#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 -3.01 0.00 -1.55 4.01 -1.26 -5.01 117.16 110.34 1bzk n TYR 3 Ca 0.00 -1.92 0.00 0.00 -0.16 0.00 0.00 57.90 55.82 1bzk n TYR 3 Cb 0.00 1.14 0.00 0.00 -0.31 0.00 0.00 39.34 40.17 1bzk n TYR 3 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1bzk n PRO 4 N 2.85 0.00 0.19 -0.72 -0.04 -1.26 -4.04 135.00 131.98 1bzk n PRO 4 Ca 0.21 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.73 1bzk n PRO 4 Cb 0.54 -0.12 0.35 0.00 -0.04 0.00 0.00 33.50 34.23 1bzk n PRO 4 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1bzk h TYR 5 N 0.00 0.00 0.37 0.54 3.20 -1.97 -1.83 116.97 117.28 1bzk h TYR 5 Ca 0.00 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1bzk h TYR 5 Cb 0.00 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 1bzk h TYR 5 CO 0.00 0.36 -0.21 1.88 -1.64 0.00 0.00 178.16 178.54 1bzk h TYR 6 N 0.00 -0.56 -0.00 -3.82 0.05 -1.95 -2.66 116.97 108.03 1bzk h TYR 6 Ca -0.00 -0.01 -0.06 0.00 0.05 0.00 0.00 58.73 58.71 1bzk h TYR 6 Cb 0.89 0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.83 1bzk h TYR 6 CO 0.00 -0.34 -0.23 -0.07 -1.05 0.00 0.00 178.16 176.47 1bzk h LEU 7 N -0.55 0.21 -1.47 3.88 3.38 -1.69 -3.17 115.31 115.89 1bzk h LEU 7 Ca -0.04 -0.77 0.33 0.00 0.09 0.00 0.00 57.88 57.49 1bzk h LEU 7 Cb 0.45 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 1bzk h LEU 7 CO 0.05 0.95 1.12 -1.28 0.09 0.00 0.00 178.44 179.37 1bzk h SER 8 N -0.51 0.00 0.15 -0.43 0.87 -1.34 0.30 113.55 112.60 1bzk h SER 8 Ca -0.03 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1bzk h SER 8 Cb 0.99 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1bzk h SER 8 CO 0.05 0.00 -0.07 0.44 -0.53 0.00 0.00 176.83 176.71 1bzk h ASP 9 N 0.00 -0.17 -0.26 6.23 5.19 -1.44 -1.19 116.42 124.78 1bzk h ASP 9 Ca 0.55 -0.13 -0.08 0.00 -0.62 0.00 0.00 57.03 56.75 1bzk h ASP 9 Cb 2.77 0.05 -0.02 0.00 0.18 0.00 0.00 39.33 42.31 1bzk h ASP 9 CO -0.01 0.03 -0.09 0.40 -3.12 0.00 0.00 179.24 176.45 1bzk h ILE 10 N -0.37 1.24 -0.04 0.35 5.03 -0.57 -1.79 117.51 121.36 1bzk h ILE 10 Ca -0.02 -1.07 0.00 0.00 -0.12 0.00 0.00 64.86 63.65 1bzk h ILE 10 Cb 0.29 1.05 0.00 0.00 -3.03 0.00 0.00 36.82 35.14 1bzk h ILE 10 CO 0.03 0.36 0.00 0.35 -0.68 0.00 0.00 178.15 178.22 1bzk n THR 11 N -4.19 0.06 1.39 -0.27 -2.24 -1.00 -3.52 114.28 104.50 1bzk n THR 11 Ca 0.01 -0.07 0.13 0.00 -2.27 0.00 0.00 64.05 61.85 1bzk n THR 11 Cb 0.33 -0.06 0.69 0.00 -2.10 0.00 0.00 70.33 69.19 1bzk n THR 11 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1bzk n ASP 12 N -0.46 0.00 -1.06 3.42 2.03 -0.46 -2.62 116.55 117.40 1bzk n ASP 12 Ca 0.08 -0.41 0.11 0.00 0.52 0.00 0.00 54.79 55.09 1bzk n ASP 12 Cb 0.08 -0.15 0.25 0.00 -0.72 0.00 0.00 41.12 40.58 1bzk n ASP 12 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bzk n ALA 13 N -1.15 2.43 0.02 -1.67 0.00 -1.23 -4.13 120.51 114.78 1bzk n ALA 13 Ca 0.15 -0.93 0.04 0.00 0.00 0.00 0.00 53.44 52.70 1bzk n ALA 13 Cb 0.15 -0.92 0.22 0.00 0.00 0.00 0.00 19.45 18.89 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 1.28 1.09 0.01 0.00 3.72 -1.08 -4.08 117.46 118.41 1bzk n PHE 14 Ca 0.19 -0.38 -0.21 0.00 -0.05 0.00 0.00 57.45 57.00 1bzk n PHE 14 Cb 0.55 -0.30 -0.14 0.00 -0.94 0.00 0.00 39.48 38.65 1bzk n PHE 14 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1bzk h SER 15 N 2.17 0.37 0.06 4.37 0.02 -1.83 -3.29 113.55 115.43 1bzk h SER 15 Ca 0.00 -0.88 -0.13 0.00 -0.84 0.00 0.00 61.79 59.94 1bzk h SER 15 Cb 1.25 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.67 1bzk h SER 15 CO 0.25 1.51 -0.64 1.55 -1.14 0.00 0.00 176.83 178.36 1bzk h PRO 16 N -0.40 0.13 -0.92 3.45 0.13 -1.91 -3.15 132.00 129.33 1bzk h PRO 16 Ca -0.24 -0.22 0.21 0.00 -0.87 0.00 0.00 66.00 64.89 1bzk h PRO 16 Cb 1.66 0.08 -0.07 0.00 0.13 0.00 0.00 31.00 32.81 1bzk h PRO 16 CO 0.07 1.10 0.61 1.96 -0.23 0.00 0.00 178.00 181.52 1bzk h GLN 17 N -0.70 0.38 -0.13 0.86 4.20 -1.76 0.84 115.11 118.80 1bzk h GLN 17 Ca -0.14 -0.02 -0.15 0.00 0.06 0.00 0.00 58.65 58.40 1bzk h GLN 17 Cb 1.35 -0.09 0.01 0.00 0.30 0.00 0.00 27.48 29.05 1bzk h GLN 17 CO 0.03 0.25 -0.49 0.28 -0.67 0.00 0.00 178.83 178.23 1bzk h VAL 18 N 0.40 1.35 -0.77 -0.54 2.07 -1.65 -3.09 116.25 114.02 1bzk h VAL 18 Ca 0.49 -1.79 0.17 0.00 0.82 0.00 0.00 66.70 66.38 1bzk h VAL 18 Cb 1.23 2.11 -0.14 0.00 -1.52 0.00 0.00 31.29 32.97 1bzk h VAL 18 CO -0.19 0.54 -0.11 0.25 0.02 0.00 0.00 177.57 178.08 1bzk h LEU 19 N 0.18 -0.58 -0.16 2.57 6.46 -0.79 0.62 115.31 123.62 1bzk h LEU 19 Ca -0.03 0.22 0.04 0.00 -0.12 0.00 0.00 57.88 58.00 1bzk h LEU 19 Cb 1.13 0.43 -0.05 0.00 -0.73 0.00 0.00 40.66 41.44 1bzk h LEU 19 CO 0.10 -0.23 -0.13 0.00 -0.62 0.00 0.00 178.44 177.56 1bzk h ALA 20 N 1.75 -0.01 -0.67 1.25 0.00 -1.47 -1.66 119.26 118.45 1bzk h ALA 20 Ca 0.39 0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.48 1bzk h ALA 20 Cb 0.65 0.28 -0.12 0.00 0.00 0.00 0.00 17.79 18.60 1bzk h ALA 20 CO -0.75 -0.57 -0.36 0.00 0.00 0.00 0.00 179.25 177.57 1bzk h ALA 21 N 0.97 -0.03 -0.78 0.00 0.00 0.26 0.16 119.26 119.83 1bzk h ALA 21 Ca 0.10 0.18 0.14 0.00 0.00 0.00 0.00 54.91 55.33 1bzk h ALA 21 Cb 0.29 0.85 -0.14 0.00 0.00 0.00 0.00 17.79 18.79 1bzk h ALA 21 CO -0.25 -0.68 -0.31 0.28 0.00 0.00 0.00 179.25 178.29 1bzk h VAL 22 N -0.14 0.12 -0.69 0.00 2.07 -0.20 0.66 116.25 118.09 1bzk h VAL 22 Ca 0.25 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.83 1bzk h VAL 22 Cb 0.56 0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 30.40 1bzk h VAL 22 CO -0.74 0.00 0.38 0.40 0.02 0.00 0.00 177.57 177.63 1bzk h ILE 23 N -0.07 0.97 -1.04 4.57 2.04 -0.52 0.11 117.51 123.57 1bzk h ILE 23 Ca 0.32 -0.24 0.27 0.00 1.00 0.00 0.00 64.86 66.21 1bzk h ILE 23 Cb 0.58 0.20 -0.11 0.00 -0.74 0.00 0.00 36.82 36.75 1bzk h ILE 23 CO -0.82 0.13 0.65 0.15 0.00 0.00 0.00 178.15 178.26 1bzk h PHE 24 N 0.71 0.79 -0.15 1.37 3.04 0.12 0.54 116.94 123.36 1bzk h PHE 24 Ca 0.31 0.03 -0.13 0.00 3.98 0.00 0.00 57.97 62.16 1bzk h PHE 24 Cb 0.20 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 38.48 1bzk h PHE 24 CO -0.08 0.03 -0.41 0.82 -2.02 0.00 0.00 178.31 176.66 1bzk h ILE 25 N 0.44 1.35 -0.29 1.41 2.04 -0.08 0.59 117.51 122.96 1bzk h ILE 25 Ca 0.63 -1.68 0.09 0.00 1.00 0.00 0.00 64.86 64.89 1bzk h ILE 25 Cb 1.49 2.03 -0.01 0.00 -0.74 0.00 0.00 36.82 39.59 1bzk h ILE 25 CO -0.38 0.51 0.44 0.22 0.00 0.00 0.00 178.15 178.93 1bzk h TYR 26 N 0.17 0.00 0.06 1.37 3.20 0.99 0.99 116.97 123.75 1bzk h TYR 26 Ca -0.01 0.00 -0.32 0.00 3.14 0.00 0.00 58.73 61.54 1bzk h TYR 26 Cb 1.02 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.26 1bzk h TYR 26 CO 0.10 0.00 -1.77 0.35 -1.64 0.00 0.00 178.16 175.20 1bzk h PHE 27 N 0.00 0.23 0.00 -3.82 3.04 -0.44 0.43 116.94 116.37 1bzk h PHE 27 Ca 0.14 -0.16 0.00 0.00 3.98 0.00 0.00 57.97 61.92 1bzk h PHE 27 Cb 1.01 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 39.51 1bzk h PHE 27 CO 0.00 1.32 0.00 0.00 -2.02 0.00 0.00 178.31 177.61 1bzk n ALA 28 N -2.72 0.00 -0.03 2.41 0.00 0.26 -4.28 120.51 116.16 1bzk n ALA 28 Ca -0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 53.44 53.08 1bzk n ALA 28 Cb 1.05 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.49 1bzk n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bzk h ALA 29 N -2.00 -0.05 -0.19 0.00 0.00 0.34 -3.34 119.26 114.02 1bzk h ALA 29 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1bzk h ALA 29 Cb 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1bzk h ALA 29 CO 0.00 -0.05 0.10 1.28 0.00 0.00 0.00 179.25 180.58 1bzk n LEU 30 N -4.65 3.32 -0.07 0.00 4.77 -0.73 -4.02 117.00 115.61 1bzk n LEU 30 Ca -0.01 -1.70 -0.14 0.00 -0.03 0.00 0.00 56.01 54.14 1bzk n LEU 30 Cb 0.02 -0.56 -0.12 0.00 -2.33 0.00 0.00 43.42 40.43 1bzk n LEU 30 CO 0.01 0.54 0.21 0.77 -1.33 0.00 0.00 177.39 177.59 1bzk h SER 31 N 0.38 0.00 0.65 -1.43 4.64 -1.03 -3.37 113.55 113.39 1bzk h SER 31 Ca 0.10 -0.84 0.00 0.00 -0.47 0.00 0.00 61.79 60.58 1bzk h SER 31 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1bzk h SER 31 CO 0.20 1.04 -0.87 -0.81 -0.87 0.00 0.00 176.83 175.52 1bzk n PRO 32 N -4.59 0.32 0.15 4.77 -0.04 -1.26 -4.20 135.00 130.14 1bzk n PRO 32 Ca -0.13 0.04 0.19 0.00 -0.04 0.00 0.00 63.50 63.56 1bzk n PRO 32 Cb 0.48 -1.65 0.76 0.00 -0.04 0.00 0.00 33.50 33.05 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 2.48 1.94 -0.95 0.55 0.00 -1.73 -0.71 119.26 120.84 1bzk h ALA 33 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bzk h ALA 33 Cb 0.76 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1bzk h ALA 33 CO 0.00 -0.57 0.00 -0.89 0.00 0.00 0.00 179.25 177.79 1bzk n ILE 34 N -3.56 0.00 0.26 0.00 5.41 -1.26 -4.28 119.36 115.93 1bzk n ILE 34 Ca 0.05 0.76 -0.16 0.00 1.00 0.00 0.00 62.75 64.40 1bzk n ILE 34 Cb 0.55 -1.58 -0.08 0.00 -0.71 0.00 0.00 39.64 37.83 1bzk n ILE 34 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1bzk h THR 35 N 0.00 0.36 -1.28 1.39 2.02 -1.82 -3.39 112.91 110.18 1bzk h THR 35 Ca 0.00 0.00 -0.65 0.00 0.77 0.00 0.00 66.41 66.53 1bzk h THR 35 Cb 0.00 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 1bzk h THR 35 CO 0.00 0.00 1.42 0.33 0.37 0.00 0.00 175.52 177.64 1bzk n PHE 36 N -5.44 1.69 -3.86 3.16 -0.00 -0.28 -4.83 117.46 107.90 1bzk n PHE 36 Ca -0.11 0.19 -0.00 0.00 -0.00 0.00 0.00 57.45 57.54 1bzk n PHE 36 Cb 0.34 -2.57 0.01 0.00 -0.00 0.00 0.00 39.48 37.25 1bzk n PHE 36 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1bzk s GLY 37 N 7.42 -0.11 0.00 7.13 0.00 -1.26 -4.73 107.32 115.77 1bzk s GLY 37 Ca 1.07 0.04 0.00 0.00 0.00 0.00 0.00 44.72 45.84 1bzk s GLY 37 CO 0.46 2.94 0.00 0.61 0.00 0.00 0.00 173.10 177.12 1bzk n GLY 38 N -0.71 0.41 0.00 0.20 0.00 -1.26 -5.10 105.19 98.72 1bzk n GLY 38 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1bzk n GLY 38 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bzk n LEU 39 N 0.00 0.00 0.00 0.99 4.32 -1.26 -4.97 117.00 116.08 1bzk n LEU 39 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1bzk n LEU 39 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1bzk n LEU 39 CO 0.00 0.00 0.00 0.18 -1.22 0.00 0.00 177.39 176.35 1bzk n LEU 40 N 0.00 0.00 -3.66 2.23 7.99 -1.26 -4.89 117.00 117.41 1bzk n LEU 40 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 56.01 55.72 1bzk n LEU 40 Cb 0.00 0.00 -0.05 0.00 -0.11 0.00 0.00 43.42 43.26 1bzk n LEU 40 CO 0.00 0.00 -0.11 0.61 -1.51 0.00 0.00 177.39 176.38 1bzk n GLY 41 N 3.16 -0.36 1.42 -0.72 0.00 -1.26 -4.70 105.19 102.73 1bzk n GLY 41 Ca 0.00 0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 1bzk n GLY 41 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1bzk n GLU 42 N -3.20 1.71 0.00 1.61 0.28 -1.26 -5.06 120.64 114.72 1bzk n GLU 42 Ca 0.08 -1.24 0.13 0.00 -0.16 0.00 0.00 57.16 55.97 1bzk n GLU 42 Cb 0.39 -1.54 0.31 0.00 1.43 0.00 0.00 31.44 32.02 1bzk n GLU 42 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60