#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 -1.49 -0.07 -0.14 9.36 -1.26 -4.98 117.16 118.58 1bnx n TYR 3 Ca 0.00 -2.91 -0.13 0.00 3.32 0.00 0.00 57.90 58.18 1bnx n TYR 3 Cb 0.00 0.43 -0.11 0.00 -0.63 0.00 0.00 39.34 39.03 1bnx n TYR 3 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1bnx h PRO 4 N 5.01 0.00 -0.36 2.98 0.13 -2.07 -3.34 132.00 134.35 1bnx h PRO 4 Ca 0.15 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.39 1bnx h PRO 4 Cb 0.95 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 1bnx h PRO 4 CO 0.33 0.84 0.58 -0.92 -0.23 0.00 0.00 178.00 178.60 1bnx h TYR 5 N -1.00 0.00 0.03 1.56 3.20 -2.02 0.16 116.97 118.90 1bnx h TYR 5 Ca -0.05 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.55 1bnx h TYR 5 Cb 0.89 0.00 0.02 0.00 1.54 0.00 0.00 36.73 39.18 1bnx h TYR 5 CO 0.21 0.00 -1.09 -0.92 -1.64 0.00 0.00 178.16 174.72 1bnx h TYR 6 N 0.00 1.04 0.18 -3.82 3.20 -1.99 -3.29 116.97 112.29 1bnx h TYR 6 Ca 0.17 -0.59 0.01 0.00 3.14 0.00 0.00 58.73 61.47 1bnx h TYR 6 Cb 1.33 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 39.46 1bnx h TYR 6 CO 0.00 1.42 -0.27 -0.07 -1.64 0.00 0.00 178.16 177.61 1bnx h LEU 7 N 0.37 -0.75 -2.72 2.82 4.07 -1.11 -1.76 115.31 116.23 1bnx h LEU 7 Ca -0.14 0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.90 1bnx h LEU 7 Cb 1.75 0.27 0.00 0.00 1.08 0.00 0.00 40.66 43.76 1bnx h LEU 7 CO 0.21 -0.37 0.07 0.28 -1.08 0.00 0.00 178.44 177.55 1bnx h SER 8 N -0.51 0.00 0.51 -0.43 0.02 -1.67 -2.97 113.55 108.50 1bnx h SER 8 Ca 0.02 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 1bnx h SER 8 Cb 0.51 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.06 1bnx h SER 8 CO -0.12 0.00 -0.25 0.44 -1.14 0.00 0.00 176.83 175.77 1bnx h ASP 9 N 0.00 -0.58 -0.46 3.07 3.32 -1.38 -1.89 116.42 118.50 1bnx h ASP 9 Ca 0.00 -0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.00 1bnx h ASP 9 Cb 0.14 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 1bnx h ASP 9 CO 0.00 -0.21 0.30 -0.29 -1.72 0.00 0.00 179.24 177.32 1bnx h ILE 10 N -1.02 1.10 -0.50 0.35 2.10 -1.56 -1.91 117.51 116.07 1bnx h ILE 10 Ca -0.07 -0.21 0.04 0.00 1.08 0.00 0.00 64.86 65.70 1bnx h ILE 10 Cb 0.61 0.44 -0.03 0.00 -1.09 0.00 0.00 36.82 36.75 1bnx h ILE 10 CO 0.12 0.11 0.33 0.74 -1.08 0.00 0.00 178.15 178.37 1bnx h THR 11 N 0.61 1.03 -0.22 2.19 2.02 -1.59 -0.98 112.91 115.96 1bnx h THR 11 Ca 0.17 -0.18 -0.14 0.00 0.77 0.00 0.00 66.41 67.03 1bnx h THR 11 Cb -0.05 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1bnx h THR 11 CO -0.05 0.10 -0.46 -0.78 0.37 0.00 0.00 175.52 174.70 1bnx h ASP 12 N 0.53 0.62 0.75 4.18 3.58 -0.58 -2.63 116.42 122.87 1bnx h ASP 12 Ca 0.21 -0.30 -0.03 0.00 0.42 0.00 0.00 57.03 57.33 1bnx h ASP 12 Cb 0.16 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.03 1bnx h ASP 12 CO -0.05 0.99 -0.14 0.58 -2.88 0.00 0.00 179.24 177.74 1bnx h VAL 13 N 0.46 0.42 0.00 2.25 2.07 -0.61 -2.75 116.25 118.09 1bnx h VAL 13 Ca 0.03 -0.79 -0.23 0.00 0.82 0.00 0.00 66.70 66.53 1bnx h VAL 13 Cb 0.98 1.57 -0.04 0.00 -1.52 0.00 0.00 31.29 32.28 1bnx h VAL 13 CO 0.09 0.14 -1.23 0.40 0.02 0.00 0.00 177.57 176.99 1bnx h ILE 14 N 0.00 1.30 -0.09 4.57 2.04 -1.06 -2.87 117.51 121.39 1bnx h ILE 14 Ca -0.00 -3.03 -0.20 0.00 1.00 0.00 0.00 64.86 62.63 1bnx h ILE 14 Cb 0.56 2.63 0.01 0.00 -0.74 0.00 0.00 36.82 39.28 1bnx h ILE 14 CO 0.02 0.74 -0.71 0.15 0.00 0.00 0.00 178.15 178.35 1bnx h PHE 15 N 0.00 0.89 0.00 1.37 3.04 -1.24 -3.11 116.94 117.89 1bnx h PHE 15 Ca -0.11 -0.42 -0.14 0.00 3.98 0.00 0.00 57.97 61.28 1bnx h PHE 15 Cb 1.82 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 40.18 1bnx h PHE 15 CO 0.00 1.24 -0.64 0.82 -2.02 0.00 0.00 178.31 177.70 1bnx h ILE 16 N 0.30 1.35 0.56 1.41 1.08 -1.62 -2.92 117.51 117.68 1bnx h ILE 16 Ca -0.06 -2.29 -0.03 0.00 -0.39 0.00 0.00 64.86 62.09 1bnx h ILE 16 Cb 1.36 2.27 0.01 0.00 -3.07 0.00 0.00 36.82 37.39 1bnx h ILE 16 CO 0.14 0.63 -0.27 0.22 -0.69 0.00 0.00 178.15 178.18 1bnx h TYR 17 N 0.00 -0.70 -0.03 1.37 5.03 -1.52 -2.58 116.97 118.54 1bnx h TYR 17 Ca -0.01 -0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.29 1bnx h TYR 17 Cb 1.22 0.23 -0.00 0.00 1.55 0.00 0.00 36.73 39.73 1bnx h TYR 17 CO 0.00 -0.38 0.02 0.74 -1.32 0.00 0.00 178.16 177.23 1bnx h PHE 18 N -0.95 0.02 0.78 -3.82 0.04 -1.62 -2.71 116.94 108.68 1bnx h PHE 18 Ca -0.08 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.66 1bnx h PHE 18 Cb 0.64 -0.01 0.01 0.00 2.20 0.00 0.00 35.95 38.79 1bnx h PHE 18 CO -0.00 0.01 -0.37 0.00 -0.60 0.00 0.00 178.31 177.35 1bnx h ALA 19 N 1.98 -1.04 0.18 2.45 0.00 -1.29 0.64 119.26 122.17 1bnx h ALA 19 Ca 0.01 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.70 1bnx h ALA 19 Cb 0.03 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1bnx h ALA 19 CO -0.00 -1.08 -0.20 0.00 0.00 0.00 0.00 179.25 177.97 1bnx h ALA 20 N -0.84 -0.39 -0.00 0.00 0.00 -1.22 -2.22 119.26 114.58 1bnx h ALA 20 Ca -0.11 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1bnx h ALA 20 Cb 0.80 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1bnx h ALA 20 CO 0.18 -0.75 0.00 1.28 0.00 0.00 0.00 179.25 179.96 1bnx n LEU 21 N -5.33 0.02 -0.25 0.00 4.32 -1.04 -4.22 117.00 110.50 1bnx n LEU 21 Ca -0.08 -0.01 0.05 0.00 -0.02 0.00 0.00 56.01 55.96 1bnx n LEU 21 Cb 0.24 -0.00 0.18 0.00 -1.62 0.00 0.00 43.42 42.21 1bnx n LEU 21 CO 0.29 0.00 0.92 -1.28 -1.22 0.00 0.00 177.39 176.11 1bnx h SER 22 N 0.03 -0.02 0.07 -1.43 0.87 0.95 -1.84 113.55 112.17 1bnx h SER 22 Ca 0.00 0.15 -0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1bnx h SER 22 Cb 0.01 0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 1bnx h SER 22 CO 0.00 -0.05 -0.03 1.55 -0.53 0.00 0.00 176.83 177.77 1bnx h PRO 23 N 0.25 -0.09 -0.98 2.24 0.13 -1.79 -3.09 132.00 128.68 1bnx h PRO 23 Ca 0.41 0.01 0.28 0.00 -0.87 0.00 0.00 66.00 65.83 1bnx h PRO 23 Cb 0.70 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 31.81 1bnx h PRO 23 CO -0.52 0.15 0.80 0.00 -0.23 0.00 0.00 178.00 178.21 1bnx h ALA 24 N -0.78 2.86 0.19 -0.56 0.00 -1.79 0.20 119.26 119.38 1bnx h ALA 24 Ca -0.01 -0.03 -0.34 0.00 0.00 0.00 0.00 54.91 54.53 1bnx h ALA 24 Cb 0.28 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.15 1bnx h ALA 24 CO 0.01 -1.31 -1.65 0.82 0.00 0.00 0.00 179.25 177.13 1bnx h ILE 25 N 0.00 1.06 0.00 0.00 1.08 -1.44 -3.30 117.51 114.91 1bnx h ILE 25 Ca 0.47 -2.62 -0.01 0.00 -0.39 0.00 0.00 64.86 62.31 1bnx h ILE 25 Cb 2.07 2.82 -0.00 0.00 -3.07 0.00 0.00 36.82 38.64 1bnx h ILE 25 CO -0.00 0.84 -0.03 0.74 -0.69 0.00 0.00 178.15 179.01 1bnx h THR 26 N 0.11 0.88 -3.24 -0.27 2.02 -0.54 -3.43 112.91 108.45 1bnx h THR 26 Ca -0.30 -0.10 -0.43 0.00 0.77 0.00 0.00 66.41 66.35 1bnx h THR 26 Cb 2.10 1.06 0.21 0.00 -1.74 0.00 0.00 68.15 69.77 1bnx h THR 26 CO 0.20 0.03 0.00 -0.36 0.37 0.00 0.00 175.52 175.75 1bnx s PHE 27 N -4.87 1.19 0.00 3.16 0.40 -0.85 -5.03 117.98 111.97 1bnx s PHE 27 Ca -0.05 1.06 0.00 0.00 -0.60 0.00 0.00 56.93 57.35 1bnx s PHE 27 Cb 0.16 -3.09 0.00 0.00 0.51 0.00 0.00 43.02 40.61 1bnx s PHE 27 CO 0.64 -3.99 0.00 0.41 0.70 0.00 0.00 175.22 172.98 1bnx n GLY 28 N 0.72 0.70 2.18 4.36 0.00 -1.26 -4.97 105.19 106.92 1bnx n GLY 28 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 3.83 1.43 0.07 -0.02 0.00 -1.26 -4.88 105.19 104.37 1bnx n GLY 29 Ca 0.00 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.19 1bnx n GLY 29 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1bnx h LEU 30 N 1.53 0.00 -0.53 0.99 6.46 -1.99 -3.36 115.31 118.41 1bnx h LEU 30 Ca -0.27 -0.59 -0.16 0.00 -0.12 0.00 0.00 57.88 56.74 1bnx h LEU 30 Cb 1.48 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.40 1bnx h LEU 30 CO 0.04 0.98 -0.60 0.25 -0.62 0.00 0.00 178.44 178.48 1bnx h LEU 31 N -1.00 0.49 0.00 2.25 5.85 -1.95 -3.50 115.31 117.45 1bnx h LEU 31 Ca -0.08 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1bnx h LEU 31 Cb 0.81 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1bnx h LEU 31 CO -0.05 0.98 0.00 0.61 -0.34 0.00 0.00 178.44 179.64 1bnx n GLY 32 N 0.32 -1.58 0.25 3.75 0.00 -1.26 -4.51 105.19 102.16 1bnx n GLY 32 Ca -0.03 -1.56 -0.05 0.00 0.00 0.00 0.00 46.02 44.38 1bnx n GLY 32 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1bnx h GLU 33 N 0.00 0.77 -0.02 1.61 4.11 -1.95 -3.51 114.58 115.59 1bnx h GLU 33 Ca 0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.38 1bnx h GLU 33 Cb 0.00 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1bnx h GLU 33 CO 0.00 0.51 0.00 1.17 0.07 0.00 0.00 179.01 180.76