#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 0.41 -3.36 3.17 2.07 -2.10 -3.37 116.25 113.07 2bx9 h VAL 2 Ca 0.00 -0.02 -0.56 0.00 0.82 0.00 0.00 66.70 66.94 2bx9 h VAL 2 Cb 0.00 0.35 -0.39 0.00 -1.52 0.00 0.00 31.29 29.73 2bx9 h VAL 2 CO 0.00 0.01 -0.77 -0.63 0.02 0.00 0.00 177.57 176.20 2bx9 s ILE 3 N -6.19 0.93 0.45 4.57 1.01 -1.26 -5.11 121.20 115.60 2bx9 s ILE 3 Ca -0.14 -0.97 0.06 0.00 0.00 0.00 0.00 60.65 59.60 2bx9 s ILE 3 Cb 0.19 -1.43 0.01 0.00 0.01 0.00 0.00 42.46 41.25 2bx9 s ILE 3 CO 0.74 -0.29 0.61 0.00 0.00 0.00 0.00 174.94 176.00 2bx9 s ALA 4 N 1.65 4.35 0.21 9.38 0.00 -1.26 -4.98 121.76 131.11 2bx9 s ALA 4 Ca 0.00 -1.57 -0.10 0.00 0.00 0.00 0.00 51.96 50.29 2bx9 s ALA 4 Cb -0.18 -1.75 0.18 0.00 0.00 0.00 0.00 23.12 21.38 2bx9 s ALA 4 CO -0.11 -0.38 1.86 1.15 0.00 0.00 0.00 175.76 178.28 2bx9 h THR 5 N 0.52 1.14 0.00 0.00 2.02 -1.98 -0.81 112.91 113.79 2bx9 h THR 5 Ca -0.41 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.45 2bx9 h THR 5 Cb 1.28 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 2bx9 h THR 5 CO 0.47 0.17 0.00 -0.90 0.37 0.00 0.00 175.52 175.63 2bx9 n ASP 6 N -4.62 0.00 0.06 4.18 5.68 -1.26 -0.82 116.55 119.77 2bx9 n ASP 6 Ca 0.07 0.24 0.12 0.00 -0.50 0.00 0.00 54.79 54.72 2bx9 n ASP 6 Cb 0.06 -0.36 0.21 0.00 -1.14 0.00 0.00 41.12 39.88 2bx9 n ASP 6 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2bx9 n ASP 7 N -1.36 0.69 -0.10 -1.12 8.00 -0.32 -4.32 116.55 118.03 2bx9 n ASP 7 Ca 0.05 0.16 -0.14 0.00 0.71 0.00 0.00 54.79 55.57 2bx9 n ASP 7 Cb 0.13 0.05 -0.09 0.00 -0.02 0.00 0.00 41.12 41.19 2bx9 n ASP 7 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2bx9 n LEU 8 N -2.09 2.77 -4.26 0.64 4.77 -0.18 -4.30 117.00 114.35 2bx9 n LEU 8 Ca 0.04 -0.05 -0.25 0.00 -0.03 0.00 0.00 56.01 55.71 2bx9 n LEU 8 Cb 0.43 -0.66 -0.14 0.00 -2.33 0.00 0.00 43.42 40.73 2bx9 n LEU 8 CO 0.35 0.77 -0.52 -1.61 -1.33 0.00 0.00 177.39 175.05 2bx9 s GLU 9 N -2.38 1.31 -0.12 3.23 2.02 -0.01 -1.05 118.70 121.70 2bx9 s GLU 9 Ca -0.26 -1.00 -0.02 0.00 0.02 0.00 0.00 54.97 53.71 2bx9 s GLU 9 Cb 0.07 -1.47 -0.03 0.00 0.10 0.00 0.00 34.13 32.81 2bx9 s GLU 9 CO 0.43 0.37 -0.05 0.08 0.02 0.00 0.00 175.26 176.11 2bx9 s VAL 10 N -0.90 3.84 0.07 2.63 1.01 0.12 -4.35 120.40 122.83 2bx9 s VAL 10 Ca 0.07 -0.40 -0.31 0.00 0.00 0.00 0.00 61.98 61.35 2bx9 s VAL 10 Cb -0.09 -2.64 -0.08 0.00 0.00 0.00 0.00 36.38 33.58 2bx9 s VAL 10 CO 0.02 0.54 1.52 0.00 0.00 0.00 0.00 175.10 177.18 2bx9 s ALA 11 N -0.17 3.65 -0.12 5.51 0.00 -1.26 -0.28 121.76 129.09 2bx9 s ALA 11 Ca 0.03 1.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.82 2bx9 s ALA 11 Cb -0.13 -3.62 -0.05 0.00 0.00 0.00 0.00 23.12 19.32 2bx9 s ALA 11 CO 0.03 -0.90 1.70 0.00 0.00 0.00 0.00 175.76 176.58 2bx9 n PRO 13 N 7.45 0.10 0.12 0.00 -0.02 -1.26 -1.10 135.00 140.29 2bx9 n PRO 13 Ca 0.19 0.07 0.06 0.00 -2.02 0.00 0.00 63.50 61.80 2bx9 n PRO 13 Cb 0.44 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.43 2bx9 n PRO 13 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2bx9 h LYS 14 N 0.00 0.00 0.00 -0.52 3.64 -1.99 -3.40 116.57 114.31 2bx9 h LYS 14 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2bx9 h LYS 14 Cb 0.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2bx9 h LYS 14 CO 0.00 0.23 0.00 0.00 -2.27 0.00 0.00 179.45 177.41 2bx9 n GLU 16 N -0.04 -4.47 -0.89 0.00 1.02 -0.26 -2.73 120.64 113.27 2bx9 n GLU 16 Ca 0.00 0.84 0.00 0.00 -0.02 0.00 0.00 57.16 57.98 2bx9 n GLU 16 Cb 0.22 -5.55 0.00 0.00 -0.02 0.00 0.00 31.44 26.09 2bx9 n GLU 16 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2bx9 n ARG 17 N -3.75 0.00 0.08 3.49 0.63 -1.23 -4.93 116.66 110.95 2bx9 n ARG 17 Ca -0.11 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.69 2bx9 n ARG 17 Cb 0.61 -2.39 -0.14 0.00 0.45 0.00 0.00 32.46 31.00 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 0.21 0.00 5.13 0.00 -1.77 -3.44 119.26 119.39 2bx9 h ALA 18 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 54.91 53.97 2bx9 h ALA 18 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2bx9 h ALA 18 CO 0.00 1.09 0.00 0.41 0.00 0.00 0.00 179.25 180.75 2bx9 n GLY 19 N 1.51 2.97 3.58 0.00 0.00 -1.26 -4.87 105.19 107.12 2bx9 n GLY 19 Ca -0.08 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 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 0.00 2.68 -0.30 1.61 2.02 -1.26 -2.45 118.70 120.99 2bx9 s GLU 20 Ca 0.00 -0.61 -0.05 0.00 0.02 0.00 0.00 54.97 54.33 2bx9 s GLU 20 Cb 0.00 -2.55 0.02 0.00 0.10 0.00 0.00 34.13 31.70 2bx9 s GLU 20 CO 0.00 0.65 0.05 0.42 0.02 0.00 0.00 175.26 176.40 2bx9 s ILE 21 N -0.85 3.62 -1.45 -1.63 1.01 0.23 -4.65 121.20 117.47 2bx9 s ILE 21 Ca 0.14 -0.93 -0.12 0.00 0.00 0.00 0.00 60.65 59.74 2bx9 s ILE 21 Cb -0.11 -2.93 0.08 0.00 0.01 0.00 0.00 42.46 39.52 2bx9 s ILE 21 CO 0.03 0.02 0.71 -0.62 0.00 0.00 0.00 174.94 175.08 2bx9 n GLU 22 N 4.79 -4.22 0.00 2.79 1.02 -1.26 -0.91 120.64 122.85 2bx9 n GLU 22 Ca -0.14 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.54 2bx9 n GLU 22 Cb 0.47 -5.33 0.00 0.00 -0.02 0.00 0.00 31.44 26.55 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 -1.41 3.29 3.88 0.62 0.00 -1.26 -5.05 105.19 105.25 2bx9 n GLY 23 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.48 5.34 0.12 2.61 -4.23 -0.09 -5.00 115.64 111.91 2bx9 s THR 24 Ca 0.00 0.23 -0.35 0.00 -1.18 0.00 0.00 61.69 60.39 2bx9 s THR 24 Cb 0.00 -3.53 -0.15 0.00 1.34 0.00 0.00 72.50 70.16 2bx9 s THR 24 CO 0.00 0.46 1.52 -2.65 -0.54 0.00 0.00 174.62 173.41 2bx9 n PRO 25 N 1.45 1.81 -2.36 3.99 -0.02 -1.26 0.74 135.00 139.35 2bx9 n PRO 25 Ca -0.14 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.57 2bx9 n PRO 25 Cb 0.53 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.60 2bx9 n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bx9 h PRO 27 N 7.52 0.00 0.00 0.00 0.11 -1.92 0.20 132.00 137.92 2bx9 h PRO 27 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2bx9 h PRO 27 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2bx9 h PRO 27 CO 0.88 0.09 0.00 0.00 -0.21 0.00 0.00 178.00 178.76 2bx9 n ALA 28 N -2.40 -0.14 1.92 -0.75 0.00 -1.26 -4.16 120.51 113.73 2bx9 n ALA 28 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.53 2bx9 n ALA 28 Cb 0.18 0.00 0.66 0.00 0.00 0.00 0.00 19.45 20.29 2bx9 n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bx9 n SER 30 N -0.73 -3.21 0.00 0.00 7.64 0.70 -1.93 113.62 116.09 2bx9 n SER 30 Ca 0.17 -0.85 0.00 0.00 1.01 0.00 0.00 58.87 59.20 2bx9 n SER 30 Cb 0.11 -3.64 0.00 0.00 -1.01 0.00 0.00 64.21 59.67 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 -1.66 2.84 0.13 0.23 0.00 -1.14 -4.85 105.19 100.73 2bx9 n GLY 31 Ca -0.07 0.00 -0.01 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 2.28 0.00 0.00 1.61 1.79 -1.62 -3.41 116.57 117.22 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 0.66 0.00 0.41 -1.08 0.00 0.00 179.45 179.44 2bx9 n GLY 33 N 0.65 0.81 3.39 3.86 0.00 -1.26 -4.76 105.19 107.88 2bx9 n GLY 33 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.15 0.00 -0.10 1.61 0.11 -1.26 -2.20 120.40 115.42 2bx9 s VAL 34 Ca 0.00 -0.02 0.03 0.00 -2.93 0.00 0.00 61.98 59.06 2bx9 s VAL 34 Cb 0.00 -0.70 -0.01 0.00 -1.53 0.00 0.00 36.38 34.14 2bx9 s VAL 34 CO 0.00 -0.01 -0.19 -0.63 -3.33 0.00 0.00 175.10 170.94 2bx9 s ILE 35 N 0.14 2.57 0.30 7.04 1.01 0.62 -4.79 121.20 128.10 2bx9 s ILE 35 Ca -0.01 -0.85 -0.27 0.00 0.00 0.00 0.00 60.65 59.52 2bx9 s ILE 35 Cb -0.03 -2.02 -0.10 0.00 0.01 0.00 0.00 42.46 40.32 2bx9 s ILE 35 CO 0.01 0.55 0.95 -0.76 0.00 0.00 0.00 174.94 175.69 2bx9 s LEU 36 N 0.12 4.43 0.62 2.97 1.43 -1.26 0.16 118.68 127.15 2bx9 s LEU 36 Ca -0.09 1.88 -0.05 0.00 -1.03 0.00 0.00 54.13 54.83 2bx9 s LEU 36 Cb -0.15 -3.90 0.03 0.00 0.03 0.00 0.00 46.19 42.20 2bx9 s LEU 36 CO 0.06 -0.01 0.92 0.42 0.23 0.00 0.00 176.35 177.96 2bx9 s THR 37 N -1.49 3.06 0.27 5.49 -4.23 -0.22 -4.87 115.64 113.65 2bx9 s THR 37 Ca 0.48 -0.20 -0.01 0.00 -1.18 0.00 0.00 61.69 60.78 2bx9 s THR 37 Cb -0.21 -3.24 0.26 0.00 1.34 0.00 0.00 72.50 70.65 2bx9 s THR 37 CO 0.26 -0.24 1.83 0.00 -0.54 0.00 0.00 174.62 175.94 2bx9 h ALA 38 N -0.27 1.38 -0.43 3.99 0.00 -1.90 0.21 119.26 122.24 2bx9 h ALA 38 Ca -0.45 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.50 2bx9 h ALA 38 Cb 1.28 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2bx9 h ALA 38 CO 0.59 0.20 0.27 0.37 0.00 0.00 0.00 179.25 180.68 2bx9 h GLN 39 N 0.94 0.52 -0.45 0.00 5.75 -1.90 -0.70 115.11 119.26 2bx9 h GLN 39 Ca 0.45 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 58.87 2bx9 h GLN 39 Cb 0.41 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 2bx9 h GLN 39 CO -0.25 0.35 0.07 0.78 -2.65 0.00 0.00 178.83 177.13 2bx9 h GLY 40 N 0.54 0.80 1.02 2.39 0.00 -1.38 -2.55 103.07 103.89 2bx9 h GLY 40 Ca 0.17 -0.53 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 2bx9 h GLY 40 CO -0.07 0.50 0.48 -0.97 0.00 0.00 0.00 176.54 176.48 2bx9 h TYR 41 N 0.61 1.18 -0.26 5.60 -1.99 -0.84 -1.67 116.97 119.61 2bx9 h TYR 41 Ca 0.14 -0.03 0.01 0.00 2.00 0.00 0.00 58.73 60.85 2bx9 h TYR 41 Cb 0.38 -0.38 -0.02 0.00 2.00 0.00 0.00 36.73 38.72 2bx9 h TYR 41 CO 0.03 0.82 0.16 1.15 -0.00 0.00 0.00 178.16 180.31 2bx9 h THR 42 N 1.20 1.04 0.21 -2.88 2.02 -0.82 0.16 112.91 113.84 2bx9 h THR 42 Ca 0.30 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.36 2bx9 h THR 42 Cb 0.02 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 2bx9 h THR 42 CO -0.05 0.06 -0.10 -0.07 0.37 0.00 0.00 175.52 175.73 2bx9 h LEU 43 N 0.33 -0.24 -0.78 2.58 3.38 -1.38 -1.71 115.31 117.49 2bx9 h LEU 43 Ca 0.10 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.11 2bx9 h LEU 43 Cb -0.02 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 2bx9 h LEU 43 CO -0.04 -0.17 0.50 0.25 0.09 0.00 0.00 178.44 179.07 2bx9 h LEU 44 N -0.28 0.82 -0.49 1.67 6.46 -1.09 -0.32 115.31 122.07 2bx9 h LEU 44 Ca -0.03 -0.00 -0.16 0.00 -0.12 0.00 0.00 57.88 57.57 2bx9 h LEU 44 Cb 0.21 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.96 2bx9 h LEU 44 CO 0.04 0.56 -0.51 0.44 -0.62 0.00 0.00 178.44 178.36 2bx9 h ASP 45 N 0.96 0.72 -0.22 1.25 3.32 -0.64 0.21 116.42 122.03 2bx9 h ASP 45 Ca 0.32 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2bx9 h ASP 45 Cb 0.02 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 2bx9 h ASP 45 CO -0.12 1.10 0.08 0.15 -1.72 0.00 0.00 179.24 178.73 2bx9 h PHE 46 N 0.51 0.33 -0.04 4.55 3.57 -0.69 -1.72 116.94 123.45 2bx9 h PHE 46 Ca 0.02 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2bx9 h PHE 46 Cb 1.06 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.70 2bx9 h PHE 46 CO 0.05 0.38 -0.01 0.82 -2.23 0.00 0.00 178.31 177.32 2bx9 h ILE 47 N 0.19 1.29 -0.03 1.41 1.08 -0.92 -2.09 117.51 118.43 2bx9 h ILE 47 Ca 0.07 -0.89 0.01 0.00 -0.39 0.00 0.00 64.86 63.66 2bx9 h ILE 47 Cb 0.19 1.82 -0.00 0.00 -3.07 0.00 0.00 36.82 35.76 2bx9 h ILE 47 CO -0.00 0.24 0.03 1.56 -0.69 0.00 0.00 178.15 179.28 2bx9 h GLN 48 N -0.28 0.00 0.13 2.37 4.20 -0.98 0.29 115.11 120.83 2bx9 h GLN 48 Ca 0.01 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.43 2bx9 h GLN 48 Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 2bx9 h GLN 48 CO 0.00 0.00 -1.36 -0.22 -0.67 0.00 0.00 178.83 176.59 2bx9 h LYS 49 N 0.00 0.27 0.00 1.46 3.64 -1.19 -3.39 116.57 117.36 2bx9 h LYS 49 Ca 0.02 -0.45 -0.00 0.00 -1.27 0.00 0.00 60.65 58.94 2bx9 h LYS 49 Cb 0.07 0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2bx9 h LYS 49 CO -0.00 1.18 -1.64 0.72 -2.27 0.00 0.00 179.45 177.44 2bx9 n HIS 50 N -3.50 0.00 -1.83 1.91 8.25 -0.80 -4.90 115.22 114.35 2bx9 n HIS 50 Ca -0.12 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.92 2bx9 n HIS 50 Cb 1.03 -0.32 -0.03 0.00 1.12 0.00 0.00 29.99 31.79 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 -3.97 4.38 -1.45 2.41 2.96 0.98 -2.90 118.68 121.09 2bx9 s LEU 51 Ca -0.05 2.69 -0.08 0.00 -0.22 0.00 0.00 54.13 56.47 2bx9 s LEU 51 Cb 0.09 -3.58 0.04 0.00 0.50 0.00 0.00 46.19 43.24 2bx9 s LEU 51 CO 0.58 -0.92 0.68 0.59 -1.32 0.00 0.00 176.35 175.96 2bx9 n ASN 52 N 4.73 -5.16 -0.28 3.68 3.02 -1.26 -4.99 115.26 114.99 2bx9 n ASN 52 Ca 0.16 -0.42 0.04 0.00 -0.03 0.00 0.00 54.58 54.32 2bx9 n ASN 52 Cb 0.38 -4.17 0.03 0.00 -0.61 0.00 0.00 39.78 35.40 2bx9 n ASN 52 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81