#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 -0.69 0.00 -0.14 4.11 -1.26 -4.95 117.16 114.23 1bzk n TYR 3 Ca 0.00 0.29 0.00 0.00 -0.00 0.00 0.00 57.90 58.19 1bzk n TYR 3 Cb 0.00 -1.07 0.00 0.00 -0.00 0.00 0.00 39.34 38.27 1bzk n TYR 3 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.86 176.51 1bzk n PRO 4 N 0.80 0.00 0.07 -3.48 -0.04 -1.26 -4.37 135.00 126.72 1bzk n PRO 4 Ca -0.02 0.28 -0.09 0.00 -0.04 0.00 0.00 63.50 63.62 1bzk n PRO 4 Cb 0.49 -0.76 0.01 0.00 -0.04 0.00 0.00 33.50 33.20 1bzk n PRO 4 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1bzk h TYR 5 N 0.00 0.43 -0.98 0.54 0.05 -2.00 -3.24 116.97 111.77 1bzk h TYR 5 Ca 0.00 -0.21 0.33 0.00 0.05 0.00 0.00 58.73 58.90 1bzk h TYR 5 Cb 0.00 -0.06 -0.17 0.00 1.01 0.00 0.00 36.73 37.51 1bzk h TYR 5 CO 0.00 0.99 0.34 -0.92 -1.05 0.00 0.00 178.16 177.52 1bzk h TYR 6 N 0.19 0.50 -0.27 4.88 5.03 -1.97 0.59 116.97 125.93 1bzk h TYR 6 Ca -0.04 0.05 -0.18 0.00 2.58 0.00 0.00 58.73 61.14 1bzk h TYR 6 Cb 1.41 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 39.64 1bzk h TYR 6 CO 0.04 -0.38 -0.55 -0.07 -1.32 0.00 0.00 178.16 175.88 1bzk h LEU 7 N 0.08 0.90 -1.03 2.82 -0.00 -1.75 -3.05 115.31 113.28 1bzk h LEU 7 Ca 0.71 -0.48 0.00 0.00 -0.00 0.00 0.00 57.88 58.11 1bzk h LEU 7 Cb 1.68 -0.26 0.00 0.00 -0.00 0.00 0.00 40.66 42.08 1bzk h LEU 7 CO -0.78 1.26 0.00 -1.20 -0.00 0.00 0.00 178.44 177.73 1bzk n SER 8 N -4.00 0.59 -0.02 -0.43 7.64 0.20 -3.22 113.62 114.38 1bzk n SER 8 Ca -0.04 0.71 -0.02 0.00 1.01 0.00 0.00 58.87 60.53 1bzk n SER 8 Cb 0.62 -0.81 -0.01 0.00 -1.01 0.00 0.00 64.21 63.01 1bzk n SER 8 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1bzk n ASP 9 N -2.22 0.58 -0.30 6.43 5.75 -0.96 -2.98 116.55 122.84 1bzk n ASP 9 Ca 0.00 0.36 0.28 0.00 -0.01 0.00 0.00 54.79 55.42 1bzk n ASP 9 Cb 0.13 -0.62 0.51 0.00 -1.03 0.00 0.00 41.12 40.11 1bzk n ASP 9 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bzk n ILE 10 N -3.01 -0.39 0.03 2.12 3.06 -1.22 0.10 119.36 120.05 1bzk n ILE 10 Ca -0.02 1.92 -0.19 0.00 -2.50 0.00 0.00 62.75 61.95 1bzk n ILE 10 Cb 0.09 -3.07 -0.11 0.00 0.54 0.00 0.00 39.64 37.09 1bzk n ILE 10 CO 0.00 0.00 0.00 0.71 -2.50 0.00 0.00 176.55 174.76 1bzk h THR 11 N 0.00 1.36 0.00 9.51 1.35 -1.74 -3.10 112.91 120.28 1bzk h THR 11 Ca 0.76 -2.22 0.00 0.00 -0.55 0.00 0.00 66.41 64.40 1bzk h THR 11 Cb 1.97 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 70.95 1bzk h THR 11 CO -0.74 0.66 0.00 -0.67 -0.25 0.00 0.00 175.52 174.52 1bzk n ASP 12 N -4.02 0.00 0.15 5.36 2.03 0.29 -3.11 116.55 117.25 1bzk n ASP 12 Ca -0.11 -1.49 0.10 0.00 0.52 0.00 0.00 54.79 53.81 1bzk n ASP 12 Cb 0.80 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 41.27 1bzk n ASP 12 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bzk h ALA 13 N 3.38 0.73 -0.04 -1.67 0.00 -0.17 -3.20 119.26 118.29 1bzk h ALA 13 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1bzk h ALA 13 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1bzk h ALA 13 CO 0.00 0.11 0.00 1.97 0.00 0.00 0.00 179.25 181.33 1bzk n PHE 14 N -2.91 0.05 -3.90 0.00 1.16 -1.18 -4.34 117.46 106.34 1bzk n PHE 14 Ca 0.01 -0.02 -0.29 0.00 -1.87 0.00 0.00 57.45 55.28 1bzk n PHE 14 Cb 0.58 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 38.31 1bzk n PHE 14 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1bzk s SER 15 N -1.52 4.36 -0.11 5.98 0.15 -1.21 -4.92 113.70 116.42 1bzk s SER 15 Ca 0.26 -3.28 -0.05 0.00 0.70 0.00 0.00 55.95 53.58 1bzk s SER 15 Cb 0.13 -1.55 -0.02 0.00 -1.71 0.00 0.00 66.02 62.87 1bzk s SER 15 CO 0.21 -0.18 -0.11 1.55 1.20 0.00 0.00 173.24 175.91 1bzk h PRO 16 N 6.11 0.00 -0.46 5.44 0.13 -1.84 -0.89 132.00 140.48 1bzk h PRO 16 Ca 0.02 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.26 1bzk h PRO 16 Cb 0.85 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.95 1bzk h PRO 16 CO 0.67 0.00 0.32 1.96 -0.23 0.00 0.00 178.00 180.72 1bzk h GLN 17 N -0.88 0.11 0.13 0.86 1.08 -1.97 -1.54 115.11 112.91 1bzk h GLN 17 Ca 0.00 -0.01 -0.36 0.00 -1.45 0.00 0.00 58.65 56.83 1bzk h GLN 17 Cb 0.30 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 1bzk h GLN 17 CO 0.00 0.08 -1.93 0.28 -0.95 0.00 0.00 178.83 176.31 1bzk h VAL 18 N 0.12 0.69 0.45 -0.54 2.07 -1.96 -3.05 116.25 114.03 1bzk h VAL 18 Ca 0.22 -2.37 -0.01 0.00 0.82 0.00 0.00 66.70 65.36 1bzk h VAL 18 Cb 0.70 2.55 -0.01 0.00 -1.52 0.00 0.00 31.29 33.01 1bzk h VAL 18 CO -0.02 0.88 -0.33 0.25 0.02 0.00 0.00 177.57 178.37 1bzk h LEU 19 N 0.05 -0.84 0.17 2.57 5.85 -0.64 -1.24 115.31 121.23 1bzk h LEU 19 Ca -0.41 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.39 1bzk h LEU 19 Cb 2.03 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 43.28 1bzk h LEU 19 CO 0.10 -0.49 -0.30 0.00 -0.34 0.00 0.00 178.44 177.41 1bzk h ALA 20 N -0.31 -0.54 -0.86 1.25 0.00 -1.48 -2.28 119.26 115.04 1bzk h ALA 20 Ca -0.05 -0.06 0.15 0.00 0.00 0.00 0.00 54.91 54.95 1bzk h ALA 20 Cb 0.64 0.47 -0.15 0.00 0.00 0.00 0.00 17.79 18.75 1bzk h ALA 20 CO 0.02 -0.85 -0.32 0.00 0.00 0.00 0.00 179.25 178.10 1bzk h ALA 21 N 0.11 0.26 -0.35 0.00 0.00 -1.39 0.84 119.26 118.72 1bzk h ALA 21 Ca 0.02 0.27 0.07 0.00 0.00 0.00 0.00 54.91 55.27 1bzk h ALA 21 Cb 0.55 0.84 -0.09 0.00 0.00 0.00 0.00 17.79 19.09 1bzk h ALA 21 CO -0.14 -0.56 -0.34 0.28 0.00 0.00 0.00 179.25 178.49 1bzk h VAL 22 N -0.04 0.22 0.38 0.00 2.07 -0.64 -2.70 116.25 115.53 1bzk h VAL 22 Ca 0.35 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.85 1bzk h VAL 22 Cb 0.60 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1bzk h VAL 22 CO -0.89 0.00 -0.18 0.40 0.02 0.00 0.00 177.57 176.92 1bzk h ILE 23 N -0.30 0.63 -0.88 4.57 1.08 -0.68 -2.82 117.51 119.11 1bzk h ILE 23 Ca 0.15 -0.30 0.31 0.00 -0.39 0.00 0.00 64.86 64.62 1bzk h ILE 23 Cb 0.55 0.79 -0.09 0.00 -3.07 0.00 0.00 36.82 35.00 1bzk h ILE 23 CO -0.51 0.06 0.57 0.33 -0.69 0.00 0.00 178.15 177.91 1bzk n PHE 24 N -5.24 0.45 -0.01 1.37 7.35 -0.25 0.19 117.46 121.33 1bzk n PHE 24 Ca -0.10 0.46 -0.10 0.00 -0.76 0.00 0.00 57.45 56.94 1bzk n PHE 24 Cb 0.26 -0.85 -0.08 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 1.00 0.40 -2.13 2.04 -1.38 -2.32 117.51 115.11 1bzk h ILE 25 Ca 0.57 -1.49 -0.02 0.00 1.00 0.00 0.00 64.86 64.91 1bzk h ILE 25 Cb 1.82 1.79 -0.00 0.00 -0.74 0.00 0.00 36.82 39.69 1bzk h ILE 25 CO -0.30 0.30 -0.26 0.22 0.00 0.00 0.00 178.15 178.12 1bzk h TYR 26 N -0.92 -0.69 -1.80 1.37 3.20 0.21 0.20 116.97 118.55 1bzk h TYR 26 Ca -0.01 -0.01 0.52 0.00 3.14 0.00 0.00 58.73 62.38 1bzk h TYR 26 Cb 0.57 0.25 -0.07 0.00 1.54 0.00 0.00 36.73 39.01 1bzk h TYR 26 CO 0.13 -0.38 1.36 0.34 -1.64 0.00 0.00 178.16 177.98 1bzk n PHE 27 N -3.91 0.00 0.33 -3.82 7.35 0.11 -0.73 117.46 116.80 1bzk n PHE 27 Ca -0.07 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.48 1bzk n PHE 27 Cb 0.26 -0.45 -0.06 0.00 0.35 0.00 0.00 39.48 39.58 1bzk n PHE 27 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1bzk h ALA 28 N 0.90 -1.05 0.00 3.13 0.00 -0.36 -3.25 119.26 118.62 1bzk h ALA 28 Ca 0.85 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.57 1bzk h ALA 28 Cb 3.57 0.34 0.00 0.00 0.00 0.00 0.00 17.79 21.69 1bzk h ALA 28 CO -0.01 -0.99 -0.19 0.00 0.00 0.00 0.00 179.25 178.06 1bzk n ALA 29 N -2.54 0.17 -0.74 0.00 0.00 0.09 -4.52 120.51 112.96 1bzk n ALA 29 Ca -0.11 -0.25 -0.18 0.00 0.00 0.00 0.00 53.44 52.90 1bzk n ALA 29 Cb 0.34 0.01 0.06 0.00 0.00 0.00 0.00 19.45 19.86 1bzk n ALA 29 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1bzk n LEU 30 N -3.04 6.19 -0.06 0.00 4.32 -0.96 -4.68 117.00 118.78 1bzk n LEU 30 Ca -0.03 -3.22 -0.10 0.00 -0.02 0.00 0.00 56.01 52.64 1bzk n LEU 30 Cb 0.10 -0.94 -0.07 0.00 -1.62 0.00 0.00 43.42 40.89 1bzk n LEU 30 CO 0.04 1.13 0.50 0.77 -1.22 0.00 0.00 177.39 178.61 1bzk h SER 31 N 1.25 -1.31 -0.02 -1.43 4.64 -1.55 -2.93 113.55 112.20 1bzk h SER 31 Ca 0.35 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1bzk h SER 31 Cb 1.25 0.52 0.00 0.00 -0.31 0.00 0.00 62.40 63.86 1bzk h SER 31 CO 0.81 -0.32 -0.04 -0.81 -0.87 0.00 0.00 176.83 175.59 1bzk n PRO 32 N -4.63 2.15 0.40 4.77 -0.04 -1.26 -4.58 135.00 131.80 1bzk n PRO 32 Ca -0.03 -1.74 -0.17 0.00 -0.04 0.00 0.00 63.50 61.52 1bzk n PRO 32 Cb 0.26 -1.46 -0.08 0.00 -0.04 0.00 0.00 33.50 32.17 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 4.59 -1.03 0.00 0.55 0.00 -1.81 0.11 119.26 121.68 1bzk h ALA 33 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1bzk h ALA 33 Cb 0.92 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 1bzk h ALA 33 CO 0.00 -0.99 -0.03 0.97 0.00 0.00 0.00 179.25 179.20 1bzk h ILE 34 N -1.21 0.30 0.00 0.00 2.10 -1.81 -1.73 117.51 115.17 1bzk h ILE 34 Ca -0.10 -0.20 0.00 0.00 1.08 0.00 0.00 64.86 65.64 1bzk h ILE 34 Cb 0.80 1.14 0.00 0.00 -1.09 0.00 0.00 36.82 37.68 1bzk h ILE 34 CO 0.17 0.03 -0.95 0.74 -1.08 0.00 0.00 178.15 177.06 1bzk h THR 35 N 0.00 0.00 -3.46 2.19 2.02 -1.77 -3.46 112.91 108.43 1bzk h THR 35 Ca -0.00 -0.98 -0.53 0.00 0.77 0.00 0.00 66.41 65.66 1bzk h THR 35 Cb 0.14 1.50 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 1bzk h THR 35 CO 0.00 0.00 -0.08 -0.36 0.37 0.00 0.00 175.52 175.45 1bzk s PHE 36 N -3.35 3.44 0.00 3.16 0.40 0.36 -4.92 117.98 117.07 1bzk s PHE 36 Ca -0.00 0.95 0.00 0.00 -0.60 0.00 0.00 56.93 57.28 1bzk s PHE 36 Cb 0.09 -2.31 0.00 0.00 0.51 0.00 0.00 43.02 41.31 1bzk s PHE 36 CO 0.78 0.27 0.00 0.41 0.70 0.00 0.00 175.22 177.38 1bzk n GLY 37 N -0.04 1.37 1.37 4.36 0.00 -1.26 -4.92 105.19 106.08 1bzk n GLY 37 Ca 0.00 -1.25 0.08 0.00 0.00 0.00 0.00 46.02 44.85 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 2.95 3.34 0.18 -0.02 0.00 -1.26 -4.44 105.19 105.94 1bzk n GLY 38 Ca 0.00 -0.92 0.14 0.00 0.00 0.00 0.00 46.02 45.24 1bzk n GLY 38 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1bzk h LEU 39 N 3.04 0.00 -0.85 0.99 4.07 -2.01 -3.04 115.31 117.51 1bzk h LEU 39 Ca 0.00 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.01 1bzk h LEU 39 Cb 1.60 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 43.28 1bzk h LEU 39 CO 0.31 0.00 0.54 -0.07 -1.08 0.00 0.00 178.44 178.14 1bzk h LEU 40 N 0.00 0.87 0.00 1.67 3.38 -1.97 -3.46 115.31 115.80 1bzk h LEU 40 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1bzk h LEU 40 Cb 0.42 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1bzk h LEU 40 CO 0.00 0.58 0.00 0.61 0.09 0.00 0.00 178.44 179.72 1bzk n GLY 41 N -1.33 1.54 0.30 0.83 0.00 -1.15 -5.00 105.19 100.39 1bzk n GLY 41 Ca 0.11 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.33 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 0.00 0.00 1.61 4.81 -1.89 -3.54 114.58 115.57 1bzk h GLU 42 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1bzk h GLU 42 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1bzk h GLU 42 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 179.01 179.45