#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 0.00 0.02 2.89 4.19 -1.26 -4.96 117.16 118.04 1bzk n TYR 3 Ca 0.00 0.00 -0.07 0.00 3.31 0.00 0.00 57.90 61.14 1bzk n TYR 3 Cb 0.00 0.00 -0.12 0.00 0.49 0.00 0.00 39.34 39.71 1bzk n TYR 3 CO 0.00 0.00 0.00 -1.00 0.91 0.00 0.00 176.86 176.77 1bzk h PRO 4 N 0.00 0.00 0.00 2.98 0.13 -2.07 -3.31 132.00 129.73 1bzk h PRO 4 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1bzk h PRO 4 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1bzk h PRO 4 CO 0.00 0.70 0.00 0.98 -0.23 0.00 0.00 178.00 179.45 1bzk n TYR 5 N -3.18 0.50 0.00 1.56 9.36 -1.26 -3.42 117.16 120.73 1bzk n TYR 5 Ca -0.08 0.17 -0.13 0.00 3.32 0.00 0.00 57.90 61.18 1bzk n TYR 5 Cb 0.98 -0.78 -0.09 0.00 -0.63 0.00 0.00 39.34 38.81 1bzk n TYR 5 CO 0.00 0.00 0.00 -0.92 0.22 0.00 0.00 176.86 176.16 1bzk h TYR 6 N 0.00 -0.03 -0.51 2.98 3.20 -1.97 -3.07 116.97 117.57 1bzk h TYR 6 Ca 0.00 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.78 1bzk h TYR 6 Cb 0.46 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 1bzk h TYR 6 CO 0.00 0.40 -0.04 1.25 -1.64 0.00 0.00 178.16 178.14 1bzk h LEU 7 N -0.46 0.92 -1.85 2.82 6.46 -1.77 -2.56 115.31 118.87 1bzk h LEU 7 Ca -0.00 -0.32 0.23 0.00 -0.12 0.00 0.00 57.88 57.67 1bzk h LEU 7 Cb 0.44 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 40.08 1bzk h LEU 7 CO 0.00 1.03 0.60 -1.28 -0.62 0.00 0.00 178.44 178.17 1bzk h SER 8 N 0.80 0.12 0.59 1.25 0.87 -1.58 0.29 113.55 115.88 1bzk h SER 8 Ca 0.14 0.01 -0.20 0.00 -1.23 0.00 0.00 61.79 60.51 1bzk h SER 8 Cb 0.58 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 1bzk h SER 8 CO 0.03 0.05 -0.91 0.44 -0.53 0.00 0.00 176.83 175.91 1bzk h ASP 9 N 0.12 0.27 0.00 6.23 5.19 -1.36 -3.08 116.42 123.80 1bzk h ASP 9 Ca 0.42 -0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 1bzk h ASP 9 Cb 1.48 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.91 1bzk h ASP 9 CO -0.06 1.04 0.01 0.40 -3.12 0.00 0.00 179.24 177.51 1bzk h ILE 10 N 0.11 0.00 0.00 0.35 1.08 -0.32 -1.27 117.51 117.46 1bzk h ILE 10 Ca -0.05 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.39 1bzk h ILE 10 Cb 1.55 0.73 -0.00 0.00 -3.07 0.00 0.00 36.82 36.02 1bzk h ILE 10 CO 0.14 0.00 -0.62 0.35 -0.69 0.00 0.00 178.15 177.33 1bzk n THR 11 N -2.66 1.43 -0.24 -0.27 -2.24 -1.16 -3.28 114.28 105.86 1bzk n THR 11 Ca -0.02 0.18 -0.05 0.00 -2.27 0.00 0.00 64.05 61.89 1bzk n THR 11 Cb 0.06 -2.35 0.05 0.00 -2.10 0.00 0.00 70.33 66.00 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 -1.00 0.77 -1.35 3.42 1.82 -1.56 -2.31 116.42 116.20 1bzk h ASP 12 Ca -0.05 -0.02 -0.70 0.00 -0.39 0.00 0.00 57.03 55.87 1bzk h ASP 12 Cb 0.62 -0.19 -0.29 0.00 0.68 0.00 0.00 39.33 40.15 1bzk h ASP 12 CO -0.03 0.56 0.85 0.00 -1.61 0.00 0.00 179.24 179.01 1bzk n ALA 13 N -2.29 6.34 -0.35 -0.78 0.00 -0.49 -4.75 120.51 118.20 1bzk n ALA 13 Ca 0.06 -3.73 0.30 0.00 0.00 0.00 0.00 53.44 50.07 1bzk n ALA 13 Cb 0.02 -1.78 0.51 0.00 0.00 0.00 0.00 19.45 18.20 1bzk n ALA 13 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1bzk n PHE 14 N -0.77 0.54 -2.37 0.00 -0.00 -0.87 -4.79 117.46 109.20 1bzk n PHE 14 Ca 0.59 0.54 0.00 0.00 -0.00 0.00 0.00 57.45 58.58 1bzk n PHE 14 Cb 0.52 -0.95 0.00 0.00 -0.00 0.00 0.00 39.48 39.05 1bzk n PHE 14 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1bzk n SER 15 N -4.21 -5.13 -0.03 -2.13 2.88 -1.26 -4.83 113.62 98.91 1bzk n SER 15 Ca 0.30 0.47 -0.02 0.00 -1.33 0.00 0.00 58.87 58.29 1bzk n SER 15 Cb 1.17 -1.13 -0.01 0.00 -0.75 0.00 0.00 64.21 63.49 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 3.47 0.00 -0.13 -1.46 0.13 -1.98 -2.99 132.00 129.04 1bzk h PRO 16 Ca 0.00 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.17 1bzk h PRO 16 Cb 0.42 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.51 1bzk h PRO 16 CO 0.00 0.00 -0.11 0.37 -0.23 0.00 0.00 178.00 178.03 1bzk h GLN 17 N -0.47 -0.13 0.00 0.86 4.15 -2.02 0.19 115.11 117.69 1bzk h GLN 17 Ca 0.00 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 1bzk h GLN 17 Cb 0.23 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.95 1bzk h GLN 17 CO 0.00 -0.09 -0.04 0.28 -1.93 0.00 0.00 178.83 177.06 1bzk h VAL 18 N -0.13 0.37 0.54 2.39 2.07 -1.96 -2.74 116.25 116.78 1bzk h VAL 18 Ca 0.09 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1bzk h VAL 18 Cb 0.26 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1bzk h VAL 18 CO -0.21 0.03 -0.41 0.25 0.02 0.00 0.00 177.57 177.25 1bzk h LEU 19 N 0.00 -1.08 -0.20 2.57 5.85 -0.47 -0.68 115.31 121.30 1bzk h LEU 19 Ca -0.00 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.85 1bzk h LEU 19 Cb 0.13 0.34 -0.07 0.00 0.37 0.00 0.00 40.66 41.44 1bzk h LEU 19 CO 0.00 -0.60 -0.26 0.00 -0.34 0.00 0.00 178.44 177.25 1bzk h ALA 20 N -0.64 -0.20 -0.71 1.25 0.00 -1.36 -1.33 119.26 116.29 1bzk h ALA 20 Ca -0.06 0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.04 1bzk h ALA 20 Cb 0.78 0.52 -0.13 0.00 0.00 0.00 0.00 17.79 18.96 1bzk h ALA 20 CO 0.01 -0.70 -0.28 0.00 0.00 0.00 0.00 179.25 178.27 1bzk h ALA 21 N 0.69 0.20 -0.51 0.00 0.00 -1.43 0.86 119.26 119.07 1bzk h ALA 21 Ca 0.12 0.23 0.10 0.00 0.00 0.00 0.00 54.91 55.36 1bzk h ALA 21 Cb 0.47 0.73 -0.10 0.00 0.00 0.00 0.00 17.79 18.90 1bzk h ALA 21 CO -0.36 -0.56 -0.12 0.28 0.00 0.00 0.00 179.25 178.48 1bzk h VAL 22 N -0.08 0.50 0.00 0.00 2.07 0.03 0.19 116.25 118.96 1bzk h VAL 22 Ca 0.30 -0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.77 1bzk h VAL 22 Cb 0.56 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1bzk h VAL 22 CO -0.76 0.00 -0.24 0.40 0.02 0.00 0.00 177.57 176.99 1bzk h ILE 23 N 0.01 0.86 -0.86 4.57 2.04 -0.52 -2.60 117.51 121.01 1bzk h ILE 23 Ca 0.24 -0.93 0.10 0.00 1.00 0.00 0.00 64.86 65.28 1bzk h ILE 23 Cb 0.37 1.55 -0.08 0.00 -0.74 0.00 0.00 36.82 37.93 1bzk h ILE 23 CO -0.52 0.23 0.50 0.15 0.00 0.00 0.00 178.15 178.51 1bzk h PHE 24 N 0.00 0.90 -0.04 1.37 3.57 0.11 0.21 116.94 123.05 1bzk h PHE 24 Ca -0.00 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.38 1bzk h PHE 24 Cb 0.53 -0.27 0.01 0.00 2.79 0.00 0.00 35.95 39.01 1bzk h PHE 24 CO 0.00 0.35 -0.54 0.82 -2.23 0.00 0.00 178.31 176.71 1bzk h ILE 25 N 0.81 1.40 0.00 1.41 5.03 -1.34 -0.08 117.51 124.74 1bzk h ILE 25 Ca 0.42 -1.95 0.00 0.00 -0.12 0.00 0.00 64.86 63.21 1bzk h ILE 25 Cb 0.42 2.42 0.00 0.00 -3.03 0.00 0.00 36.82 36.63 1bzk h ILE 25 CO -0.26 0.57 0.09 0.22 -0.68 0.00 0.00 178.15 178.09 1bzk h TYR 26 N -0.03 0.00 0.06 1.37 3.20 -1.09 0.20 116.97 120.68 1bzk h TYR 26 Ca -0.06 0.00 -0.33 0.00 3.14 0.00 0.00 58.73 61.48 1bzk h TYR 26 Cb 1.22 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.46 1bzk h TYR 26 CO 0.13 0.00 -1.89 0.34 -1.64 0.00 0.00 178.16 175.11 1bzk n PHE 27 N -2.89 1.07 0.01 -3.82 -0.00 0.66 -3.37 117.46 109.12 1bzk n PHE 27 Ca -0.02 0.30 -0.01 0.00 -0.00 0.00 0.00 57.45 57.71 1bzk n PHE 27 Cb 0.15 -1.17 -0.00 0.00 -0.00 0.00 0.00 39.48 38.46 1bzk n PHE 27 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1bzk h ALA 28 N 0.54 -0.21 0.50 3.13 0.00 0.12 -2.33 119.26 121.01 1bzk h ALA 28 Ca -0.37 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1bzk h ALA 28 Cb 2.03 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.83 1bzk h ALA 28 CO 0.08 -0.21 -0.32 0.00 0.00 0.00 0.00 179.25 178.80 1bzk h ALA 29 N -1.81 -0.79 -0.21 0.00 0.00 -1.13 -2.28 119.26 113.03 1bzk h ALA 29 Ca -0.01 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1bzk h ALA 29 Cb 0.04 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1bzk h ALA 29 CO 0.01 -0.96 0.09 1.28 0.00 0.00 0.00 179.25 179.67 1bzk n LEU 30 N -5.45 3.20 -0.00 0.00 4.32 -1.22 -4.25 117.00 113.60 1bzk n LEU 30 Ca -0.12 -1.64 -0.12 0.00 -0.02 0.00 0.00 56.01 54.11 1bzk n LEU 30 Cb 0.35 -0.57 -0.08 0.00 -1.62 0.00 0.00 43.42 41.50 1bzk n LEU 30 CO 0.33 0.51 0.73 -1.28 -1.22 0.00 0.00 177.39 176.46 1bzk h SER 31 N 0.60 0.05 0.25 -1.43 0.87 -0.82 -3.12 113.55 109.95 1bzk h SER 31 Ca 0.09 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1bzk h SER 31 Cb 1.22 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1bzk h SER 31 CO 0.22 0.35 -0.32 -0.81 -0.53 0.00 0.00 176.83 175.73 1bzk n PRO 32 N -4.91 0.74 0.05 2.24 -0.04 -1.26 -4.03 135.00 127.79 1bzk n PRO 32 Ca -0.07 -0.45 -0.03 0.00 -0.04 0.00 0.00 63.50 62.91 1bzk n PRO 32 Cb 0.18 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.07 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 3.59 0.63 -0.27 0.55 0.00 -1.76 -3.32 119.26 118.67 1bzk h ALA 33 Ca 0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 54.91 53.91 1bzk h ALA 33 Cb 0.52 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1bzk h ALA 33 CO 0.00 1.05 -0.26 -0.84 0.00 0.00 0.00 179.25 179.20 1bzk h ILE 34 N 0.00 1.27 -0.24 0.00 3.07 -1.68 -2.12 117.51 117.81 1bzk h ILE 34 Ca -0.12 -1.31 0.00 0.00 1.55 0.00 0.00 64.86 64.98 1bzk h ILE 34 Cb 1.66 1.35 0.00 0.00 -0.27 0.00 0.00 36.82 39.56 1bzk h ILE 34 CO 0.07 0.42 0.00 1.07 -1.05 0.00 0.00 178.15 178.66 1bzk n THR 35 N -4.11 0.59 0.94 0.16 5.66 -1.25 -3.57 114.28 112.70 1bzk n THR 35 Ca -0.00 -0.40 0.12 0.00 -3.05 0.00 0.00 64.05 60.71 1bzk n THR 35 Cb 0.42 -0.06 0.23 0.00 -1.55 0.00 0.00 70.33 69.37 1bzk n THR 35 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 1bzk n PHE 36 N 0.24 0.07 -0.94 1.09 -0.00 -0.80 -5.00 117.46 112.12 1bzk n PHE 36 Ca 0.09 0.02 0.00 0.00 -0.00 0.00 0.00 57.45 57.56 1bzk n PHE 36 Cb 0.36 -0.30 0.00 0.00 -0.00 0.00 0.00 39.48 39.54 1bzk n PHE 36 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1bzk n GLY 37 N 1.48 -1.54 0.87 7.13 0.00 -1.23 -5.04 105.19 106.85 1bzk n GLY 37 Ca 0.05 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.06 0.71 0.00 -0.02 0.00 -1.26 -4.78 105.19 99.79 1bzk n GLY 38 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 0.17 0.25 -0.06 0.99 -0.00 -1.26 -4.84 117.00 112.25 1bzk n LEU 39 Ca 0.00 0.48 -0.10 0.00 -0.00 0.00 0.00 56.01 56.39 1bzk n LEU 39 Cb 0.84 -0.46 -0.03 0.00 -0.00 0.00 0.00 43.42 43.77 1bzk n LEU 39 CO -0.02 -0.46 -0.66 0.18 -0.00 0.00 0.00 177.39 176.43 1bzk n LEU 40 N -1.87 1.62 0.00 1.47 4.77 -1.26 -5.12 117.00 116.62 1bzk n LEU 40 Ca 0.00 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1bzk n LEU 40 Cb 0.00 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 1bzk n LEU 40 CO 0.00 -0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.46 1bzk n GLY 41 N 1.98 3.95 0.00 -0.72 0.00 -1.26 -5.10 105.19 104.03 1bzk n GLY 41 Ca -0.17 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1bzk n GLY 41 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bzk n GLU 42 N 0.00 0.00 -0.08 1.61 4.71 -1.26 -4.38 120.64 121.24 1bzk n GLU 42 Ca 0.00 0.15 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 1bzk n GLU 42 Cb 0.00 -0.55 0.00 0.00 -1.01 0.00 0.00 31.44 29.88 1bzk n GLU 42 CO 0.00 0.00 0.00 0.36 0.09 0.00 0.00 177.13 177.58