#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bnx n TYR 3 N 0.00 0.00 0.00 -1.55 4.19 -1.26 -5.00 117.16 113.54 1bnx n TYR 3 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1bnx n TYR 3 Cb 0.00 0.00 0.00 0.00 0.49 0.00 0.00 39.34 39.83 1bnx n TYR 3 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 1bnx n PRO 4 N 0.00 0.00 0.22 2.98 -0.04 -1.26 -4.29 135.00 132.62 1bnx n PRO 4 Ca 0.00 0.12 0.18 0.00 -0.04 0.00 0.00 63.50 63.76 1bnx n PRO 4 Cb 0.00 -0.50 0.84 0.00 -0.04 0.00 0.00 33.50 33.81 1bnx n PRO 4 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1bnx h TYR 5 N 0.00 0.00 0.37 0.54 5.03 -1.98 -2.32 116.97 118.61 1bnx h TYR 5 Ca 0.00 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 1bnx h TYR 5 Cb 0.00 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.28 1bnx h TYR 5 CO 0.00 0.00 -0.19 -0.92 -1.32 0.00 0.00 178.16 175.73 1bnx h TYR 6 N 0.00 -0.50 0.00 -3.82 3.20 -1.95 -2.69 116.97 111.21 1bnx h TYR 6 Ca 0.08 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 1bnx h TYR 6 Cb 0.64 0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.07 1bnx h TYR 6 CO 0.00 -0.31 -0.27 -0.07 -1.64 0.00 0.00 178.16 175.87 1bnx h LEU 7 N -0.52 0.00 -2.86 2.82 3.38 -1.61 -3.08 115.31 113.44 1bnx h LEU 7 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1bnx h LEU 7 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1bnx h LEU 7 CO 0.07 0.27 0.00 0.28 0.09 0.00 0.00 178.44 179.15 1bnx h SER 8 N 0.00 0.00 -0.24 -0.43 0.02 -1.12 -1.87 113.55 109.91 1bnx h SER 8 Ca -0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 1bnx h SER 8 Cb 0.95 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.48 1bnx h SER 8 CO 0.04 0.00 -0.22 0.44 -1.14 0.00 0.00 176.83 175.95 1bnx h ASP 9 N 0.00 0.71 0.10 3.07 5.19 -1.49 -2.12 116.42 121.88 1bnx h ASP 9 Ca 0.00 -0.25 -0.29 0.00 -0.62 0.00 0.00 57.03 55.87 1bnx h ASP 9 Cb 0.00 -0.19 0.03 0.00 0.18 0.00 0.00 39.33 39.35 1bnx h ASP 9 CO 0.00 0.92 -1.21 0.40 -3.12 0.00 0.00 179.24 176.22 1bnx h ILE 10 N 0.62 1.28 -0.22 0.35 1.08 -1.56 -2.93 117.51 116.13 1bnx h ILE 10 Ca 0.09 -2.42 -0.04 0.00 -0.39 0.00 0.00 64.86 62.09 1bnx h ILE 10 Cb 0.70 2.65 -0.01 0.00 -3.07 0.00 0.00 36.82 37.09 1bnx h ILE 10 CO 0.05 0.74 -0.06 0.74 -0.69 0.00 0.00 178.15 178.93 1bnx h THR 11 N 0.29 1.17 -0.34 -0.27 2.02 -1.50 -2.09 112.91 112.18 1bnx h THR 11 Ca -0.18 -0.71 -0.17 0.00 0.77 0.00 0.00 66.41 66.12 1bnx h THR 11 Cb 1.88 1.07 -0.00 0.00 -1.74 0.00 0.00 68.15 69.36 1bnx h THR 11 CO 0.23 0.23 -0.44 0.44 0.37 0.00 0.00 175.52 176.36 1bnx h ASP 12 N 0.32 0.96 -0.53 4.18 5.19 -1.41 -2.35 116.42 122.78 1bnx h ASP 12 Ca 0.07 -0.46 -0.03 0.00 -0.62 0.00 0.00 57.03 55.99 1bnx h ASP 12 Cb 0.31 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 39.53 1bnx h ASP 12 CO 0.01 1.25 0.24 0.58 -3.12 0.00 0.00 179.24 178.20 1bnx h VAL 13 N 0.71 1.20 0.00 -1.35 2.07 -1.22 -1.60 116.25 116.06 1bnx h VAL 13 Ca 0.05 -0.61 -0.08 0.00 0.82 0.00 0.00 66.70 66.87 1bnx h VAL 13 Cb 1.03 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1bnx h VAL 13 CO 0.10 0.24 -0.40 0.40 0.02 0.00 0.00 177.57 177.93 1bnx h ILE 14 N 0.81 0.94 0.92 4.57 2.04 -1.21 -2.16 117.51 123.43 1bnx h ILE 14 Ca 0.19 -1.60 -0.05 0.00 1.00 0.00 0.00 64.86 64.41 1bnx h ILE 14 Cb 0.14 1.96 0.01 0.00 -0.74 0.00 0.00 36.82 38.19 1bnx h ILE 14 CO -0.02 0.40 -0.44 0.15 0.00 0.00 0.00 178.15 178.23 1bnx h PHE 15 N 0.00 -1.15 0.00 1.37 3.57 -0.75 -2.52 116.94 117.47 1bnx h PHE 15 Ca -0.00 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1bnx h PHE 15 Cb 0.93 0.38 0.00 0.00 2.79 0.00 0.00 35.95 40.05 1bnx h PHE 15 CO 0.00 -0.71 0.00 -0.89 -2.23 0.00 0.00 178.31 174.48 1bnx n ILE 16 N -5.53 0.52 0.10 1.41 -0.00 -1.17 -2.66 119.36 112.02 1bnx n ILE 16 Ca -0.15 0.13 -0.04 0.00 -0.00 0.00 0.00 62.75 62.68 1bnx n ILE 16 Cb 0.49 -0.79 0.02 0.00 -0.00 0.00 0.00 39.64 39.36 1bnx n ILE 16 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.55 176.77 1bnx h TYR 17 N 0.00 0.00 0.00 1.39 3.20 -0.97 -1.95 116.97 118.64 1bnx h TYR 17 Ca 0.00 -0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.70 1bnx h TYR 17 Cb 0.28 -0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 1bnx h TYR 17 CO 0.00 0.81 -1.39 0.74 -1.64 0.00 0.00 178.16 176.68 1bnx h PHE 18 N 0.00 0.00 0.00 -3.82 -1.00 -1.25 -3.31 116.94 107.56 1bnx h PHE 18 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1bnx h PHE 18 Cb 1.44 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.00 1bnx h PHE 18 CO 0.00 0.59 -0.02 0.00 -1.61 0.00 0.00 178.31 177.27 1bnx h ALA 19 N 1.41 0.00 -0.51 2.45 0.00 -1.51 -2.35 119.26 118.74 1bnx h ALA 19 Ca -0.16 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.82 1bnx h ALA 19 Cb 1.59 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 19.33 1bnx h ALA 19 CO 0.05 0.02 0.06 0.00 0.00 0.00 0.00 179.25 179.38 1bnx h ALA 20 N -1.09 0.54 0.00 0.00 0.00 -1.57 -1.34 119.26 115.80 1bnx h ALA 20 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1bnx h ALA 20 Cb 0.02 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1bnx h ALA 20 CO 0.00 -0.34 -0.14 -0.11 0.00 0.00 0.00 179.25 178.66 1bnx n LEU 21 N -5.17 0.50 -0.14 0.00 7.94 -1.25 -4.16 117.00 114.73 1bnx n LEU 21 Ca 0.06 0.44 -0.05 0.00 -1.11 0.00 0.00 56.01 55.36 1bnx n LEU 21 Cb 0.27 -0.35 0.02 0.00 0.53 0.00 0.00 43.42 43.88 1bnx n LEU 21 CO 0.18 -0.07 0.71 -1.28 -1.11 0.00 0.00 177.39 175.81 1bnx h SER 22 N 0.00 -0.72 0.21 1.96 0.87 -0.67 -1.75 113.55 113.46 1bnx h SER 22 Ca 0.00 0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 1bnx h SER 22 Cb 0.64 0.39 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 1bnx h SER 22 CO 0.00 -0.24 -0.10 1.55 -0.53 0.00 0.00 176.83 177.51 1bnx h PRO 23 N -0.12 -0.27 -0.90 2.24 0.13 -1.72 -3.24 132.00 128.12 1bnx h PRO 23 Ca 0.21 0.02 0.26 0.00 -0.87 0.00 0.00 66.00 65.62 1bnx h PRO 23 Cb 0.45 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.60 1bnx h PRO 23 CO -0.52 0.11 0.79 0.00 -0.23 0.00 0.00 178.00 178.15 1bnx h ALA 24 N -0.43 2.76 -0.10 -0.56 0.00 -1.71 0.11 119.26 119.34 1bnx h ALA 24 Ca -0.03 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1bnx h ALA 24 Cb 0.50 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1bnx h ALA 24 CO 0.05 -1.26 -0.41 0.82 0.00 0.00 0.00 179.25 178.45 1bnx h ILE 25 N 0.00 1.39 -0.68 0.00 2.04 -1.34 -3.16 117.51 115.77 1bnx h ILE 25 Ca 0.43 -1.76 0.14 0.00 1.00 0.00 0.00 64.86 64.67 1bnx h ILE 25 Cb 2.01 2.22 -0.04 0.00 -0.74 0.00 0.00 36.82 40.27 1bnx h ILE 25 CO -0.00 0.52 0.46 0.74 0.00 0.00 0.00 178.15 179.86 1bnx h THR 26 N 0.01 0.81 -3.05 -0.27 2.02 -0.83 -3.42 112.91 108.19 1bnx h THR 26 Ca -0.02 -0.12 -0.34 0.00 0.77 0.00 0.00 66.41 66.69 1bnx h THR 26 Cb 1.05 0.44 0.18 0.00 -1.74 0.00 0.00 68.15 68.08 1bnx h THR 26 CO 0.09 0.06 0.05 0.49 0.37 0.00 0.00 175.52 176.58 1bnx n PHE 27 N -4.46 -3.75 0.00 3.16 3.72 -1.16 -5.05 117.46 109.93 1bnx n PHE 27 Ca 0.12 -0.84 0.00 0.00 -0.05 0.00 0.00 57.45 56.68 1bnx n PHE 27 Cb 0.50 -1.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.02 1bnx n PHE 27 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bnx n GLY 28 N -4.17 1.73 2.48 1.37 0.00 -1.26 -5.01 105.19 100.34 1bnx n GLY 28 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 1bnx n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bnx n GLY 29 N 3.84 1.12 0.21 -0.02 0.00 -1.26 -4.99 105.19 104.09 1bnx n GLY 29 Ca 0.00 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 1bnx n GLY 29 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1bnx h LEU 30 N 1.07 0.63 0.10 0.99 3.38 -1.97 -3.32 115.31 116.18 1bnx h LEU 30 Ca -0.35 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.38 1bnx h LEU 30 Cb 1.24 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1bnx h LEU 30 CO -0.13 0.70 -0.05 0.25 0.09 0.00 0.00 178.44 179.30 1bnx h LEU 31 N 0.53 -0.11 -0.74 1.67 5.85 -1.99 -3.50 115.31 117.02 1bnx h LEU 31 Ca 0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1bnx h LEU 31 Cb 0.32 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1bnx h LEU 31 CO 0.00 0.05 -0.67 0.61 -0.34 0.00 0.00 178.44 178.10 1bnx n GLY 32 N 1.08 -4.24 0.07 3.75 0.00 -1.25 -4.91 105.19 99.70 1bnx n GLY 32 Ca -0.02 -0.80 -0.08 0.00 0.00 0.00 0.00 46.02 45.13 1bnx n GLY 32 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1bnx h GLU 33 N 1.30 0.00 0.00 1.61 5.08 -1.97 -3.54 114.58 117.07 1bnx h GLU 33 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bnx h GLU 33 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1bnx h GLU 33 CO 0.00 0.41 0.00 1.17 -1.00 0.00 0.00 179.01 179.59