#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 -3.62 0.00 -0.14 4.02 -1.26 -5.02 117.16 111.14 1bzk n TYR 3 Ca 0.00 1.52 0.00 0.00 -0.01 0.00 0.00 57.90 59.41 1bzk n TYR 3 Cb 0.00 -3.98 0.00 0.00 -0.02 0.00 0.00 39.34 35.34 1bzk n TYR 3 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1bzk n PRO 4 N 0.08 0.00 0.10 -0.72 -0.04 -1.26 -4.46 135.00 128.70 1bzk n PRO 4 Ca 0.07 0.08 -0.17 0.00 -0.04 0.00 0.00 63.50 63.44 1bzk n PRO 4 Cb 0.31 -0.44 -0.14 0.00 -0.04 0.00 0.00 33.50 33.19 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 0.53 -1.23 0.54 0.05 -2.02 -3.29 116.97 111.55 1bzk h TYR 5 Ca 0.00 -0.39 0.40 0.00 0.05 0.00 0.00 58.73 58.79 1bzk h TYR 5 Cb 0.00 -0.02 -0.13 0.00 1.01 0.00 0.00 36.73 37.59 1bzk h TYR 5 CO 0.00 1.33 0.78 1.88 -1.05 0.00 0.00 178.16 181.10 1bzk h TYR 6 N 0.08 0.60 -0.17 4.88 0.05 -1.99 0.39 116.97 120.81 1bzk h TYR 6 Ca -0.17 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.65 1bzk h TYR 6 Cb 2.00 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 39.58 1bzk h TYR 6 CO 0.07 -0.19 0.08 1.25 -1.05 0.00 0.00 178.16 178.32 1bzk h LEU 7 N 0.14 0.11 -0.45 3.88 6.46 -1.78 -0.66 115.31 123.01 1bzk h LEU 7 Ca 0.78 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 58.55 1bzk h LEU 7 Cb 2.33 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 42.25 1bzk h LEU 7 CO -0.44 0.09 0.00 -0.24 -0.62 0.00 0.00 178.44 177.23 1bzk n SER 8 N -5.02 0.20 0.05 1.25 2.88 0.13 -1.59 113.62 111.52 1bzk n SER 8 Ca -0.04 0.58 -0.14 0.00 -1.33 0.00 0.00 58.87 57.94 1bzk n SER 8 Cb 0.05 -0.61 -0.14 0.00 -0.75 0.00 0.00 64.21 62.76 1bzk n SER 8 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1bzk h ASP 9 N 0.00 0.28 -0.69 -3.46 3.32 -0.98 -3.33 116.42 111.57 1bzk h ASP 9 Ca 0.00 -0.41 -0.07 0.00 0.02 0.00 0.00 57.03 56.57 1bzk h ASP 9 Cb 0.04 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1bzk h ASP 9 CO 0.00 1.34 0.16 0.40 -1.72 0.00 0.00 179.24 179.42 1bzk h ILE 10 N 0.05 1.26 -0.18 0.35 1.08 -1.17 0.09 117.51 119.00 1bzk h ILE 10 Ca -0.22 -0.98 0.00 0.00 -0.39 0.00 0.00 64.86 63.27 1bzk h ILE 10 Cb 1.98 0.55 -0.01 0.00 -3.07 0.00 0.00 36.82 36.28 1bzk h ILE 10 CO 0.14 0.38 0.11 0.00 -0.69 0.00 0.00 178.15 178.09 1bzk h THR 11 N 1.06 1.06 -0.01 -0.27 1.03 -1.69 -0.65 112.91 113.45 1bzk h THR 11 Ca 0.22 -0.13 0.00 0.00 -0.01 0.00 0.00 66.41 66.49 1bzk h THR 11 Cb 0.38 0.83 0.00 0.00 -1.07 0.00 0.00 68.15 68.29 1bzk h THR 11 CO 0.00 0.06 0.00 -0.90 -0.01 0.00 0.00 175.52 174.67 1bzk n ASP 12 N -4.95 0.22 -2.26 0.00 5.75 -1.15 -3.51 116.55 110.65 1bzk n ASP 12 Ca -0.04 -1.14 -0.31 0.00 -0.01 0.00 0.00 54.79 53.30 1bzk n ASP 12 Cb 0.04 -0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.22 1bzk n ASP 12 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bzk n ALA 13 N -0.80 6.04 1.02 2.12 0.00 0.01 -4.53 120.51 124.36 1bzk n ALA 13 Ca 0.22 -3.17 0.01 0.00 0.00 0.00 0.00 53.44 50.50 1bzk n ALA 13 Cb 0.14 -1.66 0.05 0.00 0.00 0.00 0.00 19.45 17.97 1bzk n ALA 13 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1bzk n PHE 14 N -0.86 0.23 -3.87 0.00 -1.74 -1.23 -4.49 117.46 105.50 1bzk n PHE 14 Ca 0.59 -0.08 -0.32 0.00 -0.56 0.00 0.00 57.45 57.08 1bzk n PHE 14 Cb 0.88 -0.11 -0.12 0.00 1.52 0.00 0.00 39.48 41.65 1bzk n PHE 14 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 1bzk s SER 15 N -0.34 4.65 -0.13 5.98 0.15 -1.26 -4.91 113.70 117.83 1bzk s SER 15 Ca 0.07 -3.04 -0.26 0.00 0.70 0.00 0.00 55.95 53.42 1bzk s SER 15 Cb 0.05 -1.71 -0.26 0.00 -1.71 0.00 0.00 66.02 62.39 1bzk s SER 15 CO 0.03 -0.26 0.68 1.55 1.20 0.00 0.00 173.24 176.44 1bzk h PRO 16 N 6.56 0.07 0.00 5.44 0.13 -1.98 -0.69 132.00 141.53 1bzk h PRO 16 Ca -0.04 -0.12 -0.09 0.00 -0.87 0.00 0.00 66.00 64.88 1bzk h PRO 16 Cb 0.90 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 1bzk h PRO 16 CO 0.70 1.06 -0.42 0.37 -0.23 0.00 0.00 178.00 179.48 1bzk h GLN 17 N -0.84 0.00 0.00 0.86 5.75 -1.99 -2.79 115.11 116.11 1bzk h GLN 17 Ca -0.11 0.00 -0.18 0.00 -0.15 0.00 0.00 58.65 58.21 1bzk h GLN 17 Cb 1.22 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.74 1bzk h GLN 17 CO -0.00 0.42 -1.29 0.28 -2.65 0.00 0.00 178.83 175.58 1bzk h VAL 18 N 0.00 0.68 0.25 2.39 2.07 -1.96 -3.05 116.25 116.63 1bzk h VAL 18 Ca -0.00 -2.22 -0.01 0.00 0.82 0.00 0.00 66.70 65.28 1bzk h VAL 18 Cb 1.00 2.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.97 1bzk h VAL 18 CO 0.05 0.39 -0.12 -0.07 0.02 0.00 0.00 177.57 177.84 1bzk h LEU 19 N 0.00 -0.28 -0.26 2.57 3.38 -0.99 -1.36 115.31 118.37 1bzk h LEU 19 Ca -0.15 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 57.64 1bzk h LEU 19 Cb 1.63 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 42.41 1bzk h LEU 19 CO 0.06 0.13 -0.02 0.00 0.09 0.00 0.00 178.44 178.69 1bzk h ALA 20 N -0.17 0.21 -0.20 1.53 0.00 -1.65 -2.00 119.26 116.98 1bzk h ALA 20 Ca -0.03 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1bzk h ALA 20 Cb 0.50 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 1bzk h ALA 20 CO 0.06 -0.44 -0.33 0.00 0.00 0.00 0.00 179.25 178.54 1bzk h ALA 21 N 1.23 -0.34 -0.96 0.00 0.00 -1.51 0.18 119.26 117.86 1bzk h ALA 21 Ca 0.12 0.04 0.15 0.00 0.00 0.00 0.00 54.91 55.22 1bzk h ALA 21 Cb 0.17 0.65 -0.10 0.00 0.00 0.00 0.00 17.79 18.51 1bzk h ALA 21 CO -0.22 -0.79 0.57 0.28 0.00 0.00 0.00 179.25 179.09 1bzk h VAL 22 N -0.37 0.79 0.00 0.00 2.07 -0.74 0.11 116.25 118.11 1bzk h VAL 22 Ca 0.11 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1bzk h VAL 22 Cb 0.55 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1bzk h VAL 22 CO -0.40 0.15 -0.04 0.40 0.02 0.00 0.00 177.57 177.70 1bzk h ILE 23 N 0.81 0.07 -0.25 4.57 2.04 -0.48 -2.92 117.51 121.34 1bzk h ILE 23 Ca 0.52 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 1bzk h ILE 23 Cb 0.68 1.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.68 1bzk h ILE 23 CO -0.33 0.04 0.11 0.15 0.00 0.00 0.00 178.15 178.11 1bzk h PHE 24 N 0.00 0.37 -0.09 1.37 3.57 0.20 0.15 116.94 122.50 1bzk h PHE 24 Ca -0.00 -0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.31 1bzk h PHE 24 Cb 0.92 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 1bzk h PHE 24 CO 0.00 0.38 -0.66 0.82 -2.23 0.00 0.00 178.31 176.62 1bzk h ILE 25 N 0.26 1.37 0.00 1.41 5.03 -1.55 -1.51 117.51 122.52 1bzk h ILE 25 Ca 0.09 -2.03 -0.04 0.00 -0.12 0.00 0.00 64.86 62.75 1bzk h ILE 25 Cb 0.15 2.02 -0.01 0.00 -3.03 0.00 0.00 36.82 35.95 1bzk h ILE 25 CO -0.01 0.61 -0.20 1.88 -0.68 0.00 0.00 178.15 179.75 1bzk h TYR 26 N 0.27 0.00 -0.04 1.37 -1.99 -1.28 -1.73 116.97 113.57 1bzk h TYR 26 Ca -0.02 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.55 1bzk h TYR 26 Cb 1.20 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.95 1bzk h TYR 26 CO 0.04 0.20 -0.60 0.35 -0.00 0.00 0.00 178.16 178.15 1bzk h PHE 27 N 0.00 0.68 0.24 4.88 3.04 -0.30 -0.35 116.94 125.14 1bzk h PHE 27 Ca -0.00 -0.34 0.01 0.00 3.98 0.00 0.00 57.97 61.61 1bzk h PHE 27 Cb 0.42 -0.09 -0.03 0.00 2.56 0.00 0.00 35.95 38.81 1bzk h PHE 27 CO 0.00 1.15 -0.35 0.00 -2.02 0.00 0.00 178.31 177.09 1bzk h ALA 28 N 0.39 -0.68 0.28 2.41 0.00 -0.54 0.47 119.26 121.58 1bzk h ALA 28 Ca -0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1bzk h ALA 28 Cb 1.28 0.53 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1bzk h ALA 28 CO 0.12 -0.93 -0.13 0.00 0.00 0.00 0.00 179.25 178.31 1bzk h ALA 29 N -0.12 -0.38 -0.01 0.00 0.00 -1.43 -3.19 119.26 114.13 1bzk h ALA 29 Ca 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1bzk h ALA 29 Cb 0.63 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1bzk h ALA 29 CO -0.13 -0.42 0.00 1.47 0.00 0.00 0.00 179.25 180.18 1bzk n LEU 30 N -5.04 1.71 -0.32 0.00 -0.00 -0.14 -4.43 117.00 108.78 1bzk n LEU 30 Ca -0.08 -0.86 0.08 0.00 -0.00 0.00 0.00 56.01 55.16 1bzk n LEU 30 Cb 0.25 -0.50 0.17 0.00 -0.00 0.00 0.00 43.42 43.34 1bzk n LEU 30 CO 0.23 0.34 0.64 -0.24 -0.00 0.00 0.00 177.39 178.36 1bzk n SER 31 N 0.16 -0.26 0.06 1.45 2.88 0.16 0.08 113.62 118.15 1bzk n SER 31 Ca 0.01 1.56 0.03 0.00 -1.33 0.00 0.00 58.87 59.14 1bzk n SER 31 Cb 0.35 -0.50 -0.05 0.00 -0.75 0.00 0.00 64.21 63.25 1bzk n SER 31 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1bzk h PRO 32 N 0.00 0.00 0.00 -1.46 0.13 -1.84 -3.35 132.00 125.48 1bzk h PRO 32 Ca 0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.60 1bzk h PRO 32 Cb 0.82 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 1bzk h PRO 32 CO -0.91 0.22 -0.03 0.00 -0.23 0.00 0.00 178.00 177.05 1bzk h ALA 33 N 1.59 1.14 -0.32 -0.56 0.00 -0.64 -2.07 119.26 118.40 1bzk h ALA 33 Ca -0.11 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.87 1bzk h ALA 33 Cb 1.41 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1bzk h ALA 33 CO 0.03 0.03 0.35 0.97 0.00 0.00 0.00 179.25 180.64 1bzk h ILE 34 N 0.00 0.41 -0.14 0.00 2.10 -1.61 0.17 117.51 118.44 1bzk h ILE 34 Ca -0.00 0.00 -0.17 0.00 1.08 0.00 0.00 64.86 65.77 1bzk h ILE 34 Cb 0.16 0.72 -0.01 0.00 -1.09 0.00 0.00 36.82 36.60 1bzk h ILE 34 CO 0.00 0.00 -0.62 0.71 -1.08 0.00 0.00 178.15 177.16 1bzk h THR 35 N 0.00 1.34 -1.00 2.19 1.35 -1.67 -3.23 112.91 111.89 1bzk h THR 35 Ca 0.15 -1.93 0.19 0.00 -0.55 0.00 0.00 66.41 64.27 1bzk h THR 35 Cb 0.85 1.91 -0.18 0.00 -1.73 0.00 0.00 68.15 69.00 1bzk h THR 35 CO -0.00 0.59 -0.28 0.15 -0.25 0.00 0.00 175.52 175.72 1bzk h PHE 36 N 0.36 -0.67 -3.41 4.73 3.57 -0.82 -3.14 116.94 117.56 1bzk h PHE 36 Ca -0.01 0.09 -0.64 0.00 3.53 0.00 0.00 57.97 60.94 1bzk h PHE 36 Cb 1.18 0.45 -0.41 0.00 2.79 0.00 0.00 35.95 39.96 1bzk h PHE 36 CO 0.05 -0.42 -0.66 0.20 -2.23 0.00 0.00 178.31 175.24 1bzk s GLY 37 N -4.07 2.26 -0.34 2.40 0.00 -1.22 -4.89 107.32 101.46 1bzk s GLY 37 Ca -0.15 -3.04 0.15 0.00 0.00 0.00 0.00 44.72 41.68 1bzk s GLY 37 CO 0.76 1.05 1.29 0.61 0.00 0.00 0.00 173.10 176.81 1bzk n GLY 38 N 3.40 1.68 2.86 0.20 0.00 -1.19 -4.98 105.19 107.17 1bzk n GLY 38 Ca 0.05 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.30 1bzk n GLY 38 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1bzk n LEU 39 N -0.79 0.00 -0.06 0.99 7.94 -1.26 -4.94 117.00 118.88 1bzk n LEU 39 Ca -0.03 -1.07 -0.07 0.00 -1.11 0.00 0.00 56.01 53.72 1bzk n LEU 39 Cb 0.84 -0.76 -0.01 0.00 0.53 0.00 0.00 43.42 44.02 1bzk n LEU 39 CO -0.01 -1.27 0.75 -0.07 -1.11 0.00 0.00 177.39 175.69 1bzk h LEU 40 N 0.00 -0.51 0.00 -1.96 -0.00 -2.00 -3.43 115.31 107.41 1bzk h LEU 40 Ca -0.32 0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.67 1bzk h LEU 40 Cb 0.89 0.27 0.00 0.00 -0.00 0.00 0.00 40.66 41.82 1bzk h LEU 40 CO 0.22 -0.19 0.00 0.61 -0.00 0.00 0.00 178.44 179.08 1bzk n GLY 41 N -1.32 0.64 0.08 0.83 0.00 -1.26 -4.97 105.19 99.19 1bzk n GLY 41 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1bzk n GLY 41 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1bzk h GLU 42 N 0.00 0.09 0.00 1.61 5.08 -2.00 -3.47 114.58 115.90 1bzk h GLU 42 Ca 0.00 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1bzk h GLU 42 Cb 0.00 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1bzk h GLU 42 CO 0.00 1.00 0.00 1.17 -1.00 0.00 0.00 179.01 180.18