#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fyl h GLU 18 N 0.00 0.27 0.00 1.61 3.07 -2.05 -3.18 114.58 114.30 2fyl h GLU 18 Ca 0.00 -0.19 -0.00 0.00 -0.50 0.00 0.00 59.36 58.67 2fyl h GLU 18 Cb 0.00 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 27.94 2fyl h GLU 18 CO 0.00 0.79 -0.02 1.05 -1.40 0.00 0.00 179.01 179.43 2fyl h GLU 19 N 0.20 0.00 -4.26 2.33 -0.00 -2.10 -3.40 114.58 107.35 2fyl h GLU 19 Ca -0.01 0.00 -0.76 0.00 -0.00 0.00 0.00 59.36 58.60 2fyl h GLU 19 Cb 1.11 0.00 -0.23 0.00 -0.00 0.00 0.00 28.75 29.64 2fyl h GLU 19 CO 0.10 0.46 0.57 -0.06 -0.00 0.00 0.00 179.01 180.07 2fyl s PHE 20 N -1.87 3.64 -0.38 2.06 0.40 -1.24 -4.82 117.98 115.78 2fyl s PHE 20 Ca -0.09 -1.98 0.07 0.00 -0.60 0.00 0.00 56.93 54.33 2fyl s PHE 20 Cb -0.01 -4.03 0.68 0.00 0.51 0.00 0.00 43.02 40.16 2fyl s PHE 20 CO 0.32 -1.19 1.81 0.54 0.70 0.00 0.00 175.22 177.40 2fyl n ARG 21 N 4.71 2.98 -3.99 0.44 5.12 -1.20 -1.76 116.66 122.95 2fyl n ARG 21 Ca 0.22 -2.87 -0.22 0.00 -1.93 0.00 0.00 57.85 53.04 2fyl n ARG 21 Cb 0.45 -2.15 -0.17 0.00 -1.16 0.00 0.00 32.46 29.44 2fyl n ARG 21 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 2fyl s MET 22 N -2.96 0.91 0.55 5.56 1.75 -1.26 -5.02 119.30 118.83 2fyl s MET 22 Ca 0.53 -0.07 0.31 0.00 -1.25 0.00 0.00 55.69 55.21 2fyl s MET 22 Cb 0.43 -1.04 1.62 0.00 2.84 0.00 0.00 34.83 38.67 2fyl s MET 22 CO 0.12 -0.19 2.12 0.93 -0.65 0.00 0.00 175.02 177.35 2fyl h GLU 23 N 7.77 0.00 -0.39 4.11 4.39 -1.99 -2.73 114.58 125.74 2fyl h GLU 23 Ca -0.29 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.43 2fyl h GLU 23 Cb 1.14 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.76 2fyl h GLU 23 CO 0.38 0.08 0.21 1.57 -1.16 0.00 0.00 179.01 180.09 2fyl h LYS 24 N 0.00 0.41 0.02 2.33 2.10 -2.00 -0.84 116.57 118.59 2fyl h LYS 24 Ca -0.00 -0.02 -0.24 0.00 -2.00 0.00 0.00 60.65 58.38 2fyl h LYS 24 Cb 0.29 -0.09 0.01 0.00 -0.90 0.00 0.00 32.23 31.53 2fyl h LYS 24 CO 0.01 0.27 -0.99 -0.07 -2.00 0.00 0.00 179.45 176.67 2fyl h LEU 25 N 0.43 0.61 0.01 7.07 3.38 -1.93 -3.10 115.31 121.77 2fyl h LEU 25 Ca 0.16 -0.50 0.01 0.00 0.09 0.00 0.00 57.88 57.65 2fyl h LEU 25 Cb 0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2fyl h LEU 25 CO -0.09 1.30 -0.09 0.78 0.09 0.00 0.00 178.44 180.43 2fyl h ASN 26 N 0.25 -0.26 0.01 -0.43 2.35 -1.19 0.30 115.58 116.61 2fyl h ASN 26 Ca -0.10 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.61 2fyl h ASN 26 Cb 1.64 0.11 -0.01 0.00 0.05 0.00 0.00 38.32 40.11 2fyl h ASN 26 CO 0.18 -0.14 -0.24 1.56 -1.65 0.00 0.00 177.43 177.14 2fyl h GLN 27 N -0.17 0.38 -0.18 0.81 4.20 -1.25 -2.22 115.11 116.69 2fyl h GLN 27 Ca 0.03 -0.13 -0.21 0.00 0.06 0.00 0.00 58.65 58.39 2fyl h GLN 27 Cb 0.20 -0.03 0.01 0.00 0.30 0.00 0.00 27.48 27.96 2fyl h GLN 27 CO -0.08 0.60 -0.73 1.25 -0.67 0.00 0.00 178.83 179.20 2fyl h LEU 28 N 0.34 0.93 -0.33 1.46 5.85 -1.42 -2.04 115.31 120.10 2fyl h LEU 28 Ca 0.05 -0.58 -0.01 0.00 0.84 0.00 0.00 57.88 58.19 2fyl h LEU 28 Cb 0.61 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2fyl h LEU 28 CO 0.04 1.38 0.18 -0.25 -0.34 0.00 0.00 178.44 179.45 2fyl h TRP 29 N 0.56 0.46 -0.01 1.25 -0.00 -0.74 -2.68 115.95 114.79 2fyl h TRP 29 Ca -0.04 -0.01 -0.13 0.00 -0.00 0.00 0.00 58.89 58.71 2fyl h TRP 29 Cb 1.35 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 30.34 2fyl h TRP 29 CO 0.08 0.36 -0.60 1.05 -0.00 0.00 0.00 178.44 179.33 2fyl h GLU 30 N 0.41 0.03 -0.61 2.65 4.11 -1.46 -3.08 114.58 116.64 2fyl h GLU 30 Ca 0.12 -0.02 0.04 0.00 0.07 0.00 0.00 59.36 59.57 2fyl h GLU 30 Cb 0.06 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 2fyl h GLU 30 CO -0.02 0.62 0.35 -0.22 0.07 0.00 0.00 179.01 179.81 2fyl h LYS 31 N 0.02 0.66 -0.83 1.06 3.64 -1.04 0.22 116.57 120.30 2fyl h LYS 31 Ca -0.01 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 2fyl h LYS 31 Cb 1.07 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.70 2fyl h LYS 31 CO 0.08 0.44 0.38 0.00 -2.27 0.00 0.00 179.45 178.08 2fyl h ALA 32 N 1.29 1.07 -0.37 5.00 0.00 -1.42 -1.75 119.26 123.08 2fyl h ALA 32 Ca 0.26 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 2fyl h ALA 32 Cb 0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2fyl h ALA 32 CO -0.13 0.66 -0.24 1.96 0.00 0.00 0.00 179.25 181.49 2fyl h GLN 33 N 1.19 0.74 0.00 0.00 4.20 -1.24 -2.51 115.11 117.49 2fyl h GLN 33 Ca 0.28 -0.30 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 2fyl h GLN 33 Cb 0.15 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.89 2fyl h GLN 33 CO -0.03 0.91 -0.14 0.00 -0.67 0.00 0.00 178.83 178.90 2fyl h ARG 34 N 0.64 0.00 -0.00 1.46 3.08 -0.14 -1.20 114.38 118.22 2fyl h ARG 34 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2fyl h ARG 34 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.80 2fyl h ARG 34 CO 0.06 0.14 -0.26 1.28 -1.07 0.00 0.00 179.97 180.12 2fyl n LEU 35 N -3.36 0.58 -1.75 3.04 4.77 -0.70 -5.02 117.00 114.56 2fyl n LEU 35 Ca -0.00 -0.01 -0.01 0.00 -0.03 0.00 0.00 56.01 55.95 2fyl n LEU 35 Cb 0.34 -0.22 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 2fyl n LEU 35 CO 0.30 0.12 -0.26 1.41 -1.33 0.00 0.00 177.39 177.64 2fyl n HIS 36 N -1.10 -2.19 -3.91 -1.77 8.25 -0.45 -5.09 115.22 108.96 2fyl n HIS 36 Ca 0.10 1.29 -0.11 0.00 -0.26 0.00 0.00 57.72 58.75 2fyl n HIS 36 Cb 0.32 -2.78 -0.11 0.00 1.12 0.00 0.00 29.99 28.54 2fyl n HIS 36 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2fyl s LEU 37 N -0.29 1.92 0.66 2.41 1.43 -1.25 -5.00 118.68 118.56 2fyl s LEU 37 Ca -0.05 -0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 52.68 2fyl s LEU 37 Cb 0.00 0.28 0.00 0.00 0.03 0.00 0.00 46.19 46.51 2fyl s LEU 37 CO 0.12 -0.23 1.11 -2.16 0.23 0.00 0.00 176.35 175.43 2fyl s PRO 38 N -0.96 2.75 0.34 1.29 0.04 -1.26 -4.81 135.00 132.39 2fyl s PRO 38 Ca -0.11 1.40 0.07 0.00 0.04 0.00 0.00 61.00 62.41 2fyl s PRO 38 Cb -0.06 -1.94 0.77 0.00 0.04 0.00 0.00 34.50 33.30 2fyl s PRO 38 CO -0.00 -1.29 1.85 -1.00 0.04 0.00 0.00 177.00 176.60 2fyl h PRO 39 N -0.01 0.73 -0.26 0.56 0.13 -2.02 -0.16 132.00 130.97 2fyl h PRO 39 Ca -0.47 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2fyl h PRO 39 Cb 1.25 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 2fyl h PRO 39 CO 0.54 0.48 0.17 -0.24 -0.23 0.00 0.00 178.00 178.72 2fyl h VAL 40 N 0.75 1.07 0.24 1.56 3.04 -2.00 0.23 116.25 121.14 2fyl h VAL 40 Ca 0.48 -0.12 -0.34 0.00 -1.01 0.00 0.00 66.70 65.70 2fyl h VAL 40 Cb 0.72 0.68 0.03 0.00 -2.01 0.00 0.00 31.29 30.71 2fyl h VAL 40 CO -0.24 0.06 -1.57 0.03 -1.01 0.00 0.00 177.57 174.85 2fyl h ARG 41 N 0.35 0.50 -0.43 4.17 2.47 -1.44 -3.12 114.38 116.89 2fyl h ARG 41 Ca 0.10 -0.85 -0.05 0.00 -1.26 0.00 0.00 59.98 57.91 2fyl h ARG 41 Cb -0.04 0.32 -0.02 0.00 -1.65 0.00 0.00 29.97 28.58 2fyl h ARG 41 CO -0.02 1.41 0.04 -0.07 0.56 0.00 0.00 179.97 181.88 2fyl h LEU 42 N 0.14 0.63 0.08 3.04 3.38 -0.64 0.68 115.31 122.62 2fyl h LEU 42 Ca -0.28 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.56 2fyl h LEU 42 Cb 2.15 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.74 2fyl h LEU 42 CO 0.25 0.67 -0.04 0.00 0.09 0.00 0.00 178.44 179.41 2fyl h ALA 43 N 1.41 -0.11 -0.58 1.53 0.00 -0.64 0.15 119.26 121.02 2fyl h ALA 43 Ca 0.14 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2fyl h ALA 43 Cb 0.34 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2fyl h ALA 43 CO 0.01 -0.45 0.23 0.93 0.00 0.00 0.00 179.25 179.97 2fyl h GLU 44 N -0.34 0.87 -0.51 0.00 5.08 -1.44 -1.46 114.58 116.77 2fyl h GLU 44 Ca -0.01 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 2fyl h GLU 44 Cb 0.29 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2fyl h GLU 44 CO 0.02 0.75 0.27 1.25 -1.00 0.00 0.00 179.01 180.30 2fyl h LEU 45 N 0.80 0.65 -1.00 1.33 5.85 -0.78 0.13 115.31 122.29 2fyl h LEU 45 Ca 0.19 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2fyl h LEU 45 Cb 0.20 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2fyl h LEU 45 CO -0.02 0.57 0.51 -0.74 -0.34 0.00 0.00 178.44 178.42 2fyl h HIS 46 N 0.68 1.17 -0.22 1.25 2.76 -0.43 0.23 115.15 120.60 2fyl h HIS 46 Ca 0.18 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.30 2fyl h HIS 46 Cb 0.07 -0.38 -0.01 0.00 1.55 0.00 0.00 27.41 28.65 2fyl h HIS 46 CO -0.01 0.79 -0.01 0.00 -1.30 0.00 0.00 177.93 177.40 2fyl h ALA 47 N 1.35 0.29 -0.90 5.26 0.00 -0.74 -2.00 119.26 122.51 2fyl h ALA 47 Ca 0.31 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2fyl h ALA 47 Cb -0.02 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2fyl h ALA 47 CO -0.05 0.02 0.54 -0.44 0.00 0.00 0.00 179.25 179.31 2fyl h ASP 48 N 0.15 1.09 -0.76 0.00 3.32 -0.26 -2.12 116.42 117.84 2fyl h ASP 48 Ca 0.06 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 2fyl h ASP 48 Cb 0.41 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 2fyl h ASP 48 CO 0.01 0.85 0.39 -0.07 -1.72 0.00 0.00 179.24 178.70 2fyl h LEU 49 N 1.25 0.98 -1.32 1.55 3.38 -0.42 -1.99 115.31 118.74 2fyl h LEU 49 Ca 0.32 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 2fyl h LEU 49 Cb -0.04 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2fyl h LEU 49 CO -0.06 0.81 0.06 0.11 0.09 0.00 0.00 178.44 179.45 2fyl h LYS 50 N 1.09 0.52 -0.29 1.13 1.79 -0.70 0.39 116.57 120.50 2fyl h LYS 50 Ca 0.27 -0.09 -0.11 0.00 -2.18 0.00 0.00 60.65 58.54 2fyl h LYS 50 Cb 0.07 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.62 2fyl h LYS 50 CO -0.04 0.50 -0.28 0.82 -1.08 0.00 0.00 179.45 179.37 2fyl h ILE 51 N 0.51 1.28 0.11 1.86 1.08 -1.02 -2.53 117.51 118.80 2fyl h ILE 51 Ca 0.12 -1.37 -0.26 0.00 -0.39 0.00 0.00 64.86 62.96 2fyl h ILE 51 Cb 0.23 1.37 0.03 0.00 -3.07 0.00 0.00 36.82 35.38 2fyl h ILE 51 CO 0.00 0.44 -1.09 -0.61 -0.69 0.00 0.00 178.15 176.20 2fyl h GLN 52 N 0.51 0.54 0.13 2.37 4.15 -0.92 -2.91 115.11 118.98 2fyl h GLN 52 Ca 0.07 -0.73 0.01 0.00 0.77 0.00 0.00 58.65 58.76 2fyl h GLN 52 Cb 0.75 0.24 -0.04 0.00 0.21 0.00 0.00 27.48 28.65 2fyl h GLN 52 CO 0.06 1.32 -0.43 1.49 -1.93 0.00 0.00 178.83 179.34 2fyl h GLU 53 N 0.11 -0.61 -0.56 1.69 4.81 -0.17 0.19 114.58 120.04 2fyl h GLU 53 Ca -0.17 0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 2fyl h GLU 53 Cb 1.80 0.14 -0.03 0.00 0.63 0.00 0.00 28.75 31.29 2fyl h GLU 53 CO 0.21 -0.41 0.30 -0.09 -0.73 0.00 0.00 179.01 178.29 2fyl h ARG 54 N -0.64 0.77 -0.16 1.92 2.43 -1.60 -1.60 114.38 115.51 2fyl h ARG 54 Ca -0.01 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 2fyl h ARG 54 Cb 0.63 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 2fyl h ARG 54 CO -0.22 0.57 0.06 -0.44 -1.51 0.00 0.00 179.97 178.43 2fyl h ASP 55 N 0.78 0.22 -0.61 -3.80 5.19 -1.20 0.90 116.42 117.89 2fyl h ASP 55 Ca 0.20 -0.18 -0.05 0.00 -0.62 0.00 0.00 57.03 56.37 2fyl h ASP 55 Cb 0.03 -0.06 -0.03 0.00 0.18 0.00 0.00 39.33 39.45 2fyl h ASP 55 CO -0.03 0.35 0.17 -0.08 -3.12 0.00 0.00 179.24 176.52 2fyl h GLU 56 N 0.08 0.97 -0.64 3.56 4.81 -0.35 0.22 114.58 123.24 2fyl h GLU 56 Ca 0.05 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 59.03 2fyl h GLU 56 Cb 0.20 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 2fyl h GLU 56 CO -0.00 0.87 0.28 -0.07 -0.73 0.00 0.00 179.01 179.35 2fyl h LEU 57 N 0.89 0.86 -0.29 1.64 3.38 -1.14 0.24 115.31 120.89 2fyl h LEU 57 Ca 0.20 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 2fyl h LEU 57 Cb 0.32 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2fyl h LEU 57 CO -0.00 0.78 -0.10 0.00 0.09 0.00 0.00 178.44 179.21 2fyl h ALA 58 N 1.12 0.40 -0.53 1.53 0.00 -0.52 -2.97 119.26 118.29 2fyl h ALA 58 Ca 0.21 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2fyl h ALA 58 Cb 0.17 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2fyl h ALA 58 CO -0.02 0.24 0.33 2.35 0.00 0.00 0.00 179.25 182.15 2fyl h TRP 59 N 0.33 0.67 0.02 0.00 7.01 -0.30 0.60 115.95 124.28 2fyl h TRP 59 Ca 0.07 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.08 2fyl h TRP 59 Cb 0.59 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.43 2fyl h TRP 59 CO 0.06 0.44 -0.01 -0.22 -2.79 0.00 0.00 178.44 175.91 2fyl h LYS 60 N 0.72 -0.03 -0.50 2.65 1.63 -0.80 0.30 116.57 120.53 2fyl h LYS 60 Ca 0.19 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 59.90 2fyl h LYS 60 Cb -0.05 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 2fyl h LYS 60 CO -0.04 -0.00 -0.06 -0.22 -3.45 0.00 0.00 179.45 175.68 2fyl h LYS 61 N -0.05 0.88 -0.06 1.90 3.64 -1.31 -2.45 116.57 119.12 2fyl h LYS 61 Ca -0.00 -0.28 0.01 0.00 -1.27 0.00 0.00 60.65 59.11 2fyl h LYS 61 Cb 0.04 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2fyl h LYS 61 CO 0.01 0.91 -0.01 -0.07 -2.27 0.00 0.00 179.45 178.01 2fyl h LEU 62 N 0.80 -0.05 -0.73 5.20 4.07 -0.45 -0.63 115.31 123.52 2fyl h LEU 62 Ca 0.14 0.02 0.06 0.00 0.08 0.00 0.00 57.88 58.18 2fyl h LEU 62 Cb 0.56 0.03 -0.06 0.00 1.08 0.00 0.00 40.66 42.28 2fyl h LEU 62 CO 0.03 -0.02 0.43 0.50 -1.08 0.00 0.00 178.44 178.30 2fyl h LYS 63 N 0.00 0.76 -0.50 1.13 3.11 -0.23 0.21 116.57 121.05 2fyl h LYS 63 Ca 0.03 -0.05 -0.06 0.00 -2.81 0.00 0.00 60.65 57.76 2fyl h LYS 63 Cb 0.04 -0.17 -0.02 0.00 -1.00 0.00 0.00 32.23 31.08 2fyl h LYS 63 CO -0.06 0.50 0.05 1.25 -2.81 0.00 0.00 179.45 178.38 2fyl h LEU 64 N 0.78 0.77 -0.86 5.20 6.46 -1.10 -1.78 115.31 124.78 2fyl h LEU 64 Ca 0.32 -0.17 -0.02 0.00 -0.12 0.00 0.00 57.88 57.90 2fyl h LEU 64 Cb 0.18 -0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 39.90 2fyl h LEU 64 CO -0.18 0.80 -0.10 -0.78 -0.62 0.00 0.00 178.44 177.57 2fyl h ASP 65 N 0.76 0.00 -0.07 1.25 1.82 -0.22 -3.47 116.42 116.50 2fyl h ASP 65 Ca 0.16 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.80 2fyl h ASP 65 Cb 0.39 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.40 2fyl h ASP 65 CO 0.01 0.10 0.00 0.61 -1.61 0.00 0.00 179.24 178.35 2fyl n GLY 66 N 0.45 1.20 0.09 -0.78 0.00 0.49 -5.00 105.19 101.64 2fyl n GLY 66 Ca 0.01 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 2fyl n GLY 66 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fyl h LEU 67 N 0.00 0.17 -7.14 0.99 -0.00 -1.05 -3.44 115.31 104.83 2fyl h LEU 67 Ca 0.00 -0.28 -0.51 0.00 -0.00 0.00 0.00 57.88 57.09 2fyl h LEU 67 Cb 0.47 -0.06 -0.40 0.00 -0.00 0.00 0.00 40.66 40.67 2fyl h LEU 67 CO 0.00 1.24 -0.76 -0.62 -0.00 0.00 0.00 178.44 178.30 2fyl s ASP 68 N -6.59 2.97 0.00 -0.43 2.15 -1.26 -4.94 116.67 108.56 2fyl s ASP 68 Ca -0.07 -0.91 0.00 0.00 0.43 0.00 0.00 52.55 52.00 2fyl s ASP 68 Cb 0.08 -0.50 0.00 0.00 -0.30 0.00 0.00 42.92 42.19 2fyl s ASP 68 CO 0.83 -0.35 0.00 -0.62 -0.17 0.00 0.00 175.17 174.86 2fyl n GLU 69 N 5.11 0.08 0.20 4.34 -0.58 -1.26 -4.55 120.64 123.98 2fyl n GLU 69 Ca -0.07 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.78 2fyl n GLU 69 Cb 0.46 -1.00 0.14 0.00 -0.57 0.00 0.00 31.44 30.48 2fyl n GLU 69 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 2fyl h ASP 70 N 0.00 0.00 -0.67 1.62 2.03 -1.99 -3.48 116.42 113.93 2fyl h ASP 70 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2fyl h ASP 70 Cb 0.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.51 2fyl h ASP 70 CO 0.00 0.01 0.00 0.61 -1.03 0.00 0.00 179.24 178.83 2fyl n GLY 71 N 1.12 0.95 0.11 7.15 0.00 -1.26 -5.01 105.19 108.25 2fyl n GLY 71 Ca 0.03 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.42 2fyl n GLY 71 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fyl h GLU 72 N 0.00 0.27 -0.75 1.61 4.22 -1.93 -2.69 114.58 115.31 2fyl h GLU 72 Ca 0.00 -0.45 -0.03 0.00 0.08 0.00 0.00 59.36 58.96 2fyl h GLU 72 Cb 0.64 0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.03 2fyl h GLU 72 CO 0.00 1.22 0.35 0.87 -2.18 0.00 0.00 179.01 179.26 2fyl h LYS 73 N -0.42 1.08 -0.21 1.92 1.79 -1.97 -1.54 116.57 117.22 2fyl h LYS 73 Ca -0.15 -0.17 -0.12 0.00 -2.18 0.00 0.00 60.65 58.03 2fyl h LYS 73 Cb 1.60 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 32.05 2fyl h LYS 73 CO 0.12 0.85 -0.38 1.49 -1.08 0.00 0.00 179.45 180.46 2fyl h GLU 74 N 1.05 0.48 -0.72 3.15 4.81 -1.99 -1.65 114.58 119.72 2fyl h GLU 74 Ca 0.25 -0.23 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2fyl h GLU 74 Cb 0.14 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 2fyl h GLU 74 CO -0.03 0.79 0.37 0.00 -0.73 0.00 0.00 179.01 179.41 2fyl h ALA 75 N 1.19 1.30 -0.63 2.92 0.00 -1.06 0.69 119.26 123.67 2fyl h ALA 75 Ca 0.04 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2fyl h ALA 75 Cb 0.85 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2fyl h ALA 75 CO 0.07 0.56 0.02 -0.09 0.00 0.00 0.00 179.25 179.81 2fyl h ARG 76 N 1.01 1.09 -0.57 0.00 2.43 -0.90 -2.12 114.38 115.32 2fyl h ARG 76 Ca 0.25 -0.34 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 2fyl h ARG 76 Cb 0.07 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 2fyl h ARG 76 CO -0.04 1.05 0.28 -0.07 -1.51 0.00 0.00 179.97 179.69 2fyl h LEU 77 N 1.00 0.73 -0.82 3.80 3.38 -0.31 -1.83 115.31 121.26 2fyl h LEU 77 Ca 0.18 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.04 2fyl h LEU 77 Cb 0.54 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 2fyl h LEU 77 CO 0.03 0.64 0.54 0.40 0.09 0.00 0.00 178.44 180.14 2fyl h ILE 78 N 0.77 1.21 -0.69 1.22 2.04 -0.64 0.37 117.51 121.79 2fyl h ILE 78 Ca 0.20 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2fyl h ILE 78 Cb 0.10 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.15 2fyl h ILE 78 CO -0.03 0.20 0.40 -0.09 0.00 0.00 0.00 178.15 178.64 2fyl h ARG 79 N 1.11 0.94 -0.30 2.37 2.43 -1.01 0.20 114.38 120.13 2fyl h ARG 79 Ca 0.30 -0.10 -0.12 0.00 -0.81 0.00 0.00 59.98 59.25 2fyl h ARG 79 Cb -0.13 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.22 2fyl h ARG 79 CO -0.07 0.69 -0.32 -0.97 -1.51 0.00 0.00 179.97 177.79 2fyl h ASN 80 N 0.94 0.67 -0.24 -3.80 -1.24 -0.64 -2.70 115.58 108.56 2fyl h ASN 80 Ca 0.25 -0.27 -0.05 0.00 0.71 0.00 0.00 56.30 56.94 2fyl h ASN 80 Cb -0.00 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 38.84 2fyl h ASN 80 CO -0.04 0.94 0.02 -0.07 -1.29 0.00 0.00 177.43 176.98 2fyl h LEU 81 N 0.55 0.49 -0.84 0.34 -0.00 0.43 -1.53 115.31 114.75 2fyl h LEU 81 Ca 0.06 -0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.86 2fyl h LEU 81 Cb 0.81 -0.13 -0.04 0.00 -0.00 0.00 0.00 40.66 41.31 2fyl h LEU 81 CO 0.07 0.55 0.53 -1.13 -0.00 0.00 0.00 178.44 178.45 2fyl h ASN 82 N 0.51 0.98 -0.50 -0.43 -1.24 -0.65 0.37 115.58 114.62 2fyl h ASN 82 Ca 0.11 -0.05 -0.04 0.00 0.71 0.00 0.00 56.30 57.04 2fyl h ASN 82 Cb 0.30 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.08 2fyl h ASN 82 CO 0.01 0.74 0.17 0.58 -1.29 0.00 0.00 177.43 177.64 2fyl h VAL 83 N 1.14 1.22 -0.36 2.57 2.07 -1.23 -0.77 116.25 120.89 2fyl h VAL 83 Ca 0.30 -0.73 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2fyl h VAL 83 Cb -0.08 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2fyl h VAL 83 CO -0.06 0.27 0.13 0.40 0.02 0.00 0.00 177.57 178.33 2fyl h ILE 84 N 0.68 1.20 -0.56 4.57 2.04 -0.61 -0.77 117.51 124.05 2fyl h ILE 84 Ca 0.16 -0.63 -0.05 0.00 1.00 0.00 0.00 64.86 65.34 2fyl h ILE 84 Cb 0.24 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 2fyl h ILE 84 CO -0.01 0.22 0.15 -0.07 0.00 0.00 0.00 178.15 178.44 2fyl h LEU 85 N 0.43 0.80 -0.01 1.44 3.38 -0.11 0.29 115.31 121.52 2fyl h LEU 85 Ca 0.12 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2fyl h LEU 85 Cb 0.22 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2fyl h LEU 85 CO -0.01 0.77 -0.04 0.00 0.09 0.00 0.00 178.44 179.26 2fyl n ALA 86 N -2.46 2.47 -0.12 1.53 0.00 -0.31 -0.48 120.51 121.14 2fyl n ALA 86 Ca 0.04 -0.14 -0.16 0.00 0.00 0.00 0.00 53.44 53.18 2fyl n ALA 86 Cb 0.22 -1.45 -0.11 0.00 0.00 0.00 0.00 19.45 18.12 2fyl n ALA 86 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2fyl n LYS 87 N -1.41 0.59 -0.00 0.00 4.81 -0.32 -4.71 118.16 117.12 2fyl n LYS 87 Ca 0.09 0.14 0.04 0.00 -0.87 0.00 0.00 58.31 57.71 2fyl n LYS 87 Cb 0.31 -1.47 -0.06 0.00 0.02 0.00 0.00 35.03 33.83 2fyl n LYS 87 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2fyl n TYR 88 N -3.20 0.00 -3.46 5.64 4.01 0.91 -5.05 117.16 116.01 2fyl n TYR 88 Ca -0.42 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.12 2fyl n TYR 88 Cb 0.94 -0.15 0.04 0.00 -0.31 0.00 0.00 39.34 39.86 2fyl n TYR 88 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fyl n GLY 89 N 1.85 -1.12 1.62 2.72 0.00 0.36 -4.92 105.19 105.70 2fyl n GLY 89 Ca -0.01 0.51 -0.12 0.00 0.00 0.00 0.00 46.02 46.40 2fyl n GLY 89 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fyl n LEU 90 N -3.36 5.24 -4.97 0.99 4.77 -1.26 -5.00 117.00 113.41 2fyl n LEU 90 Ca -0.09 -3.70 -0.25 0.00 -0.03 0.00 0.00 56.01 51.95 2fyl n LEU 90 Cb 0.59 -0.72 0.10 0.00 -2.33 0.00 0.00 43.42 41.06 2fyl n LEU 90 CO 0.62 1.17 0.59 1.51 -1.33 0.00 0.00 177.39 179.94 2fyl s ASP 91 N -2.00 4.41 -0.29 -1.43 -4.77 -1.26 -5.11 116.67 106.22 2fyl s ASP 91 Ca 0.50 -0.02 -0.10 0.00 -3.30 0.00 0.00 52.55 49.63 2fyl s ASP 91 Cb 0.44 -0.45 0.13 0.00 -1.09 0.00 0.00 42.92 41.95 2fyl s ASP 91 CO 0.05 -1.82 0.62 -0.83 0.70 0.00 0.00 175.17 173.88 2fyl s GLY 92 N -4.66 -0.69 -1.28 2.12 0.00 -1.26 -4.96 107.32 96.59 2fyl s GLY 92 Ca 0.65 2.25 -0.03 0.00 0.00 0.00 0.00 44.72 47.58 2fyl s GLY 92 CO 0.45 2.99 0.69 1.17 0.00 0.00 0.00 173.10 178.39 2fyl n LYS 93 N 5.44 -4.00 0.29 2.90 4.81 -1.22 -4.85 118.16 121.53 2fyl n LYS 93 Ca -0.12 0.58 0.15 0.00 -0.87 0.00 0.00 58.31 58.05 2fyl n LYS 93 Cb 0.49 -4.98 0.88 0.00 0.02 0.00 0.00 35.03 31.44 2fyl n LYS 93 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 2fyl h LYS 94 N -1.82 0.00 0.00 1.64 2.10 -1.83 -3.42 116.57 113.24 2fyl h LYS 94 Ca -0.62 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.03 2fyl h LYS 94 Cb 1.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 2fyl h LYS 94 CO 0.55 0.03 0.00 -3.47 -2.00 0.00 0.00 179.45 174.56 2fyl n ASP 95 N -3.77 -3.45 -0.01 7.07 2.03 -1.26 -5.00 116.55 112.16 2fyl n ASP 95 Ca -0.03 0.76 -0.02 0.00 0.52 0.00 0.00 54.79 56.03 2fyl n ASP 95 Cb 0.12 3.29 -0.01 0.00 -0.72 0.00 0.00 41.12 43.80 2fyl n ASP 95 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2fyl n ALA 96 N -3.29 2.22 -1.03 -1.67 0.00 -1.26 -5.26 120.51 110.21 2fyl n ALA 96 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2fyl n ALA 96 Cb 0.00 0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.91 2fyl n ALA 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37