#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 0.26 -3.24 1.12 2.07 -2.10 -3.38 116.25 110.98 2bx9 h VAL 2 Ca 0.00 0.00 -0.49 0.00 0.82 0.00 0.00 66.70 67.03 2bx9 h VAL 2 Cb 0.00 0.26 -0.38 0.00 -1.52 0.00 0.00 31.29 29.65 2bx9 h VAL 2 CO 0.00 0.00 -0.78 0.27 0.02 0.00 0.00 177.57 177.08 2bx9 s ILE 3 N -6.10 0.72 0.57 4.57 -4.36 -1.26 -5.10 121.20 110.24 2bx9 s ILE 3 Ca -0.14 -0.21 0.09 0.00 -0.26 0.00 0.00 60.65 60.12 2bx9 s ILE 3 Cb 0.17 -0.88 0.07 0.00 1.25 0.00 0.00 42.46 43.08 2bx9 s ILE 3 CO 0.71 0.22 0.69 0.00 0.24 0.00 0.00 174.94 176.80 2bx9 s ALA 4 N 1.82 4.64 0.24 2.27 0.00 -1.26 -4.97 121.76 124.50 2bx9 s ALA 4 Ca 0.04 -1.90 -0.06 0.00 0.00 0.00 0.00 51.96 50.03 2bx9 s ALA 4 Cb -0.13 -1.26 0.23 0.00 0.00 0.00 0.00 23.12 21.96 2bx9 s ALA 4 CO -0.07 -0.75 1.84 1.15 0.00 0.00 0.00 175.76 177.93 2bx9 h THR 5 N 0.33 1.25 -0.08 0.00 2.02 -1.99 -1.44 112.91 113.01 2bx9 h THR 5 Ca -0.32 -0.69 0.02 0.00 0.77 0.00 0.00 66.41 66.20 2bx9 h THR 5 Cb 1.29 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 2bx9 h THR 5 CO 0.45 0.30 0.11 0.44 0.37 0.00 0.00 175.52 177.19 2bx9 h ASP 6 N 1.19 0.00 1.22 4.18 3.32 -1.96 0.30 116.42 124.67 2bx9 h ASP 6 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 2bx9 h ASP 6 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 2bx9 h ASP 6 CO -0.04 0.00 -0.17 0.47 -1.72 0.00 0.00 179.24 177.78 2bx9 n ASP 7 N -3.64 0.66 -0.07 6.45 8.00 -0.55 -4.35 116.55 123.05 2bx9 n ASP 7 Ca -0.01 0.42 -0.10 0.00 0.71 0.00 0.00 54.79 55.81 2bx9 n ASP 7 Cb 0.20 -0.47 -0.06 0.00 -0.02 0.00 0.00 41.12 40.77 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 -2.08 2.86 -4.11 0.64 4.77 0.30 -4.20 117.00 115.18 2bx9 n LEU 8 Ca 0.05 -0.06 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 2bx9 n LEU 8 Cb 0.42 -0.48 -0.15 0.00 -2.33 0.00 0.00 43.42 40.88 2bx9 n LEU 8 CO 0.32 0.71 -0.47 -1.61 -1.33 0.00 0.00 177.39 175.00 2bx9 s GLU 9 N -2.28 1.07 0.04 3.23 2.02 0.79 -1.26 118.70 122.31 2bx9 s GLU 9 Ca -0.19 -0.56 0.02 0.00 0.02 0.00 0.00 54.97 54.27 2bx9 s GLU 9 Cb 0.05 -1.05 -0.04 0.00 0.10 0.00 0.00 34.13 33.19 2bx9 s GLU 9 CO 0.32 0.28 0.03 0.08 0.02 0.00 0.00 175.26 175.98 2bx9 s VAL 10 N -0.45 4.26 0.26 2.63 1.01 0.65 -4.24 120.40 124.53 2bx9 s VAL 10 Ca 0.04 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 2bx9 s VAL 10 Cb -0.06 -2.97 -0.11 0.00 0.00 0.00 0.00 36.38 33.24 2bx9 s VAL 10 CO -0.00 0.25 1.58 0.00 0.00 0.00 0.00 175.10 176.93 2bx9 s ALA 11 N -1.22 3.75 0.13 5.51 0.00 -1.26 -0.98 121.76 127.69 2bx9 s ALA 11 Ca 0.24 1.51 -0.31 0.00 0.00 0.00 0.00 51.96 53.40 2bx9 s ALA 11 Cb -0.12 -3.64 -0.09 0.00 0.00 0.00 0.00 23.12 19.28 2bx9 s ALA 11 CO 0.15 -0.92 1.51 0.00 0.00 0.00 0.00 175.76 176.50 2bx9 h PRO 13 N 7.00 0.15 -0.05 0.00 0.13 -1.92 0.19 132.00 137.50 2bx9 h PRO 13 Ca -0.42 -0.21 -0.03 0.00 -0.87 0.00 0.00 66.00 64.47 2bx9 h PRO 13 Cb 1.20 0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2bx9 h PRO 13 CO 0.90 1.03 -0.07 -0.22 -0.23 0.00 0.00 178.00 179.41 2bx9 h LYS 14 N 0.06 0.14 0.00 0.86 1.63 -2.00 -3.36 116.57 113.90 2bx9 h LYS 14 Ca -0.06 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 2bx9 h LYS 14 Cb 1.70 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.34 2bx9 h LYS 14 CO 0.15 0.63 -0.99 0.00 -3.45 0.00 0.00 179.45 175.78 2bx9 n GLU 16 N -1.52 -3.04 0.00 0.00 1.02 0.65 -2.69 120.64 115.06 2bx9 n GLU 16 Ca 0.03 0.57 0.00 0.00 -0.02 0.00 0.00 57.16 57.74 2bx9 n GLU 16 Cb 0.31 -4.82 0.00 0.00 -0.02 0.00 0.00 31.44 26.92 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 -4.11 0.00 0.11 3.49 1.74 -1.23 -4.89 116.66 111.77 2bx9 n ARG 17 Ca -0.20 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 56.87 2bx9 n ARG 17 Cb 0.64 -1.42 0.22 0.00 -1.02 0.00 0.00 32.46 30.89 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 1.10 -0.01 7.54 0.00 -1.77 -3.41 119.26 122.71 2bx9 h ALA 18 Ca 0.00 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2bx9 h ALA 18 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2bx9 h ALA 18 CO 0.00 0.61 -0.00 0.41 0.00 0.00 0.00 179.25 180.26 2bx9 n GLY 19 N -0.13 0.28 3.02 0.00 0.00 -1.26 -4.83 105.19 102.27 2bx9 n GLY 19 Ca -0.02 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 2bx9 n GLY 19 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2bx9 s GLU 20 N -0.95 0.17 -0.33 1.61 2.12 -1.26 -2.52 118.70 117.53 2bx9 s GLU 20 Ca 0.00 0.49 -0.03 0.00 0.36 0.00 0.00 54.97 55.80 2bx9 s GLU 20 Cb 0.00 -0.14 0.06 0.00 0.26 0.00 0.00 34.13 34.32 2bx9 s GLU 20 CO 0.00 -0.17 0.07 0.42 -0.54 0.00 0.00 175.26 175.04 2bx9 s ILE 21 N 1.28 3.21 -1.40 -3.70 1.01 -0.51 -4.79 121.20 116.30 2bx9 s ILE 21 Ca -0.09 -1.51 -0.05 0.00 0.00 0.00 0.00 60.65 59.00 2bx9 s ILE 21 Cb -0.11 -2.93 0.03 0.00 0.01 0.00 0.00 42.46 39.46 2bx9 s ILE 21 CO -0.08 -0.27 0.76 1.21 0.00 0.00 0.00 174.94 176.56 2bx9 n GLU 22 N 4.65 -4.90 0.00 2.79 4.07 -1.26 -2.91 120.64 123.08 2bx9 n GLU 22 Ca -0.10 0.58 0.00 0.00 -0.06 0.00 0.00 57.16 57.58 2bx9 n GLU 22 Cb 0.43 -5.20 0.00 0.00 -0.06 0.00 0.00 31.44 26.61 2bx9 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2bx9 n GLY 23 N -1.66 2.87 3.86 8.31 0.00 -1.26 -5.03 105.19 112.28 2bx9 n GLY 23 Ca -0.19 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.79 5.17 0.67 2.61 -4.23 -1.15 -5.05 115.64 112.88 2bx9 s THR 24 Ca 0.00 0.50 -0.17 0.00 -1.18 0.00 0.00 61.69 60.84 2bx9 s THR 24 Cb 0.00 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.19 2bx9 s THR 24 CO 0.00 0.46 0.84 -2.65 -0.54 0.00 0.00 174.62 172.72 2bx9 n PRO 25 N 1.44 0.60 -2.59 3.99 -0.02 -1.26 -1.43 135.00 135.73 2bx9 n PRO 25 Ca -0.13 0.25 -0.43 0.00 -2.02 0.00 0.00 63.50 61.17 2bx9 n PRO 25 Cb 0.53 -2.08 -0.02 0.00 -0.02 0.00 0.00 33.50 31.91 2bx9 n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bx9 n PRO 27 N 7.41 0.04 -0.09 0.00 -0.02 -1.26 -1.73 135.00 139.34 2bx9 n PRO 27 Ca 0.12 0.31 -0.15 0.00 -2.02 0.00 0.00 63.50 61.76 2bx9 n PRO 27 Cb 0.48 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.39 2bx9 n PRO 27 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bx9 n ALA 28 N -1.36 0.68 -0.68 3.55 0.00 -1.26 -4.37 120.51 117.07 2bx9 n ALA 28 Ca 0.02 -0.51 0.07 0.00 0.00 0.00 0.00 53.44 53.02 2bx9 n ALA 28 Cb 0.04 -0.26 0.37 0.00 0.00 0.00 0.00 19.45 19.60 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 0.70 -2.44 0.00 0.00 7.64 -0.71 -1.44 113.62 117.37 2bx9 n SER 30 Ca 0.25 -1.13 0.00 0.00 1.01 0.00 0.00 58.87 59.00 2bx9 n SER 30 Cb 1.06 -2.17 0.00 0.00 -1.01 0.00 0.00 64.21 62.09 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 -1.27 2.32 0.21 0.23 0.00 -0.93 -4.87 105.19 100.87 2bx9 n GLY 31 Ca 0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.18 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 2.42 0.00 0.00 1.61 1.57 -1.51 -3.39 116.57 117.27 2bx9 h LYS 32 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2bx9 h LYS 32 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2bx9 h LYS 32 CO 0.00 0.28 0.00 0.41 -0.57 0.00 0.00 179.45 179.57 2bx9 n GLY 33 N 0.15 0.76 3.25 3.86 0.00 -1.26 -4.75 105.19 107.21 2bx9 n GLY 33 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.75 0.06 -0.05 1.61 0.11 -1.26 -2.37 120.40 115.74 2bx9 s VAL 34 Ca 0.00 -0.52 0.06 0.00 -2.93 0.00 0.00 61.98 58.59 2bx9 s VAL 34 Cb 0.00 -0.73 -0.01 0.00 -1.53 0.00 0.00 36.38 34.11 2bx9 s VAL 34 CO 0.00 -0.29 -0.23 -0.63 -3.33 0.00 0.00 175.10 170.62 2bx9 s ILE 35 N -1.72 1.93 0.41 7.04 1.01 -0.15 -4.75 121.20 124.98 2bx9 s ILE 35 Ca -0.11 -1.00 -0.23 0.00 0.00 0.00 0.00 60.65 59.32 2bx9 s ILE 35 Cb -0.04 -1.63 -0.09 0.00 0.01 0.00 0.00 42.46 40.71 2bx9 s ILE 35 CO 0.02 0.54 1.02 -0.76 0.00 0.00 0.00 174.94 175.76 2bx9 s LEU 36 N -0.15 4.07 0.72 2.97 1.43 -1.26 -0.25 118.68 126.21 2bx9 s LEU 36 Ca -0.03 1.93 -0.06 0.00 -1.03 0.00 0.00 54.13 54.94 2bx9 s LEU 36 Cb -0.13 -4.30 0.08 0.00 0.03 0.00 0.00 46.19 41.86 2bx9 s LEU 36 CO 0.03 -0.48 1.02 0.42 0.23 0.00 0.00 176.35 177.57 2bx9 s THR 37 N -1.81 2.26 0.29 5.49 -4.23 -0.39 -4.84 115.64 112.42 2bx9 s THR 37 Ca 0.60 -0.31 -0.00 0.00 -1.18 0.00 0.00 61.69 60.79 2bx9 s THR 37 Cb -0.18 -2.96 0.28 0.00 1.34 0.00 0.00 72.50 70.98 2bx9 s THR 37 CO 0.23 0.00 1.91 0.00 -0.54 0.00 0.00 174.62 176.22 2bx9 h ALA 38 N -0.63 1.47 -0.31 3.99 0.00 -1.89 0.13 119.26 122.03 2bx9 h ALA 38 Ca -0.43 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 2bx9 h ALA 38 Cb 1.30 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2bx9 h ALA 38 CO 0.56 0.39 -0.01 0.37 0.00 0.00 0.00 179.25 180.56 2bx9 h GLN 39 N 1.08 0.55 -0.59 0.00 5.75 -1.90 -0.31 115.11 119.69 2bx9 h GLN 39 Ca 0.40 -0.18 -0.01 0.00 -0.15 0.00 0.00 58.65 58.70 2bx9 h GLN 39 Cb 0.17 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.64 2bx9 h GLN 39 CO -0.15 0.70 0.32 0.78 -2.65 0.00 0.00 178.83 177.84 2bx9 h GLY 40 N 0.35 0.88 0.81 2.39 0.00 -1.56 -1.83 103.07 104.09 2bx9 h GLY 40 Ca 0.09 -0.40 0.03 0.00 0.00 0.00 0.00 47.33 47.05 2bx9 h GLY 40 CO 0.02 0.38 0.15 -0.97 0.00 0.00 0.00 176.54 176.12 2bx9 h TYR 41 N 0.80 0.28 -0.41 5.60 0.99 -0.57 -1.76 116.97 121.90 2bx9 h TYR 41 Ca 0.21 0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.89 2bx9 h TYR 41 Cb 0.04 -0.08 -0.02 0.00 1.00 0.00 0.00 36.73 37.68 2bx9 h TYR 41 CO -0.01 0.14 0.02 1.79 -0.00 0.00 0.00 178.16 180.10 2bx9 h THR 42 N 0.32 1.26 -0.42 -2.88 1.35 -0.80 0.27 112.91 112.00 2bx9 h THR 42 Ca 0.14 -0.97 0.01 0.00 -0.55 0.00 0.00 66.41 65.05 2bx9 h THR 42 Cb 0.07 1.08 -0.03 0.00 -1.73 0.00 0.00 68.15 67.55 2bx9 h THR 42 CO -0.11 0.33 0.26 0.25 -0.25 0.00 0.00 175.52 176.00 2bx9 h LEU 43 N 0.55 0.43 -0.34 3.87 6.46 -1.32 -1.62 115.31 123.34 2bx9 h LEU 43 Ca 0.12 -0.00 -0.15 0.00 -0.12 0.00 0.00 57.88 57.73 2bx9 h LEU 43 Cb 0.45 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 40.28 2bx9 h LEU 43 CO 0.02 0.31 -0.37 0.25 -0.62 0.00 0.00 178.44 178.02 2bx9 h LEU 44 N 0.53 0.91 -0.55 2.25 5.85 -1.14 -2.46 115.31 120.70 2bx9 h LEU 44 Ca 0.17 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.36 2bx9 h LEU 44 Cb -0.01 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 2bx9 h LEU 44 CO -0.06 1.21 0.18 -0.78 -0.34 0.00 0.00 178.44 178.65 2bx9 h ASP 45 N 0.64 0.80 0.22 1.25 1.82 -0.87 -1.11 116.42 119.16 2bx9 h ASP 45 Ca 0.05 -0.20 -0.00 0.00 -0.39 0.00 0.00 57.03 56.49 2bx9 h ASP 45 Cb 0.97 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 40.76 2bx9 h ASP 45 CO 0.09 0.78 -0.15 0.15 -1.61 0.00 0.00 179.24 178.50 2bx9 h PHE 46 N 0.77 -0.39 -0.48 0.28 3.57 -1.24 -1.49 116.94 117.96 2bx9 h PHE 46 Ca 0.18 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.70 2bx9 h PHE 46 Cb 0.26 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 2bx9 h PHE 46 CO 0.01 -0.23 0.28 0.82 -2.23 0.00 0.00 178.31 176.96 2bx9 h ILE 47 N -0.36 1.03 -0.33 1.41 1.08 -1.35 -2.14 117.51 116.84 2bx9 h ILE 47 Ca -0.02 -0.19 -0.05 0.00 -0.39 0.00 0.00 64.86 64.21 2bx9 h ILE 47 Cb 0.32 0.43 -0.02 0.00 -3.07 0.00 0.00 36.82 34.48 2bx9 h ILE 47 CO 0.00 0.10 -0.00 1.56 -0.69 0.00 0.00 178.15 179.12 2bx9 h GLN 48 N 0.56 0.52 -0.02 2.37 4.20 -1.10 0.21 115.11 121.84 2bx9 h GLN 48 Ca 0.20 -0.11 -0.16 0.00 0.06 0.00 0.00 58.65 58.64 2bx9 h GLN 48 Cb 0.04 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2bx9 h GLN 48 CO -0.10 0.54 -0.72 -0.22 -0.67 0.00 0.00 178.83 177.67 2bx9 h LYS 49 N 0.50 0.14 0.00 1.46 3.64 -0.89 -3.37 116.57 118.05 2bx9 h LYS 49 Ca 0.11 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2bx9 h LYS 49 Cb 0.32 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2bx9 h LYS 49 CO 0.01 0.80 -1.29 0.72 -2.27 0.00 0.00 179.45 177.42 2bx9 n HIS 50 N -3.75 0.00 -1.60 1.91 8.25 -0.84 -4.80 115.22 114.38 2bx9 n HIS 50 Ca -0.02 0.00 -0.49 0.00 -0.26 0.00 0.00 57.72 56.95 2bx9 n HIS 50 Cb 0.70 -0.16 -0.05 0.00 1.12 0.00 0.00 29.99 31.59 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 -1.73 2.96 -3.71 2.41 7.94 0.72 -2.83 117.00 122.77 2bx9 n LEU 51 Ca -0.01 0.70 -0.21 0.00 -1.11 0.00 0.00 56.01 55.37 2bx9 n LEU 51 Cb 0.18 -1.35 -0.07 0.00 0.53 0.00 0.00 43.42 42.72 2bx9 n LEU 51 CO 0.15 -0.37 -0.31 0.59 -1.11 0.00 0.00 177.39 176.34 2bx9 n ASN 52 N 8.30 0.54 0.00 1.96 5.03 -1.26 -5.01 115.26 124.82 2bx9 n ASN 52 Ca 0.29 -0.86 0.00 0.00 0.87 0.00 0.00 54.58 54.89 2bx9 n ASN 52 Cb 0.29 -1.07 0.00 0.00 -1.02 0.00 0.00 39.78 37.98 2bx9 n ASN 52 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60