.45 0.88 -0.76 0.00 0.00 0.00 174.94 175.55 2bx9 s LEU 36 N -0.87 4.23 0.69 2.97 1.43 -1.26 0.51 118.68 126.38 2bx9 s LEU 36 Ca 0.10 1.66 -0.07 0.00 -1.03 0.00 0.00 54.13 54.80 2bx9 s LEU 36 Cb -0.10 -4.03 0.05 0.00 0.03 0.00 0.00 46.19 42.15 2bx9 s LEU 36 CO 0.00 -0.12 1.00 0.42 0.23 0.00 0.00 176.35 177.89 2bx9 s THR 37 N -1.74 2.44 0.27 5.49 -4.23 -0.51 -4.80 115.64 112.56 2bx9 s THR 37 Ca 0.51 -0.23 0.01 0.00 -1.18 0.00 0.00 61.69 60.80 2bx9 s THR 37 Cb -0.15 -3.06 0.26 0.00 1.34 0.00 0.00 72.50 70.89 2bx9 s THR 37 CO 0.20 -0.06 1.74 0.00 -0.54 0.00 0.00 174.62 175.96 2bx9 h ALA 38 N -0.56 1.32 -0.46 3.99 0.00 -1.89 -0.17 119.26 121.50 2bx9 h ALA 38 Ca -0.44 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 2bx9 h ALA 38 Cb 1.31 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 2bx9 h ALA 38 CO 0.60 -0.18 -0.07 0.37 0.00 0.00 0.00 179.25 179.97 2bx9 h GLN 39 N 0.54 0.85 -0.41 0.00 5.75 -1.90 -0.91 115.11 119.03 2bx9 h GLN 39 Ca 0.49 -0.31 -0.06 0.00 -0.15 0.00 0.00 58.65 58.63 2bx9 h GLN 39 Cb 0.80 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.27 2bx9 h GLN 39 CO -0.42 0.94 0.03 0.78 -2.65 0.00 0.00 178.83 177.50 2bx9 h GLY 40 N 0.70 0.75 0.54 2.39 0.00 -1.45 -2.24 103.07 103.75 2bx9 h GLY 40 Ca 0.12 -0.53 0.05 0.00 0.00 0.00 0.00 47.33 46.97 2bx9 h GLY 40 CO 0.04 0.49 0.04 -0.97 0.00 0.00 0.00 176.54 176.14 2bx9 h TYR 41 N 0.53 0.06 -0.21 5.60 0.05 -1.01 -1.21 116.97 120.78 2bx9 h TYR 41 Ca 0.12 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.97 2bx9 h TYR 41 Cb 0.43 0.02 -0.06 0.00 1.01 0.00 0.00 36.73 38.14 2bx9 h TYR 41 CO 0.03 -0.01 -0.16 1.15 -1.05 0.00 0.00 178.16 178.12 2bx9 h THR 42 N 0.15 0.55 -0.55 -2.88 2.02 -0.95 0.30 112.91 111.55 2bx9 h THR 42 Ca 0.16 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.32 2bx9 h THR 42 Cb 0.20 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2bx9 h THR 42 CO -0.24 0.00 0.24 -0.07 0.37 0.00 0.00 175.52 175.83 2bx9 h LEU 43 N -0.17 0.73 -0.26 2.58 3.38 -1.32 -2.29 115.31 117.97 2bx9 h LEU 43 Ca 0.12 -0.15 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 2bx9 h LEU 43 Cb 0.35 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2bx9 h LEU 43 CO -0.31 0.67 -0.46 0.25 0.09 0.00 0.00 178.44 178.69 2bx9 h LEU 44 N 0.74 0.86 -0.26 1.67 6.46 -0.81 -2.25 115.31 121.72 2bx9 h LEU 44 Ca 0.19 -0.53 -0.00 0.00 -0.12 0.00 0.00 57.88 57.41 2bx9 h LEU 44 Cb 0.15 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 39.82 2bx9 h LEU 44 CO -0.02 1.23 0.15 0.44 -0.62 0.00 0.00 178.44 179.62 2bx9 h ASP 45 N 0.52 0.31 -0.02 1.25 5.19 -0.38 -0.42 116.42 122.87 2bx9 h ASP 45 Ca 0.02 -0.05 0.03 0.00 -0.62 0.00 0.00 57.03 56.41 2bx9 h ASP 45 Cb 1.06 -0.08 -0.05 0.00 0.18 0.00 0.00 39.33 40.45 2bx9 h ASP 45 CO 0.10 0.27 -0.27 0.15 -3.12 0.00 0.00 179.24 176.37 2bx9 h PHE 46 N 0.32 -0.73 -0.17 4.55 3.57 -1.36 -1.26 116.94 121.86 2bx9 h PHE 46 Ca 0.09 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.64 2bx9 h PHE 46 Cb 0.02 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 2bx9 h PHE 46 CO -0.05 -0.36 0.04 0.82 -2.23 0.00 0.00 178.31 176.54 2bx9 h ILE 47 N -0.41 0.94 -0.79 1.41 1.08 -1.27 -1.62 117.51 116.85 2bx9 h ILE 47 Ca 0.07 -0.04 0.10 0.00 -0.39 0.00 0.00 64.86 64.60 2bx9 h ILE 47 Cb 0.50 0.81 -0.08 0.00 -3.07 0.00 0.00 36.82 34.98 2bx9 h ILE 47 CO -0.25 0.02 0.43 1.56 -0.69 0.00 0.00 178.15 179.22 2bx9 h GLN 48 N 0.12 0.69 0.00 2.37 4.20 -0.91 0.23 115.11 121.81 2bx9 h GLN 48 Ca 0.08 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2bx9 h GLN 48 Cb 0.06 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.68 2bx9 h GLN 48 CO -0.09 0.46 -0.20 1.57 -0.67 0.00 0.00 178.83 179.90 2bx9 h LYS 49 N 0.71 0.00 0.00 1.46 2.10 -0.78 -3.36 116.57 116.71 2bx9 h LYS 49 Ca 0.39 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.04 2bx9 h LYS 49 Cb 0.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.73 2bx9 h LYS 49 CO -0.27 0.00 -1.26 0.72 -2.00 0.00 0.00 179.45 176.64 2bx9 n HIS 50 N -2.36 0.00 -1.81 0.07 8.25 -0.65 -4.90 115.22 113.81 2bx9 n HIS 50 Ca 0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.08 2bx9 n HIS 50 Cb 0.45 -0.15 -0.03 0.00 1.12 0.00 0.00 29.99 31.39 2bx9 n HIS 50 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2bx9 s LEU 51 N -3.42 4.39 -1.56 2.41 2.96 0.77 -2.83 118.68 121.39 2bx9 s LEU 51 Ca -0.02 2.60 0.00 0.00 -0.22 0.00 0.00 54.13 56.49 2bx9 s LEU 51 Cb 0.04 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.18 2bx9 s LEU 51 CO 0.28 -0.96 0.00 0.59 -1.32 0.00 0.00 176.35 174.94 2bx9 n ASN 52 N 6.05 -5.28 0.00 3.68 5.03 -1.26 -5.00 115.26 118.48 2bx9 n ASN 52 Ca 0.17 0.06 0.00 0.00 0.87 0.00 0.00 54.58 55.68 2bx9 n ASN 52 Cb 0.40 -4.42 0.00 0.00 -1.02 0.00 0.00 39.78 34.74 2bx9 n ASN 52 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72