#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bzk n TYR 3 N 0.00 -2.21 0.01 -0.14 4.01 -1.26 -4.99 117.16 112.59 1bzk n TYR 3 Ca 0.00 -1.29 -0.10 0.00 -0.16 0.00 0.00 57.90 56.35 1bzk n TYR 3 Cb 0.00 1.37 -0.14 0.00 -0.31 0.00 0.00 39.34 40.26 1bzk n TYR 3 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1bzk h PRO 4 N 3.73 0.05 0.03 -0.72 0.13 -2.03 -3.21 132.00 129.99 1bzk h PRO 4 Ca -0.17 -0.09 -0.27 0.00 -0.87 0.00 0.00 66.00 64.61 1bzk h PRO 4 Cb 1.11 0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 1bzk h PRO 4 CO 0.10 0.74 -1.45 2.48 -0.23 0.00 0.00 178.00 179.64 1bzk n TYR 5 N -3.20 1.04 -0.05 1.56 0.18 -1.26 -3.01 117.16 112.42 1bzk n TYR 5 Ca -0.14 0.39 -0.09 0.00 1.88 0.00 0.00 57.90 59.94 1bzk n TYR 5 Cb 1.02 -1.11 -0.03 0.00 -0.38 0.00 0.00 39.34 38.84 1bzk n TYR 5 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 1bzk h TYR 6 N -0.78 0.24 -0.62 -3.48 5.03 -1.96 -1.17 116.97 114.23 1bzk h TYR 6 Ca -0.38 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 60.90 1bzk h TYR 6 Cb 1.47 -0.07 -0.03 0.00 1.55 0.00 0.00 36.73 39.64 1bzk h TYR 6 CO 0.09 0.14 0.21 1.25 -1.32 0.00 0.00 178.16 178.53 1bzk h LEU 7 N 0.26 0.89 -0.88 2.82 7.12 -1.74 -1.84 115.31 121.94 1bzk h LEU 7 Ca 0.09 -0.20 0.00 0.00 0.13 0.00 0.00 57.88 57.90 1bzk h LEU 7 Cb -0.00 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 39.90 1bzk h LEU 7 CO -0.04 0.85 0.00 -0.24 -0.13 0.00 0.00 178.44 178.87 1bzk n SER 8 N -4.40 1.05 0.00 1.25 2.88 -0.98 -2.18 113.62 111.24 1bzk n SER 8 Ca 0.04 -2.05 0.00 0.00 -1.33 0.00 0.00 58.87 55.52 1bzk n SER 8 Cb 0.20 -0.35 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 1bzk n SER 8 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1bzk n ASP 9 N -0.07 0.00 -0.02 -3.46 8.00 -0.48 -4.79 116.55 115.73 1bzk n ASP 9 Ca 0.02 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.34 1bzk n ASP 9 Cb 0.24 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.20 1bzk n ASP 9 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bzk n ILE 10 N 0.00 1.70 0.71 0.53 0.00 -1.26 -4.01 119.36 117.04 1bzk n ILE 10 Ca 0.00 -0.68 0.06 0.00 0.00 0.00 0.00 62.75 62.13 1bzk n ILE 10 Cb 0.00 -1.53 0.34 0.00 0.00 0.00 0.00 39.64 38.45 1bzk n ILE 10 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1bzk n THR 11 N -3.36 0.12 0.03 9.51 -2.24 -1.26 -2.78 114.28 114.31 1bzk n THR 11 Ca -0.31 0.03 -0.14 0.00 -2.27 0.00 0.00 64.05 61.36 1bzk n THR 11 Cb 1.04 -0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 68.40 1bzk n THR 11 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1bzk h ASP 12 N 0.00 0.68 -0.52 3.42 3.58 -1.57 -3.24 116.42 118.77 1bzk h ASP 12 Ca 0.00 -0.47 0.00 0.00 0.42 0.00 0.00 57.03 56.98 1bzk h ASP 12 Cb 0.02 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 40.87 1bzk h ASP 12 CO 0.00 1.25 0.00 0.00 -2.88 0.00 0.00 179.24 177.61 1bzk n ALA 13 N -2.56 2.29 -0.96 -0.78 0.00 -1.12 -4.54 120.51 112.85 1bzk n ALA 13 Ca -0.06 -1.19 0.00 0.00 0.00 0.00 0.00 53.44 52.19 1bzk n ALA 13 Cb 0.76 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 19.53 1bzk n ALA 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1bzk n PHE 14 N 1.11 0.00 -3.19 0.00 3.01 -1.22 -4.93 117.46 112.24 1bzk n PHE 14 Ca 0.18 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.43 1bzk n PHE 14 Cb 0.53 -0.01 -0.06 0.00 -0.01 0.00 0.00 39.48 39.92 1bzk n PHE 14 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1bzk n SER 15 N -1.07 -1.07 -0.08 4.37 2.88 -1.25 -4.97 113.62 112.43 1bzk n SER 15 Ca 0.00 -2.59 -0.13 0.00 -1.33 0.00 0.00 58.87 54.82 1bzk n SER 15 Cb 0.00 0.01 -0.08 0.00 -0.75 0.00 0.00 64.21 63.39 1bzk n SER 15 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1bzk h PRO 16 N 5.09 0.00 -0.01 -1.46 0.13 -1.80 -2.60 132.00 131.36 1bzk h PRO 16 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1bzk h PRO 16 Cb 0.95 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.08 1bzk h PRO 16 CO 0.32 0.61 0.12 -0.56 -0.23 0.00 0.00 178.00 178.26 1bzk h GLN 17 N -1.00 0.00 0.00 0.86 3.07 -1.93 -1.49 115.11 114.62 1bzk h GLN 17 Ca -0.14 0.00 -0.07 0.00 0.09 0.00 0.00 58.65 58.53 1bzk h GLN 17 Cb 0.86 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.41 1bzk h GLN 17 CO -0.08 0.00 -0.73 0.28 0.09 0.00 0.00 178.83 178.39 1bzk n VAL 18 N -3.04 1.45 -0.25 1.86 0.31 -1.25 -2.85 118.33 114.55 1bzk n VAL 18 Ca -0.03 0.15 0.06 0.00 -0.01 0.00 0.00 64.34 64.51 1bzk n VAL 18 Cb 0.19 -2.29 0.17 0.00 -0.91 0.00 0.00 33.84 30.99 1bzk n VAL 18 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1bzk h LEU 19 N -1.00 -0.23 0.59 7.52 3.38 -1.19 0.38 115.31 124.77 1bzk h LEU 19 Ca -0.10 0.18 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1bzk h LEU 19 Cb 0.73 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1bzk h LEU 19 CO -0.06 -0.14 -0.32 0.00 0.09 0.00 0.00 178.44 178.01 1bzk h ALA 20 N 1.68 -0.85 -0.87 1.53 0.00 -1.45 -2.29 119.26 117.01 1bzk h ALA 20 Ca 0.42 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 55.33 1bzk h ALA 20 Cb 0.74 0.37 -0.17 0.00 0.00 0.00 0.00 17.79 18.73 1bzk h ALA 20 CO -0.62 -0.98 -0.20 0.00 0.00 0.00 0.00 179.25 177.45 1bzk n ALA 21 N -2.50 0.23 0.14 0.00 0.00 0.03 0.16 120.51 118.58 1bzk n ALA 21 Ca -0.13 0.96 -0.07 0.00 0.00 0.00 0.00 53.44 54.20 1bzk n ALA 21 Cb 0.36 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.18 1bzk n ALA 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1bzk h VAL 22 N 0.00 0.00 0.29 0.00 2.07 -0.77 -3.07 116.25 114.77 1bzk h VAL 22 Ca 0.43 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.94 1bzk h VAL 22 Cb 0.68 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1bzk h VAL 22 CO -0.89 0.00 -0.14 0.16 0.02 0.00 0.00 177.57 176.72 1bzk h ILE 23 N -0.41 0.64 -0.50 4.57 3.07 -0.62 -3.11 117.51 121.16 1bzk h ILE 23 Ca -0.03 -0.74 0.19 0.00 1.55 0.00 0.00 64.86 65.83 1bzk h ILE 23 Cb 0.33 0.98 -0.07 0.00 -0.27 0.00 0.00 36.82 37.79 1bzk h ILE 23 CO 0.02 0.13 0.29 0.33 -1.05 0.00 0.00 178.15 177.88 1bzk n PHE 24 N -5.08 0.44 -0.02 0.16 7.35 0.43 0.26 117.46 121.00 1bzk n PHE 24 Ca -0.09 0.44 -0.09 0.00 -0.76 0.00 0.00 57.45 56.96 1bzk n PHE 24 Cb 0.27 -0.86 -0.07 0.00 0.35 0.00 0.00 39.48 39.16 1bzk n PHE 24 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1bzk h ILE 25 N 0.00 0.90 0.30 -2.13 2.04 -1.49 -0.38 117.51 116.75 1bzk h ILE 25 Ca 0.38 -1.49 -0.01 0.00 1.00 0.00 0.00 64.86 64.73 1bzk h ILE 25 Cb 1.08 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.80 1bzk h ILE 25 CO -0.29 0.28 -0.14 0.22 0.00 0.00 0.00 178.15 178.22 1bzk h TYR 26 N -0.95 -0.37 -0.96 1.37 3.20 0.37 -2.32 116.97 117.31 1bzk h TYR 26 Ca -0.01 -0.01 0.36 0.00 3.14 0.00 0.00 58.73 62.22 1bzk h TYR 26 Cb 0.53 0.12 -0.17 0.00 1.54 0.00 0.00 36.73 38.75 1bzk h TYR 26 CO 0.12 -0.23 0.37 1.19 -1.64 0.00 0.00 178.16 177.98 1bzk n PHE 27 N -3.12 0.98 -0.03 -3.82 3.01 0.31 0.27 117.46 115.04 1bzk n PHE 27 Ca -0.05 1.14 -0.08 0.00 1.01 0.00 0.00 57.45 59.47 1bzk n PHE 27 Cb 0.16 -1.45 -0.02 0.00 -0.01 0.00 0.00 39.48 38.16 1bzk n PHE 27 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1bzk h ALA 28 N 1.92 0.01 0.11 4.37 0.00 -0.53 0.64 119.26 125.77 1bzk h ALA 28 Ca 0.75 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.75 1bzk h ALA 28 Cb 1.88 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 19.94 1bzk h ALA 28 CO -0.79 -0.57 -0.45 0.00 0.00 0.00 0.00 179.25 177.45 1bzk h ALA 29 N 1.00 -0.80 -0.90 0.00 0.00 0.26 -2.85 119.26 115.98 1bzk h ALA 29 Ca 0.12 -0.08 -0.61 0.00 0.00 0.00 0.00 54.91 54.34 1bzk h ALA 29 Cb 0.31 0.75 -0.32 0.00 0.00 0.00 0.00 17.79 18.54 1bzk h ALA 29 CO -0.29 -1.02 0.36 1.28 0.00 0.00 0.00 179.25 179.58 1bzk n LEU 30 N -5.47 6.72 -0.08 0.00 4.32 -1.11 -4.48 117.00 116.89 1bzk n LEU 30 Ca -0.07 -4.35 -0.11 0.00 -0.02 0.00 0.00 56.01 51.46 1bzk n LEU 30 Cb 0.39 -0.78 -0.05 0.00 -1.62 0.00 0.00 43.42 41.36 1bzk n LEU 30 CO 0.18 1.61 -0.45 -0.24 -1.22 0.00 0.00 177.39 177.27 1bzk n SER 31 N -0.89 1.83 0.05 -1.43 2.88 0.22 -4.59 113.62 111.70 1bzk n SER 31 Ca 0.56 0.55 0.11 0.00 -1.33 0.00 0.00 58.87 58.76 1bzk n SER 31 Cb 0.83 -0.89 -0.01 0.00 -0.75 0.00 0.00 64.21 63.39 1bzk n SER 31 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1bzk n PRO 32 N -4.54 0.46 0.04 -1.46 -0.04 -1.26 -4.19 135.00 124.00 1bzk n PRO 32 Ca -0.16 0.01 -0.12 0.00 -0.04 0.00 0.00 63.50 63.19 1bzk n PRO 32 Cb 0.42 -1.66 -0.07 0.00 -0.04 0.00 0.00 33.50 32.14 1bzk n PRO 32 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bzk h ALA 33 N 2.27 -0.00 0.00 0.55 0.00 -1.81 -1.52 119.26 118.75 1bzk h ALA 33 Ca 0.00 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.62 1bzk h ALA 33 Cb 0.87 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.68 1bzk h ALA 33 CO 0.00 -0.48 -1.04 0.97 0.00 0.00 0.00 179.25 178.71 1bzk h ILE 34 N -0.06 1.29 -0.51 0.00 6.09 -1.82 -3.22 117.51 119.29 1bzk h ILE 34 Ca -0.00 -2.28 -0.25 0.00 -1.37 0.00 0.00 64.86 60.96 1bzk h ILE 34 Cb 0.05 2.39 -0.15 0.00 0.47 0.00 0.00 36.82 39.59 1bzk h ILE 34 CO 0.00 0.70 0.31 1.07 -3.07 0.00 0.00 178.15 177.17 1bzk n THR 35 N -3.84 2.10 -2.94 2.19 5.66 -1.20 -4.84 114.28 111.42 1bzk n THR 35 Ca -0.10 -1.00 -0.43 0.00 -3.05 0.00 0.00 64.05 59.47 1bzk n THR 35 Cb 0.88 -0.68 -0.05 0.00 -1.55 0.00 0.00 70.33 68.93 1bzk n THR 35 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 1bzk s PHE 36 N -1.78 2.84 0.00 1.09 5.36 -0.57 -4.68 117.98 120.23 1bzk s PHE 36 Ca 0.30 -0.37 0.00 0.00 -0.96 0.00 0.00 56.93 55.90 1bzk s PHE 36 Cb 0.25 -4.00 0.00 0.00 -0.34 0.00 0.00 43.02 38.93 1bzk s PHE 36 CO 0.06 -1.36 0.00 0.41 -1.46 0.00 0.00 175.22 172.88 1bzk n GLY 37 N 5.20 2.82 0.00 13.12 0.00 -1.26 -5.01 105.19 120.06 1bzk n GLY 37 Ca -0.03 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1bzk n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bzk n GLY 38 N 0.00 2.66 3.56 -0.02 0.00 -1.26 -5.06 105.19 105.07 1bzk n GLY 38 Ca 0.00 -0.94 -0.51 0.00 0.00 0.00 0.00 46.02 44.57 1bzk n GLY 38 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1bzk n LEU 39 N 0.00 2.57 -1.38 0.99 -0.00 -1.26 -4.79 117.00 113.12 1bzk n LEU 39 Ca 0.00 0.65 0.09 0.00 -0.00 0.00 0.00 56.01 56.74 1bzk n LEU 39 Cb 0.00 -1.29 0.32 0.00 -0.00 0.00 0.00 43.42 42.45 1bzk n LEU 39 CO 0.00 -0.51 0.78 -0.11 -0.00 0.00 0.00 177.39 177.55 1bzk n LEU 40 N 8.45 4.46 0.00 1.47 0.00 -1.26 -4.97 117.00 125.15 1bzk n LEU 40 Ca 0.34 -2.49 0.00 0.00 0.00 0.00 0.00 56.01 53.85 1bzk n LEU 40 Cb 0.24 -0.53 0.00 0.00 0.00 0.00 0.00 43.42 43.13 1bzk n LEU 40 CO 0.76 0.78 0.00 0.61 0.00 0.00 0.00 177.39 179.53 1bzk n GLY 41 N 0.79 4.00 0.15 -3.96 0.00 -1.26 -5.06 105.19 99.85 1bzk n GLY 41 Ca 0.23 -0.70 -0.05 0.00 0.00 0.00 0.00 46.02 45.50 1bzk n GLY 41 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1bzk h GLU 42 N 0.00 -0.29 0.00 1.61 4.81 -2.02 -3.55 114.58 115.14 1bzk h GLU 42 Ca 0.00 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1bzk h GLU 42 Cb 0.00 0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1bzk h GLU 42 CO 0.00 -0.20 0.00 1.17 -0.73 0.00 0.00 179.01 179.25