#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kfk n HIS 2 N 0.00 0.00 0.00 6.00 8.25 -1.26 -5.08 115.22 123.13 2kfk n HIS 2 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2kfk n HIS 2 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2kfk n HIS 2 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2kfk n MET 3 N -0.91 0.00 0.00 -0.41 0.00 -1.26 -5.08 117.12 109.46 2kfk n MET 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 2kfk n MET 3 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 2kfk n MET 3 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2kfk n LYS 4 N 0.00 0.00 -1.10 3.17 4.81 -1.26 -5.01 118.16 118.77 2kfk n LYS 4 Ca 0.00 0.37 0.15 0.00 -0.87 0.00 0.00 58.31 57.96 2kfk n LYS 4 Cb 0.00 -1.14 -0.04 0.00 0.02 0.00 0.00 35.03 33.87 2kfk n LYS 4 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2kfk n THR 5 N -1.61 0.00 -4.24 3.15 -2.24 -1.26 -4.90 114.28 103.18 2kfk n THR 5 Ca 0.00 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.53 2kfk n THR 5 Cb 0.00 -0.37 -0.08 0.00 -2.10 0.00 0.00 70.33 67.78 2kfk n THR 5 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2kfk s THR 6 N -1.79 3.62 -0.72 4.28 2.01 0.01 -4.84 115.64 118.21 2kfk s THR 6 Ca 0.00 -1.58 -0.12 0.00 0.31 0.00 0.00 61.69 60.30 2kfk s THR 6 Cb 0.00 -2.85 0.19 0.00 0.01 0.00 0.00 72.50 69.84 2kfk s THR 6 CO 0.00 -0.19 0.63 -0.75 -0.69 0.00 0.00 174.62 173.62 2kfk s LYS 7 N -3.16 3.22 -0.07 4.92 2.47 -1.26 -2.71 119.74 123.14 2kfk s LYS 7 Ca 0.28 -2.31 0.04 0.00 -1.56 0.00 0.00 55.97 52.42 2kfk s LYS 7 Cb -0.08 -4.23 -0.02 0.00 -1.46 0.00 0.00 37.83 32.04 2kfk s LYS 7 CO 0.19 -1.26 -0.19 0.42 0.16 0.00 0.00 175.35 174.66 2kfk s ILE 8 N 0.42 2.55 0.55 5.43 -1.09 -1.02 -4.97 121.20 123.06 2kfk s ILE 8 Ca 0.15 -0.88 0.08 0.00 -2.23 0.00 0.00 60.65 57.77 2kfk s ILE 8 Cb -0.16 -1.99 0.07 0.00 -1.58 0.00 0.00 42.46 38.80 2kfk s ILE 8 CO -0.06 0.56 0.75 -1.59 -1.23 0.00 0.00 174.94 173.38 2kfk s LYS 9 N -0.17 2.40 0.09 2.79 -2.85 -1.26 -0.58 119.74 120.17 2kfk s LYS 9 Ca -0.02 -1.47 -0.16 0.00 -1.00 0.00 0.00 55.97 53.31 2kfk s LYS 9 Cb -0.14 -2.65 0.03 0.00 -2.06 0.00 0.00 37.83 33.02 2kfk s LYS 9 CO 0.04 -0.75 0.38 -0.06 0.10 0.00 0.00 175.35 175.06 2kfk s PHE 10 N -2.62 -0.19 -0.12 1.78 0.40 0.17 -2.42 117.98 114.97 2kfk s PHE 10 Ca 0.60 -0.02 0.01 0.00 -0.60 0.00 0.00 56.93 56.92 2kfk s PHE 10 Cb -0.07 0.21 0.02 0.00 0.51 0.00 0.00 43.02 43.69 2kfk s PHE 10 CO 0.38 -0.63 -0.15 0.71 0.70 0.00 0.00 175.22 176.23 2kfk s TYR 11 N -3.27 2.05 -0.23 0.36 1.51 0.56 0.52 117.35 118.85 2kfk s TYR 11 Ca -0.00 -1.04 -0.00 0.00 -1.01 0.00 0.00 57.07 55.01 2kfk s TYR 11 Cb 0.01 -1.49 0.03 0.00 -0.11 0.00 0.00 41.96 40.40 2kfk s TYR 11 CO -0.08 -0.55 -0.10 -0.47 -1.11 0.00 0.00 175.55 173.24 2kfk s TYR 12 N 1.19 3.04 0.00 2.71 5.04 0.54 0.29 117.35 130.16 2kfk s TYR 12 Ca -0.02 -1.70 0.00 0.00 -2.44 0.00 0.00 57.07 52.92 2kfk s TYR 12 Cb -0.14 -2.01 0.00 0.00 0.35 0.00 0.00 41.96 40.16 2kfk s TYR 12 CO -0.05 -0.77 0.00 1.63 -1.34 0.00 0.00 175.55 175.02 2kfk n LYS 13 N 4.62 0.00 -0.48 4.97 5.02 -1.23 0.83 118.16 131.88 2kfk n LYS 13 Ca -0.17 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.13 2kfk n LYS 13 Cb 0.47 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.50 2kfk n LYS 13 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2kfk n ASP 14 N 0.61 0.33 -4.22 4.39 5.75 -1.26 -5.09 116.55 117.06 2kfk n ASP 14 Ca 0.00 -2.14 -0.18 0.00 -0.01 0.00 0.00 54.79 52.45 2kfk n ASP 14 Cb 0.00 -0.23 -0.11 0.00 -1.03 0.00 0.00 41.12 39.74 2kfk n ASP 14 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 2kfk s ASP 15 N -1.27 1.94 -0.11 -1.12 1.11 0.24 -5.15 116.67 112.32 2kfk s ASP 15 Ca 0.05 -0.74 0.04 0.00 0.18 0.00 0.00 52.55 52.07 2kfk s ASP 15 Cb 0.05 -0.07 0.00 0.00 1.07 0.00 0.00 42.92 43.97 2kfk s ASP 15 CO -0.00 -0.11 -0.23 -0.63 1.18 0.00 0.00 175.17 175.38 2kfk s ILE 16 N -1.82 1.99 0.35 0.77 1.01 -1.26 0.20 121.20 122.45 2kfk s ILE 16 Ca 0.05 -0.97 0.08 0.00 0.00 0.00 0.00 60.65 59.82 2kfk s ILE 16 Cb -0.07 -1.74 -0.05 0.00 0.01 0.00 0.00 42.46 40.62 2kfk s ILE 16 CO 0.03 0.54 0.09 -0.36 0.00 0.00 0.00 174.94 175.24 2kfk s PHE 17 N 0.48 2.62 -0.04 3.97 0.08 0.19 -4.89 117.98 120.39 2kfk s PHE 17 Ca -0.16 -0.43 0.02 0.00 0.12 0.00 0.00 56.93 56.48 2kfk s PHE 17 Cb -0.17 -1.61 0.01 0.00 -0.57 0.00 0.00 43.02 40.67 2kfk s PHE 17 CO 0.06 0.38 -0.09 0.00 -0.10 0.00 0.00 175.22 175.48 2kfk s ALA 18 N -2.49 0.90 0.39 5.36 0.00 -1.26 0.42 121.76 125.08 2kfk s ALA 18 Ca 0.37 -0.28 0.04 0.00 0.00 0.00 0.00 51.96 52.09 2kfk s ALA 18 Cb -0.01 -0.39 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 2kfk s ALA 18 CO 0.21 0.10 0.15 -0.51 0.00 0.00 0.00 175.76 175.72 2kfk s LEU 19 N 0.44 1.93 -0.18 0.00 1.43 0.26 -4.99 118.68 117.56 2kfk s LEU 19 Ca -0.07 -1.68 -0.01 0.00 -1.03 0.00 0.00 54.13 51.34 2kfk s LEU 19 Cb -0.11 0.02 0.05 0.00 0.03 0.00 0.00 46.19 46.18 2kfk s LEU 19 CO 0.01 -0.95 -0.03 0.00 0.23 0.00 0.00 176.35 175.62 2kfk s MET 20 N -3.68 1.22 -0.18 1.70 0.23 -1.25 -2.44 119.30 114.90 2kfk s MET 20 Ca 0.27 -0.56 -0.01 0.00 -1.03 0.00 0.00 55.69 54.36 2kfk s MET 20 Cb 0.03 -2.11 -0.00 0.00 -1.53 0.00 0.00 34.83 31.21 2kfk s MET 20 CO 0.17 -0.52 -0.11 -0.51 -2.03 0.00 0.00 175.02 172.01 2kfk s LEU 21 N 1.66 2.64 1.23 0.18 2.01 -1.10 -4.74 118.68 120.57 2kfk s LEU 21 Ca -0.01 -0.43 -0.16 0.00 0.01 0.00 0.00 54.13 53.54 2kfk s LEU 21 Cb -0.16 -1.63 0.30 0.00 0.01 0.00 0.00 46.19 44.71 2kfk s LEU 21 CO -0.07 0.05 1.01 -0.54 1.01 0.00 0.00 176.35 177.81 2kfk s LYS 22 N 1.04 -1.45 0.00 1.70 1.02 -1.26 -0.81 119.74 119.98 2kfk s LYS 22 Ca -0.01 0.51 0.02 0.00 0.02 0.00 0.00 55.97 56.52 2kfk s LYS 22 Cb -0.15 -1.52 0.13 0.00 -0.52 0.00 0.00 37.83 35.77 2kfk s LYS 22 CO -0.02 -3.99 0.65 0.41 -0.92 0.00 0.00 175.35 171.47 2kfk n GLY 23 N 0.63 -0.53 0.11 -3.33 0.00 -1.26 -2.27 105.19 98.54 2kfk n GLY 23 Ca 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 46.08 2kfk n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kfk n ASP 24 N -0.56 0.58 -4.74 1.61 2.03 -1.26 -5.09 116.55 109.11 2kfk n ASP 24 Ca 0.02 -1.57 -0.42 0.00 0.52 0.00 0.00 54.79 53.33 2kfk n ASP 24 Cb 0.01 -0.08 -0.01 0.00 -0.72 0.00 0.00 41.12 40.32 2kfk n ASP 24 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2kfk n THR 25 N -0.21 1.23 -2.97 5.18 -1.04 -0.96 -5.02 114.28 110.49 2kfk n THR 25 Ca 0.01 -0.31 -0.18 0.00 -2.04 0.00 0.00 64.05 61.53 2kfk n THR 25 Cb 0.51 -1.89 0.03 0.00 -1.82 0.00 0.00 70.33 67.15 2kfk n THR 25 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2kfk s THR 26 N -0.26 2.74 0.06 12.58 2.01 -1.26 -4.06 115.64 127.45 2kfk s THR 26 Ca 0.62 -0.96 -0.34 0.00 0.31 0.00 0.00 61.69 61.32 2kfk s THR 26 Cb -0.51 -2.78 -0.18 0.00 0.01 0.00 0.00 72.50 69.03 2kfk s THR 26 CO 0.52 0.00 1.52 0.22 -0.69 0.00 0.00 174.62 176.19 2kfk h TYR 27 N 0.44 -1.19 -0.99 4.92 3.20 -1.83 0.19 116.97 121.73 2kfk h TYR 27 Ca -0.38 -0.02 0.34 0.00 3.14 0.00 0.00 58.73 61.82 2kfk h TYR 27 Cb 1.28 0.41 -0.17 0.00 1.54 0.00 0.00 36.73 39.79 2kfk h TYR 27 CO 0.39 -0.69 0.33 0.87 -1.64 0.00 0.00 178.16 177.41 2kfk h LYS 28 N -1.17 0.05 0.52 1.82 1.79 -1.94 1.13 116.57 118.77 2kfk h LYS 28 Ca -0.11 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.33 2kfk h LYS 28 Cb 0.92 -0.01 0.01 0.00 -1.58 0.00 0.00 32.23 31.56 2kfk h LYS 28 CO 0.15 0.04 -0.25 1.49 -1.08 0.00 0.00 179.45 179.79 2kfk h GLU 29 N 0.05 -0.67 -0.50 3.15 4.81 -1.81 0.34 114.58 119.97 2kfk h GLU 29 Ca 0.72 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 60.09 2kfk h GLU 29 Cb 1.73 0.15 -0.08 0.00 0.63 0.00 0.00 28.75 31.18 2kfk h GLU 29 CO -0.80 -0.41 0.06 1.25 -0.73 0.00 0.00 179.01 178.38 2kfk h LEU 30 N -0.77 -0.09 -0.10 1.64 7.12 0.29 -1.93 115.31 121.47 2kfk h LEU 30 Ca -0.07 0.10 0.00 0.00 0.13 0.00 0.00 57.88 58.04 2kfk h LEU 30 Cb 0.57 0.16 -0.00 0.00 -0.53 0.00 0.00 40.66 40.85 2kfk h LEU 30 CO 0.12 -0.02 0.06 -0.09 -0.13 0.00 0.00 178.44 178.38 2kfk h ARG 31 N 0.18 0.13 -0.17 1.25 2.43 0.90 -2.05 114.38 117.04 2kfk h ARG 31 Ca 0.25 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.46 2kfk h ARG 31 Cb 0.36 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2kfk h ARG 31 CO -0.37 0.10 0.21 1.03 -1.51 0.00 0.00 179.97 179.43 2kfk h SER 32 N 0.12 0.00 0.05 -3.80 0.87 0.32 -1.25 113.55 109.86 2kfk h SER 32 Ca 0.03 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.38 2kfk h SER 32 Cb -0.00 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 61.98 2kfk h SER 32 CO -0.01 0.00 -0.88 0.50 -0.53 0.00 0.00 176.83 175.91 2kfk h LYS 33 N 0.00 0.51 -0.08 2.24 3.64 -0.67 -3.32 116.57 118.89 2kfk h LYS 33 Ca 0.08 -0.61 -0.16 0.00 -1.27 0.00 0.00 60.65 58.69 2kfk h LYS 33 Cb 0.50 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 2kfk h LYS 33 CO -0.00 1.24 -0.63 0.82 -2.27 0.00 0.00 179.45 178.60 2kfk h ILE 34 N 0.06 1.38 0.13 2.00 2.04 -0.89 -3.33 117.51 118.91 2kfk h ILE 34 Ca -0.12 -2.02 0.02 0.00 1.00 0.00 0.00 64.86 63.73 2kfk h ILE 34 Cb 1.59 2.02 -0.05 0.00 -0.74 0.00 0.00 36.82 39.64 2kfk h ILE 34 CO 0.17 0.60 -0.46 0.00 0.00 0.00 0.00 178.15 178.46 2kfk h ALA 35 N 1.11 -0.84 0.00 1.87 0.00 -1.38 0.64 119.26 120.65 2kfk h ALA 35 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2kfk h ALA 35 Cb 1.16 0.77 0.00 0.00 0.00 0.00 0.00 17.79 19.72 2kfk h ALA 35 CO 0.10 -1.04 0.16 -1.00 0.00 0.00 0.00 179.25 177.47 2kfk h PRO 36 N -0.70 0.00 0.06 0.00 0.13 -1.68 -0.89 132.00 128.92 2kfk h PRO 36 Ca 0.01 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.99 2kfk h PRO 36 Cb 0.72 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 2kfk h PRO 36 CO -0.26 0.00 -0.75 0.00 -0.23 0.00 0.00 178.00 176.77 2kfk h ARG 37 N 0.00 0.13 0.00 0.86 2.47 -1.16 -3.47 114.38 113.21 2kfk h ARG 37 Ca 0.00 -0.23 0.00 0.00 -1.26 0.00 0.00 59.98 58.49 2kfk h ARG 37 Cb 0.32 0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 2kfk h ARG 37 CO 0.00 1.11 0.00 -0.89 0.56 0.00 0.00 179.97 180.75 2kfk n ILE 38 N -4.29 0.00 -1.09 2.04 5.41 0.03 -4.98 119.36 116.48 2kfk n ILE 38 Ca -0.18 0.00 0.09 0.00 1.00 0.00 0.00 62.75 63.66 2kfk n ILE 38 Cb 0.70 -1.03 0.17 0.00 -0.71 0.00 0.00 39.64 38.77 2kfk n ILE 38 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2kfk n ASP 39 N -2.48 2.66 -3.91 4.38 8.00 -1.26 -4.97 116.55 118.97 2kfk n ASP 39 Ca 0.00 -3.13 -0.09 0.00 0.71 0.00 0.00 54.79 52.29 2kfk n ASP 39 Cb 0.00 -0.46 -0.08 0.00 -0.02 0.00 0.00 41.12 40.56 2kfk n ASP 39 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2kfk s THR 40 N -2.89 0.16 -1.66 -3.53 -1.32 -1.26 -5.02 115.64 100.11 2kfk s THR 40 Ca 0.35 -1.28 0.15 0.00 -1.21 0.00 0.00 61.69 59.69 2kfk s THR 40 Cb 0.30 -1.32 0.21 0.00 -1.51 0.00 0.00 72.50 70.18 2kfk s THR 40 CO 0.04 -0.71 1.08 -0.90 -2.21 0.00 0.00 174.62 171.92 2kfk n ASP 41 N 0.07 2.54 -3.87 8.08 5.75 -1.26 -4.68 116.55 123.19 2kfk n ASP 41 Ca -0.15 -1.74 -0.29 0.00 -0.01 0.00 0.00 54.79 52.60 2kfk n ASP 41 Cb 0.62 -0.10 -0.13 0.00 -1.03 0.00 0.00 41.12 40.48 2kfk n ASP 41 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2kfk s ASN 42 N -1.16 4.18 0.01 -1.12 4.22 -1.26 -5.06 114.94 114.74 2kfk s ASN 42 Ca 0.21 -3.13 -0.05 0.00 -2.14 0.00 0.00 52.86 47.76 2kfk s ASN 42 Cb 0.14 -1.46 -0.00 0.00 1.28 0.00 0.00 41.25 41.20 2kfk s ASN 42 CO 0.19 -0.20 0.08 0.72 -2.04 0.00 0.00 177.10 175.85 2kfk s PHE 43 N -0.42 0.10 0.27 1.54 -0.71 -1.26 -2.51 117.98 115.00 2kfk s PHE 43 Ca 0.20 -0.23 0.10 0.00 -1.04 0.00 0.00 56.93 55.95 2kfk s PHE 43 Cb -0.20 -0.09 -0.04 0.00 -1.21 0.00 0.00 43.02 41.49 2kfk s PHE 43 CO -0.05 -0.24 0.00 -1.59 -1.34 0.00 0.00 175.22 172.01 2kfk s LYS 44 N -1.30 2.28 0.06 1.99 0.00 0.20 -4.89 119.74 118.07 2kfk s LYS 44 Ca -0.14 -1.44 0.07 0.00 0.00 0.00 0.00 55.97 54.46 2kfk s LYS 44 Cb -0.08 -2.15 -0.03 0.00 0.00 0.00 0.00 37.83 35.58 2kfk s LYS 44 CO 0.01 0.34 -0.20 -0.51 0.00 0.00 0.00 175.35 174.98 2kfk s LEU 45 N -3.68 2.21 -0.12 2.77 2.01 -1.26 -0.63 118.68 119.97 2kfk s LEU 45 Ca 0.32 -0.57 -0.13 0.00 0.01 0.00 0.00 54.13 53.76 2kfk s LEU 45 Cb -0.06 -0.93 0.03 0.00 0.01 0.00 0.00 46.19 45.24 2kfk s LEU 45 CO 0.20 0.12 0.35 0.00 1.01 0.00 0.00 176.35 178.03 2kfk s GLN 46 N -1.39 0.45 -0.16 1.70 -2.07 -0.24 0.11 119.66 118.06 2kfk s GLN 46 Ca 0.07 0.41 -0.29 0.00 -1.82 0.00 0.00 55.36 53.73 2kfk s GLN 46 Cb -0.09 0.21 -0.05 0.00 -1.09 0.00 0.00 33.01 32.00 2kfk s GLN 46 CO 0.02 -0.07 1.87 0.95 -1.32 0.00 0.00 175.29 176.74 2kfk s THR 47 N 0.01 3.34 -0.14 3.63 -4.23 0.24 0.23 115.64 118.72 2kfk s THR 47 Ca -0.02 0.39 -0.19 0.00 -1.18 0.00 0.00 61.69 60.69 2kfk s THR 47 Cb -0.03 -3.35 -0.04 0.00 1.34 0.00 0.00 72.50 70.42 2kfk s THR 47 CO 0.01 -0.15 0.53 -0.75 -0.54 0.00 0.00 174.62 173.73 2kfk s LYS 48 N 5.09 4.30 0.23 3.99 2.36 0.50 -2.41 119.74 133.79 2kfk s LYS 48 Ca 0.83 0.51 0.03 0.00 -2.55 0.00 0.00 55.97 54.80 2kfk s LYS 48 Cb -0.31 -3.49 -0.01 0.00 -1.05 0.00 0.00 37.83 32.97 2kfk s LYS 48 CO 0.34 0.01 0.11 1.47 1.55 0.00 0.00 175.35 178.83 2kfk n LEU 49 N 4.16 0.00 -0.41 5.43 -0.00 -1.26 -4.12 117.00 120.81 2kfk n LEU 49 Ca -0.05 -1.85 0.34 0.00 -0.00 0.00 0.00 56.01 54.44 2kfk n LEU 49 Cb 0.51 0.71 0.55 0.00 -0.00 0.00 0.00 43.42 45.19 2kfk n LEU 49 CO 0.43 -0.29 0.99 2.22 -0.00 0.00 0.00 177.39 180.75 2kfk n PHE 50 N -0.50 0.42 -0.03 1.47 -1.74 -1.26 0.13 117.46 115.96 2kfk n PHE 50 Ca -0.01 0.43 -0.19 0.00 -0.56 0.00 0.00 57.45 57.12 2kfk n PHE 50 Cb 0.36 -0.83 -0.13 0.00 1.52 0.00 0.00 39.48 40.40 2kfk n PHE 50 CO 0.00 0.00 0.00 0.22 -0.56 0.00 0.00 176.76 176.42 2kfk h ASP 51 N 0.00 0.21 0.00 5.98 3.58 -1.99 -3.48 116.42 120.72 2kfk h ASP 51 Ca 0.69 -0.86 0.00 0.00 0.42 0.00 0.00 57.03 57.29 2kfk h ASP 51 Cb 2.37 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 43.35 2kfk h ASP 51 CO -0.28 1.35 0.00 0.61 -2.88 0.00 0.00 179.24 178.04 2kfk n GLY 52 N 1.63 0.90 2.57 -0.78 0.00 0.35 -4.98 105.19 104.87 2kfk n GLY 52 Ca -0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 2kfk n GLY 52 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2kfk n SER 53 N 0.00 2.71 -1.50 1.61 2.88 -1.26 -4.78 113.62 113.28 2kfk n SER 53 Ca 0.00 -3.35 0.00 0.00 -1.33 0.00 0.00 58.87 54.19 2kfk n SER 53 Cb 0.00 -0.59 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 2kfk n SER 53 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kfk n GLY 54 N 0.03 0.91 3.88 0.46 0.00 -1.01 -5.00 105.19 104.47 2kfk n GLY 54 Ca 0.28 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.55 2kfk n GLY 54 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2kfk s GLU 55 N 0.08 3.69 -0.32 1.61 -1.05 -1.24 -4.79 118.70 116.68 2kfk s GLU 55 Ca 0.00 0.06 -0.23 0.00 -0.15 0.00 0.00 54.97 54.65 2kfk s GLU 55 Cb 0.00 -2.83 0.00 0.00 -0.44 0.00 0.00 34.13 30.86 2kfk s GLU 55 CO 0.00 0.45 0.76 -2.00 0.95 0.00 0.00 175.26 175.42 2kfk s GLU 56 N -2.53 3.89 -0.61 -4.83 2.12 -1.26 0.81 118.70 116.29 2kfk s GLU 56 Ca 0.41 0.45 -0.27 0.00 0.36 0.00 0.00 54.97 55.92 2kfk s GLU 56 Cb -0.12 -3.75 -0.02 0.00 0.26 0.00 0.00 34.13 30.50 2kfk s GLU 56 CO 0.22 -0.71 1.85 0.96 -0.54 0.00 0.00 175.26 177.04 2kfk s ILE 57 N 2.93 3.36 0.00 -3.70 -0.00 0.31 -4.62 121.20 119.49 2kfk s ILE 57 Ca 0.31 0.21 0.00 0.00 -0.00 0.00 0.00 60.65 61.17 2kfk s ILE 57 Cb -0.14 -3.95 0.00 0.00 -0.00 0.00 0.00 42.46 38.37 2kfk s ILE 57 CO 0.14 -0.92 0.00 0.29 -0.00 0.00 0.00 174.94 174.45 2kfk n LYS 58 N 9.18 1.13 -4.30 0.37 5.02 -1.26 -4.42 118.16 123.87 2kfk n LYS 58 Ca 0.20 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.22 2kfk n LYS 58 Cb 0.52 -0.98 -0.10 0.00 -0.02 0.00 0.00 35.03 34.45 2kfk n LYS 58 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2kfk s THR 59 N -1.94 3.08 0.34 -0.18 -4.23 -1.26 -4.76 115.64 106.68 2kfk s THR 59 Ca 0.00 -1.68 0.03 0.00 -1.18 0.00 0.00 61.69 58.86 2kfk s THR 59 Cb 0.00 -2.51 0.28 0.00 1.34 0.00 0.00 72.50 71.61 2kfk s THR 59 CO 0.00 -0.09 1.96 -2.24 -0.54 0.00 0.00 174.62 173.70 2kfk h ASP 60 N 3.01 0.77 0.02 3.99 3.04 -1.91 -2.17 116.42 123.17 2kfk h ASP 60 Ca -0.47 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.32 2kfk h ASP 60 Cb 1.20 -0.17 0.00 0.00 -1.04 0.00 0.00 39.33 39.32 2kfk h ASP 60 CO 0.53 0.51 0.00 -1.28 -2.04 0.00 0.00 179.24 176.96 2kfk h SER 61 N 0.88 0.00 0.00 4.15 0.87 -1.96 -1.22 113.55 116.27 2kfk h SER 61 Ca 0.32 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 2kfk h SER 61 Cb 0.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 2kfk h SER 61 CO -0.10 0.00 -0.47 0.00 -0.53 0.00 0.00 176.83 175.73 2kfk n GLN 62 N -2.91 0.29 -0.29 2.24 6.02 -0.83 -3.47 117.38 118.43 2kfk n GLN 62 Ca -0.03 0.24 0.04 0.00 -0.01 0.00 0.00 57.00 57.24 2kfk n GLN 62 Cb 0.07 -1.14 0.13 0.00 1.02 0.00 0.00 30.24 30.32 2kfk n GLN 62 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 177.06 175.66 2kfk h VAL 63 N -0.58 0.18 0.41 5.09 -1.51 -1.54 0.68 116.25 118.98 2kfk h VAL 63 Ca 0.00 -0.01 -0.01 0.00 -1.23 0.00 0.00 66.70 65.45 2kfk h VAL 63 Cb 0.47 0.16 -0.02 0.00 -2.13 0.00 0.00 31.29 29.77 2kfk h VAL 63 CO 0.00 0.00 -0.39 -1.28 -1.23 0.00 0.00 177.57 174.67 2kfk h SER 64 N 0.02 -1.07 -1.18 4.19 0.87 -1.36 -0.64 113.55 114.37 2kfk h SER 64 Ca 0.42 0.08 0.34 0.00 -1.23 0.00 0.00 61.79 61.41 2kfk h SER 64 Cb 0.69 0.35 -0.05 0.00 -0.44 0.00 0.00 62.40 62.95 2kfk h SER 64 CO -0.83 -0.52 0.92 -1.13 -0.53 0.00 0.00 176.83 174.74 2kfk h ASN 65 N -0.79 0.00 0.63 6.23 -1.24 -0.48 2.11 115.58 122.04 2kfk h ASN 65 Ca -0.05 0.00 -0.16 0.00 0.71 0.00 0.00 56.30 56.80 2kfk h ASN 65 Cb 0.68 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.72 2kfk h ASN 65 CO -0.04 0.00 -0.74 0.40 -1.29 0.00 0.00 177.43 175.76 2kfk h ILE 66 N 0.00 1.49 0.00 2.57 5.03 0.16 1.69 117.51 128.46 2kfk h ILE 66 Ca 0.56 -2.44 -0.18 0.00 -0.12 0.00 0.00 64.86 62.68 2kfk h ILE 66 Cb 2.40 2.32 -0.02 0.00 -3.03 0.00 0.00 36.82 38.49 2kfk h ILE 66 CO -0.01 0.70 -0.84 0.16 -0.68 0.00 0.00 178.15 177.48 2kfk h ILE 67 N 0.05 1.57 0.00 -0.67 3.07 0.45 0.67 117.51 122.66 2kfk h ILE 67 Ca -0.02 -2.80 -0.02 0.00 1.55 0.00 0.00 64.86 63.57 2kfk h ILE 67 Cb 1.31 2.52 -0.00 0.00 -0.27 0.00 0.00 36.82 40.38 2kfk h ILE 67 CO 0.10 0.80 -0.32 1.56 -1.05 0.00 0.00 178.15 179.24 2kfk h GLN 68 N 0.02 0.00 0.00 0.16 4.20 -0.78 -3.33 115.11 115.38 2kfk h GLN 68 Ca -0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2kfk h GLN 68 Cb 1.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.26 2kfk h GLN 68 CO 0.11 0.20 0.00 0.00 -0.67 0.00 0.00 178.83 178.47 2kfk h ALA 69 N -0.85 1.00 -4.91 3.87 0.00 0.24 -3.46 119.26 115.16 2kfk h ALA 69 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.56 2kfk h ALA 69 Cb 0.43 0.00 0.12 0.00 0.00 0.00 0.00 17.79 18.33 2kfk h ALA 69 CO -0.02 0.00 -0.56 1.63 0.00 0.00 0.00 179.25 180.30 2kfk n LYS 70 N -2.89 -6.31 -2.41 0.00 4.01 0.19 -4.95 118.16 105.79 2kfk n LYS 70 Ca -0.01 0.67 -0.41 0.00 -0.51 0.00 0.00 58.31 58.05 2kfk n LYS 70 Cb 0.17 -5.22 -0.04 0.00 -0.51 0.00 0.00 35.03 29.43 2kfk n LYS 70 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2kfk s LEU 71 N -6.02 4.52 0.42 -0.35 1.02 0.11 -4.99 118.68 113.39 2kfk s LEU 71 Ca 0.42 2.31 -0.23 0.00 0.02 0.00 0.00 54.13 56.64 2kfk s LEU 71 Cb -0.18 -3.62 -0.09 0.00 0.02 0.00 0.00 46.19 42.31 2kfk s LEU 71 CO 0.59 -0.24 1.07 -0.54 0.02 0.00 0.00 176.35 177.25 2kfk s LYS 72 N -1.21 4.07 0.16 1.70 -0.14 -1.26 -4.61 119.74 118.44 2kfk s LYS 72 Ca 0.47 1.54 0.07 0.00 -1.36 0.00 0.00 55.97 56.69 2kfk s LYS 72 Cb -0.33 -2.48 -0.04 0.00 -1.68 0.00 0.00 37.83 33.30 2kfk s LYS 72 CO 0.41 -0.23 -0.16 0.42 -0.76 0.00 0.00 175.35 175.03 2kfk s ILE 73 N -1.67 1.61 -0.17 2.17 1.01 -1.01 0.19 121.20 123.32 2kfk s ILE 73 Ca 0.60 -1.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.33 2kfk s ILE 73 Cb -0.22 -1.77 0.04 0.00 0.01 0.00 0.00 42.46 40.52 2kfk s ILE 73 CO 0.28 -0.42 -0.03 -0.44 0.00 0.00 0.00 174.94 174.33 2kfk s SER 74 N -2.73 2.80 -0.04 3.58 0.01 0.63 -0.33 113.70 117.62 2kfk s SER 74 Ca 0.15 -0.67 -0.05 0.00 1.31 0.00 0.00 55.95 56.68 2kfk s SER 74 Cb -0.04 -0.84 -0.04 0.00 0.21 0.00 0.00 66.02 65.31 2kfk s SER 74 CO 0.05 -0.21 0.19 0.54 0.41 0.00 0.00 173.24 174.23 2kfk s VAL 75 N 1.68 5.42 0.10 3.43 0.11 0.84 -1.08 120.40 130.91 2kfk s VAL 75 Ca 0.00 0.05 -0.06 0.00 -2.93 0.00 0.00 61.98 59.04 2kfk s VAL 75 Cb -0.15 -3.51 -0.02 0.00 -1.53 0.00 0.00 36.38 31.17 2kfk s VAL 75 CO -0.07 0.43 0.15 -1.00 -3.33 0.00 0.00 175.10 171.28 2kfk s HIS 76 N -1.22 0.39 0.68 1.54 3.76 0.19 -3.37 115.29 117.26 2kfk s HIS 76 Ca 0.23 -0.82 -0.14 0.00 -0.15 0.00 0.00 55.06 54.18 2kfk s HIS 76 Cb -0.13 -0.19 0.01 0.00 1.11 0.00 0.00 32.58 33.39 2kfk s HIS 76 CO 0.13 -0.55 1.12 0.34 -0.85 0.00 0.00 174.74 174.93 2kfk s ASP 77 N -2.92 4.90 0.00 1.40 2.15 -1.26 0.58 116.67 121.51 2kfk s ASP 77 Ca 0.11 2.02 0.02 0.00 0.43 0.00 0.00 52.55 55.13 2kfk s ASP 77 Cb 0.06 -2.55 0.02 0.00 -0.30 0.00 0.00 42.92 40.14 2kfk s ASP 77 CO -0.06 -1.77 0.56 -0.38 -0.17 0.00 0.00 175.17 173.35