#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kfk s HIS 2 N 0.00 0.64 -0.30 6.00 2.46 -1.26 -5.00 115.29 117.83 2kfk s HIS 2 Ca 0.00 -0.15 0.07 0.00 0.47 0.00 0.00 55.06 55.45 2kfk s HIS 2 Cb 0.00 -0.71 0.25 0.00 -0.13 0.00 0.00 32.58 31.99 2kfk s HIS 2 CO 0.00 -0.26 1.20 0.00 -2.47 0.00 0.00 174.74 173.21 2kfk n MET 3 N 4.71 0.81 -1.73 2.88 0.00 -1.26 -5.14 117.12 117.39 2kfk n MET 3 Ca -0.14 -1.09 -0.39 0.00 0.00 0.00 0.00 57.70 56.08 2kfk n MET 3 Cb 0.50 0.11 0.04 0.00 0.00 0.00 0.00 33.22 33.87 2kfk n MET 3 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 2kfk n LYS 4 N -0.75 1.64 -4.07 3.17 -0.00 -1.26 -5.02 118.16 111.88 2kfk n LYS 4 Ca -0.13 0.60 -0.12 0.00 -0.00 0.00 0.00 58.31 58.67 2kfk n LYS 4 Cb 0.75 -2.51 -0.06 0.00 -0.00 0.00 0.00 35.03 33.22 2kfk n LYS 4 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2kfk s THR 5 N -1.30 0.00 0.18 0.58 -4.23 -1.26 -4.48 115.64 105.12 2kfk s THR 5 Ca 0.71 -1.58 0.05 0.00 -1.18 0.00 0.00 61.69 59.69 2kfk s THR 5 Cb -0.43 -2.43 -0.04 0.00 1.34 0.00 0.00 72.50 70.95 2kfk s THR 5 CO 0.50 0.00 0.19 -0.89 -0.54 0.00 0.00 174.62 173.88 2kfk s THR 6 N -3.66 4.68 -0.64 3.99 2.01 -0.21 -4.84 115.64 116.97 2kfk s THR 6 Ca 0.28 -1.05 -0.07 0.00 0.31 0.00 0.00 61.69 61.17 2kfk s THR 6 Cb 0.01 -3.42 0.17 0.00 0.01 0.00 0.00 72.50 69.26 2kfk s THR 6 CO 0.14 -0.15 0.49 -0.75 -0.69 0.00 0.00 174.62 173.66 2kfk s LYS 7 N -3.28 2.78 -0.06 4.92 2.36 -1.26 -2.50 119.74 122.70 2kfk s LYS 7 Ca 0.32 -2.34 0.03 0.00 -2.55 0.00 0.00 55.97 51.43 2kfk s LYS 7 Cb -0.10 -3.94 -0.02 0.00 -1.05 0.00 0.00 37.83 32.72 2kfk s LYS 7 CO 0.25 -1.20 -0.16 0.42 1.55 0.00 0.00 175.35 176.20 2kfk s ILE 8 N 0.30 2.87 0.55 5.43 -1.09 -0.88 -4.96 121.20 123.43 2kfk s ILE 8 Ca 0.15 -0.78 0.09 0.00 -2.23 0.00 0.00 60.65 57.88 2kfk s ILE 8 Cb -0.19 -2.13 0.07 0.00 -1.58 0.00 0.00 42.46 38.64 2kfk s ILE 8 CO -0.04 0.57 0.73 -1.59 -1.23 0.00 0.00 174.94 173.38 2kfk s LYS 9 N -0.44 2.38 0.08 2.79 -2.85 -1.26 -0.20 119.74 120.25 2kfk s LYS 9 Ca 0.05 -1.61 -0.16 0.00 -1.00 0.00 0.00 55.97 53.25 2kfk s LYS 9 Cb -0.12 -2.63 0.03 0.00 -2.06 0.00 0.00 37.83 33.05 2kfk s LYS 9 CO 0.02 -0.75 0.39 -0.06 0.10 0.00 0.00 175.35 175.04 2kfk s PHE 10 N -2.62 -0.21 -0.13 1.78 0.40 0.10 -2.38 117.98 114.92 2kfk s PHE 10 Ca 0.59 0.02 0.01 0.00 -0.60 0.00 0.00 56.93 56.95 2kfk s PHE 10 Cb -0.06 0.21 0.02 0.00 0.51 0.00 0.00 43.02 43.70 2kfk s PHE 10 CO 0.37 -0.62 -0.15 0.71 0.70 0.00 0.00 175.22 176.22 2kfk s TYR 11 N -3.13 2.12 -0.27 0.36 1.51 0.87 0.96 117.35 119.78 2kfk s TYR 11 Ca -0.01 -1.10 -0.00 0.00 -1.01 0.00 0.00 57.07 54.95 2kfk s TYR 11 Cb 0.01 -1.54 0.05 0.00 -0.11 0.00 0.00 41.96 40.37 2kfk s TYR 11 CO -0.07 -0.58 -0.06 -0.47 -1.11 0.00 0.00 175.55 173.27 2kfk s TYR 12 N 1.20 3.21 0.00 2.71 5.04 0.52 0.30 117.35 130.33 2kfk s TYR 12 Ca -0.01 -1.96 0.00 0.00 -2.44 0.00 0.00 57.07 52.66 2kfk s TYR 12 Cb -0.14 -2.03 0.00 0.00 0.35 0.00 0.00 41.96 40.14 2kfk s TYR 12 CO -0.06 -0.82 0.00 1.63 -1.34 0.00 0.00 175.55 174.97 2kfk n LYS 13 N 4.57 0.00 -0.60 4.97 5.02 -1.23 0.15 118.16 131.03 2kfk n LYS 13 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 2kfk n LYS 13 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.45 2kfk n LYS 13 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2kfk n ASP 14 N 0.56 0.08 -4.24 4.39 2.03 -1.26 -5.10 116.55 113.01 2kfk n ASP 14 Ca 0.00 -1.87 -0.19 0.00 0.52 0.00 0.00 54.79 53.25 2kfk n ASP 14 Cb 0.00 -0.18 -0.11 0.00 -0.72 0.00 0.00 41.12 40.11 2kfk n ASP 14 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 2kfk s ASP 15 N -0.97 2.10 -0.11 1.67 -4.77 0.12 -5.15 116.67 109.57 2kfk s ASP 15 Ca 0.03 -0.76 0.03 0.00 -3.30 0.00 0.00 52.55 48.56 2kfk s ASP 15 Cb 0.04 -0.09 0.01 0.00 -1.09 0.00 0.00 42.92 41.79 2kfk s ASP 15 CO -0.02 -0.09 -0.22 -0.63 0.70 0.00 0.00 175.17 174.92 2kfk s ILE 16 N -1.80 1.93 0.38 2.11 1.01 -1.26 0.20 121.20 123.77 2kfk s ILE 16 Ca 0.07 -0.93 0.08 0.00 0.00 0.00 0.00 60.65 59.87 2kfk s ILE 16 Cb -0.07 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.68 2kfk s ILE 16 CO 0.03 0.53 0.29 -0.36 0.00 0.00 0.00 174.94 175.43 2kfk s PHE 17 N 0.55 2.74 -0.05 3.97 0.08 0.27 -4.88 117.98 120.67 2kfk s PHE 17 Ca -0.14 -0.44 0.00 0.00 0.12 0.00 0.00 56.93 56.47 2kfk s PHE 17 Cb -0.17 -1.96 0.02 0.00 -0.57 0.00 0.00 43.02 40.34 2kfk s PHE 17 CO 0.05 0.07 -0.03 0.00 -0.10 0.00 0.00 175.22 175.21 2kfk s ALA 18 N -2.44 0.65 0.41 5.36 0.00 -1.26 0.01 121.76 124.49 2kfk s ALA 18 Ca 0.44 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.37 2kfk s ALA 18 Cb -0.03 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 2kfk s ALA 18 CO 0.26 -0.12 0.11 -0.51 0.00 0.00 0.00 175.76 175.50 2kfk s LEU 19 N 1.15 2.05 -0.17 0.00 1.43 0.73 -4.99 118.68 118.88 2kfk s LEU 19 Ca -0.07 -1.64 -0.01 0.00 -1.03 0.00 0.00 54.13 51.38 2kfk s LEU 19 Cb -0.14 -0.21 0.05 0.00 0.03 0.00 0.00 46.19 45.92 2kfk s LEU 19 CO -0.01 -0.89 -0.02 0.00 0.23 0.00 0.00 176.35 175.66 2kfk s MET 20 N -3.75 1.12 -0.14 1.70 0.23 -1.24 -2.07 119.30 115.16 2kfk s MET 20 Ca 0.23 -0.47 0.01 0.00 -1.03 0.00 0.00 55.69 54.43 2kfk s MET 20 Cb 0.03 -1.99 -0.00 0.00 -1.53 0.00 0.00 34.83 31.34 2kfk s MET 20 CO 0.13 -0.50 -0.17 -0.51 -2.03 0.00 0.00 175.02 171.95 2kfk s LEU 21 N 1.71 2.42 1.13 0.18 2.01 -1.04 -4.74 118.68 120.36 2kfk s LEU 21 Ca -0.00 -0.47 -0.13 0.00 0.01 0.00 0.00 54.13 53.54 2kfk s LEU 21 Cb -0.16 -1.54 0.25 0.00 0.01 0.00 0.00 46.19 44.75 2kfk s LEU 21 CO -0.07 0.11 0.93 0.29 1.01 0.00 0.00 176.35 178.61 2kfk n LYS 22 N 3.89 -2.07 0.00 1.70 4.76 -1.26 -1.04 118.16 124.14 2kfk n LYS 22 Ca -0.19 -0.57 0.00 0.00 -2.87 0.00 0.00 58.31 54.68 2kfk n LYS 22 Cb 0.52 -2.15 0.00 0.00 -1.84 0.00 0.00 35.03 31.56 2kfk n LYS 22 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2kfk n GLY 23 N 1.01 0.04 0.26 0.72 0.00 -1.26 -2.15 105.19 103.82 2kfk n GLY 23 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.17 0.00 -4.74 1.61 2.03 -1.26 -5.06 116.55 108.96 2kfk n ASP 24 Ca 0.00 -1.45 -0.42 0.00 0.52 0.00 0.00 54.79 53.44 2kfk n ASP 24 Cb 0.05 -0.09 -0.01 0.00 -0.72 0.00 0.00 41.12 40.35 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 0.00 1.77 -2.85 5.18 -1.04 -0.91 -5.02 114.28 111.41 2kfk n THR 25 Ca 0.00 -0.44 -0.19 0.00 -2.04 0.00 0.00 64.05 61.38 2kfk n THR 25 Cb 0.59 -1.81 0.02 0.00 -1.82 0.00 0.00 70.33 67.32 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 -0.85 2.87 0.05 12.58 2.01 -1.26 -3.94 115.64 127.11 2kfk s THR 26 Ca 0.57 -0.85 -0.28 0.00 0.31 0.00 0.00 61.69 61.44 2kfk s THR 26 Cb -0.52 -3.01 -0.15 0.00 0.01 0.00 0.00 72.50 68.83 2kfk s THR 26 CO 0.60 -0.01 1.42 0.22 -0.69 0.00 0.00 174.62 176.16 2kfk h TYR 27 N 0.39 -0.99 -0.99 4.92 3.20 -1.81 -0.04 116.97 121.64 2kfk h TYR 27 Ca -0.41 -0.01 0.36 0.00 3.14 0.00 0.00 58.73 61.81 2kfk h TYR 27 Cb 1.29 0.35 -0.17 0.00 1.54 0.00 0.00 36.73 39.74 2kfk h TYR 27 CO 0.39 -0.56 0.47 0.87 -1.64 0.00 0.00 178.16 177.69 2kfk h LYS 28 N -0.92 0.10 0.57 1.82 1.57 -1.93 1.10 116.57 118.88 2kfk h LYS 28 Ca -0.08 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 2kfk h LYS 28 Cb 0.73 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 33.03 2kfk h LYS 28 CO 0.08 0.07 -0.27 1.49 -0.57 0.00 0.00 179.45 180.25 2kfk h GLU 29 N 0.10 -0.74 -0.51 3.15 4.81 -1.80 0.43 114.58 120.02 2kfk h GLU 29 Ca 0.77 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 60.13 2kfk h GLU 29 Cb 1.90 0.17 -0.07 0.00 0.63 0.00 0.00 28.75 31.38 2kfk h GLU 29 CO -0.74 -0.47 0.13 1.25 -0.73 0.00 0.00 179.01 178.45 2kfk h LEU 30 N -0.81 0.05 -0.10 1.64 7.12 0.28 -1.99 115.31 121.49 2kfk h LEU 30 Ca -0.08 0.09 -0.00 0.00 0.13 0.00 0.00 57.88 58.02 2kfk h LEU 30 Cb 0.61 0.11 -0.00 0.00 -0.53 0.00 0.00 40.66 40.84 2kfk h LEU 30 CO 0.13 0.05 0.06 -0.09 -0.13 0.00 0.00 178.44 178.46 2kfk h ARG 31 N 0.27 0.14 -0.17 1.25 2.43 0.69 -2.19 114.38 116.81 2kfk h ARG 31 Ca 0.26 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.46 2kfk h ARG 31 Cb 0.34 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2kfk h ARG 31 CO -0.32 0.16 0.20 1.03 -1.51 0.00 0.00 179.97 179.54 2kfk h SER 32 N 0.09 0.00 0.04 -3.80 0.87 0.38 -1.26 113.55 109.86 2kfk h SER 32 Ca 0.04 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.36 2kfk h SER 32 Cb 0.06 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2kfk h SER 32 CO -0.01 0.00 -0.93 0.50 -0.53 0.00 0.00 176.83 175.86 2kfk h LYS 33 N 0.00 0.56 -0.04 2.24 3.64 -0.76 -3.32 116.57 118.90 2kfk h LYS 33 Ca 0.08 -0.66 -0.16 0.00 -1.27 0.00 0.00 60.65 58.64 2kfk h LYS 33 Cb 0.48 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 2kfk h LYS 33 CO -0.00 1.26 -0.71 0.82 -2.27 0.00 0.00 179.45 178.55 2kfk h ILE 34 N 0.15 1.43 0.20 2.00 2.04 -0.89 -3.33 117.51 119.11 2kfk h ILE 34 Ca -0.13 -2.24 0.01 0.00 1.00 0.00 0.00 64.86 63.50 2kfk h ILE 34 Cb 1.62 2.19 -0.04 0.00 -0.74 0.00 0.00 36.82 39.85 2kfk h ILE 34 CO 0.18 0.66 -0.43 0.00 0.00 0.00 0.00 178.15 178.56 2kfk h ALA 35 N 1.12 -0.82 0.00 1.87 0.00 -1.40 0.45 119.26 120.48 2kfk h ALA 35 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2kfk h ALA 35 Cb 1.26 0.70 0.00 0.00 0.00 0.00 0.00 17.79 19.74 2kfk h ALA 35 CO 0.11 -1.02 0.12 -1.00 0.00 0.00 0.00 179.25 177.45 2kfk h PRO 36 N -0.72 0.00 0.07 0.00 0.13 -1.67 -1.17 132.00 128.63 2kfk h PRO 36 Ca 0.00 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.90 2kfk h PRO 36 Cb 0.71 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.83 2kfk h PRO 36 CO -0.20 0.00 -1.18 0.00 -0.23 0.00 0.00 178.00 176.39 2kfk h ARG 37 N 0.00 0.15 0.00 0.86 2.47 -1.24 -3.47 114.38 113.14 2kfk h ARG 37 Ca 0.00 -0.25 0.00 0.00 -1.26 0.00 0.00 59.98 58.47 2kfk h ARG 37 Cb 0.24 0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.65 2kfk h ARG 37 CO 0.00 1.12 0.00 -0.89 0.56 0.00 0.00 179.97 180.76 2kfk n ILE 38 N -4.14 0.00 -1.06 2.04 5.41 -0.01 -4.98 119.36 116.62 2kfk n ILE 38 Ca -0.25 0.00 0.09 0.00 1.00 0.00 0.00 62.75 63.59 2kfk n ILE 38 Cb 0.79 -1.01 0.19 0.00 -0.71 0.00 0.00 39.64 38.89 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 -2.69 2.92 -3.91 4.38 8.00 -1.26 -4.97 116.55 119.03 2kfk n ASP 39 Ca 0.00 -3.09 -0.09 0.00 0.71 0.00 0.00 54.79 52.32 2kfk n ASP 39 Cb 0.00 -0.48 -0.08 0.00 -0.02 0.00 0.00 41.12 40.54 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 -2.88 0.16 -1.66 -3.53 -1.32 -1.26 -5.02 115.64 100.13 2kfk s THR 40 Ca 0.36 -1.29 0.15 0.00 -1.21 0.00 0.00 61.69 59.70 2kfk s THR 40 Cb 0.31 -1.33 0.20 0.00 -1.51 0.00 0.00 72.50 70.17 2kfk s THR 40 CO 0.05 -0.71 1.07 -0.90 -2.21 0.00 0.00 174.62 171.92 2kfk n ASP 41 N 0.06 2.52 -3.87 8.08 5.75 -1.26 -4.68 116.55 123.14 2kfk n ASP 41 Ca -0.15 -1.72 -0.29 0.00 -0.01 0.00 0.00 54.79 52.61 2kfk n ASP 41 Cb 0.62 -0.09 -0.13 0.00 -1.03 0.00 0.00 41.12 40.49 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 4.19 0.01 -1.12 4.22 -1.26 -5.06 114.94 114.75 2kfk s ASN 42 Ca 0.21 -3.15 -0.04 0.00 -2.14 0.00 0.00 52.86 47.75 2kfk s ASN 42 Cb 0.13 -1.47 -0.01 0.00 1.28 0.00 0.00 41.25 41.19 2kfk s ASN 42 CO 0.19 -0.20 0.06 0.72 -2.04 0.00 0.00 177.10 175.83 2kfk s PHE 43 N -0.43 0.14 0.27 1.54 -0.71 -1.26 -2.46 117.98 115.06 2kfk s PHE 43 Ca 0.20 -0.31 0.10 0.00 -1.04 0.00 0.00 56.93 55.87 2kfk s PHE 43 Cb -0.19 -0.11 -0.04 0.00 -1.21 0.00 0.00 43.02 41.46 2kfk s PHE 43 CO -0.05 -0.24 -0.03 -1.59 -1.34 0.00 0.00 175.22 171.97 2kfk s LYS 44 N -1.40 2.22 0.06 1.99 0.00 0.20 -4.89 119.74 117.91 2kfk s LYS 44 Ca -0.15 -1.46 0.08 0.00 0.00 0.00 0.00 55.97 54.43 2kfk s LYS 44 Cb -0.09 -2.11 -0.03 0.00 0.00 0.00 0.00 37.83 35.60 2kfk s LYS 44 CO 0.00 0.36 -0.21 -0.51 0.00 0.00 0.00 175.35 174.99 2kfk s LEU 45 N -3.65 2.20 -0.13 2.77 2.01 -1.26 -0.58 118.68 120.04 2kfk s LEU 45 Ca 0.31 -0.57 -0.13 0.00 0.01 0.00 0.00 54.13 53.75 2kfk s LEU 45 Cb -0.06 -0.97 0.03 0.00 0.01 0.00 0.00 46.19 45.20 2kfk s LEU 45 CO 0.19 0.14 0.36 0.00 1.01 0.00 0.00 176.35 178.05 2kfk s GLN 46 N -1.39 0.44 -0.13 1.70 -2.07 -0.19 0.12 119.66 118.14 2kfk s GLN 46 Ca 0.08 0.45 -0.29 0.00 -1.82 0.00 0.00 55.36 53.77 2kfk s GLN 46 Cb -0.09 0.21 -0.05 0.00 -1.09 0.00 0.00 33.01 31.99 2kfk s GLN 46 CO 0.03 -0.06 1.88 0.95 -1.32 0.00 0.00 175.29 176.77 2kfk s THR 47 N 0.07 3.31 -0.16 3.63 -4.23 0.25 0.24 115.64 118.75 2kfk s THR 47 Ca -0.01 0.35 -0.18 0.00 -1.18 0.00 0.00 61.69 60.67 2kfk s THR 47 Cb -0.03 -3.30 -0.04 0.00 1.34 0.00 0.00 72.50 70.47 2kfk s THR 47 CO 0.01 -0.12 0.49 -0.75 -0.54 0.00 0.00 174.62 173.71 2kfk s LYS 48 N 5.02 4.27 0.23 3.99 2.36 0.46 -2.35 119.74 133.71 2kfk s LYS 48 Ca 0.84 0.43 0.03 0.00 -2.55 0.00 0.00 55.97 54.72 2kfk s LYS 48 Cb -0.33 -3.49 -0.01 0.00 -1.05 0.00 0.00 37.83 32.95 2kfk s LYS 48 CO 0.34 0.02 0.10 1.47 1.55 0.00 0.00 175.35 178.84 2kfk n LEU 49 N 4.18 0.00 -0.45 5.43 -0.00 -1.26 -4.11 117.00 120.79 2kfk n LEU 49 Ca -0.06 -1.82 0.36 0.00 -0.00 0.00 0.00 56.01 54.49 2kfk n LEU 49 Cb 0.51 0.69 0.59 0.00 -0.00 0.00 0.00 43.42 45.20 2kfk n LEU 49 CO 0.43 -0.29 1.06 2.22 -0.00 0.00 0.00 177.39 180.81 2kfk n PHE 50 N -0.50 0.38 -0.03 1.47 -1.74 -1.26 0.13 117.46 115.91 2kfk n PHE 50 Ca -0.02 0.39 -0.19 0.00 -0.56 0.00 0.00 57.45 57.07 2kfk n PHE 50 Cb 0.36 -0.79 -0.13 0.00 1.52 0.00 0.00 39.48 40.43 2kfk n PHE 50 CO 0.00 0.00 0.00 -0.44 -0.56 0.00 0.00 176.76 175.76 2kfk h ASP 51 N 0.00 0.21 0.00 5.98 3.32 -1.99 -3.48 116.42 120.46 2kfk h ASP 51 Ca 0.73 -0.86 0.00 0.00 0.02 0.00 0.00 57.03 56.92 2kfk h ASP 51 Cb 2.55 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 42.03 2kfk h ASP 51 CO -0.26 1.35 0.00 0.61 -1.72 0.00 0.00 179.24 179.22 2kfk n GLY 52 N 1.63 0.89 2.59 2.75 0.00 0.34 -4.98 105.19 108.41 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 1.44 0.00 0.00 0.00 173.32 174.76 2kfk n SER 53 N 0.00 2.85 -1.49 1.61 7.64 -1.26 -4.78 113.62 118.19 2kfk n SER 53 Ca 0.00 -3.37 0.00 0.00 1.01 0.00 0.00 58.87 56.51 2kfk n SER 53 Cb 0.00 -0.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.62 2kfk n SER 53 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kfk n GLY 54 N -0.03 0.79 3.89 0.23 0.00 -0.99 -5.00 105.19 104.09 2kfk n GLY 54 Ca 0.28 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.58 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 0.00 3.65 -0.32 1.61 -1.05 -1.24 -4.79 118.70 116.56 2kfk s GLU 55 Ca 0.00 -0.03 -0.22 0.00 -0.15 0.00 0.00 54.97 54.57 2kfk s GLU 55 Cb 0.00 -2.81 -0.00 0.00 -0.44 0.00 0.00 34.13 30.88 2kfk s GLU 55 CO 0.00 0.44 0.72 -2.00 0.95 0.00 0.00 175.26 175.37 2kfk s GLU 56 N -2.71 3.89 -0.68 -4.83 2.12 -1.26 0.87 118.70 116.09 2kfk s GLU 56 Ca 0.42 0.41 -0.26 0.00 0.36 0.00 0.00 54.97 55.90 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 0.24 -0.67 1.84 0.96 -0.54 0.00 0.00 175.26 177.10 2kfk s ILE 57 N 2.84 3.40 -0.00 -3.70 -0.00 0.32 -4.60 121.20 119.45 2kfk s ILE 57 Ca 0.29 0.08 0.01 0.00 -0.00 0.00 0.00 60.65 61.03 2kfk s ILE 57 Cb -0.14 -4.02 -0.02 0.00 -0.00 0.00 0.00 42.46 38.28 2kfk s ILE 57 CO 0.13 -0.98 0.02 0.29 -0.00 0.00 0.00 174.94 174.40 2kfk n LYS 58 N 9.13 0.77 -4.32 0.37 5.02 -1.26 -4.41 118.16 123.45 2kfk n LYS 58 Ca 0.24 -0.01 -0.27 0.00 -2.02 0.00 0.00 58.31 56.25 2kfk n LYS 58 Cb 0.51 -1.03 -0.10 0.00 -0.02 0.00 0.00 35.03 34.39 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 -2.06 3.00 0.32 -0.18 -4.23 -1.26 -4.77 115.64 106.47 2kfk s THR 59 Ca -0.00 -1.72 0.02 0.00 -1.18 0.00 0.00 61.69 58.81 2kfk s THR 59 Cb 0.01 -2.47 0.28 0.00 1.34 0.00 0.00 72.50 71.66 2kfk s THR 59 CO 0.04 -0.09 1.94 -2.24 -0.54 0.00 0.00 174.62 173.73 2kfk h ASP 60 N 3.03 0.82 -0.00 3.99 3.04 -1.91 -2.28 116.42 123.10 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 -0.18 -0.00 0.00 -1.04 0.00 0.00 39.33 39.31 2kfk h ASP 60 CO 0.52 0.54 0.04 -1.28 -2.04 0.00 0.00 179.24 177.02 2kfk h SER 61 N 0.94 0.00 0.00 4.15 0.87 -1.96 -1.41 113.55 116.13 2kfk h SER 61 Ca 0.34 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.90 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 -0.11 0.00 -0.49 0.00 -0.53 0.00 0.00 176.83 175.69 2kfk n GLN 62 N -3.13 0.32 -0.30 2.24 6.02 -0.87 -3.44 117.38 118.21 2kfk n GLN 62 Ca -0.03 0.29 0.05 0.00 -0.01 0.00 0.00 57.00 57.30 2kfk n GLN 62 Cb 0.11 -1.24 0.14 0.00 1.02 0.00 0.00 30.24 30.27 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 -0.66 0.15 0.38 5.09 -1.51 -1.54 0.69 116.25 118.86 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 0.49 0.13 -0.02 0.00 -2.13 0.00 0.00 31.29 29.77 2kfk h VAL 63 CO 0.00 0.00 -0.38 -1.28 -1.23 0.00 0.00 177.57 174.69 2kfk h SER 64 N 0.02 -1.03 -1.22 4.19 0.87 -1.37 -0.75 113.55 114.25 2kfk h SER 64 Ca 0.44 0.08 0.35 0.00 -1.23 0.00 0.00 61.79 61.43 2kfk h SER 64 Cb 0.72 0.34 -0.05 0.00 -0.44 0.00 0.00 62.40 62.98 2kfk h SER 64 CO -0.86 -0.50 0.94 -1.13 -0.53 0.00 0.00 176.83 174.75 2kfk h ASN 65 N -0.75 0.00 0.59 6.23 -1.24 -0.35 1.99 115.58 122.05 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 0.65 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.69 2kfk h ASN 65 CO -0.05 0.00 -0.72 0.40 -1.29 0.00 0.00 177.43 175.77 2kfk h ILE 66 N 0.00 1.48 -0.00 2.57 5.03 0.15 1.67 117.51 128.41 2kfk h ILE 66 Ca 0.58 -2.37 -0.17 0.00 -0.12 0.00 0.00 64.86 62.78 2kfk h ILE 66 Cb 2.45 2.27 -0.02 0.00 -3.03 0.00 0.00 36.82 38.49 2kfk h ILE 66 CO -0.01 0.68 -0.80 0.16 -0.68 0.00 0.00 178.15 177.51 2kfk h ILE 67 N 0.07 1.54 0.00 -0.67 3.07 0.42 0.28 117.51 122.22 2kfk h ILE 67 Ca -0.02 -2.64 -0.01 0.00 1.55 0.00 0.00 64.86 63.75 2kfk h ILE 67 Cb 1.28 2.43 -0.00 0.00 -0.27 0.00 0.00 36.82 40.26 2kfk h ILE 67 CO 0.10 0.76 -0.26 1.56 -1.05 0.00 0.00 178.15 179.26 2kfk h GLN 68 N 0.04 0.00 0.00 0.16 4.20 -0.83 -3.34 115.11 115.33 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 1.41 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.19 2kfk h GLN 68 CO 0.11 0.08 0.00 0.00 -0.67 0.00 0.00 178.83 178.35 2kfk h ALA 69 N -0.94 1.00 -3.24 3.87 0.00 0.24 -3.45 119.26 116.73 2kfk h ALA 69 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.64 2kfk h ALA 69 Cb 0.31 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.15 2kfk h ALA 69 CO -0.01 0.00 -0.39 1.63 0.00 0.00 0.00 179.25 180.48 2kfk n LYS 70 N -2.83 -3.57 -2.35 0.00 5.02 0.61 -4.96 118.16 110.09 2kfk n LYS 70 Ca -0.02 0.56 -0.41 0.00 -2.02 0.00 0.00 58.31 56.42 2kfk n LYS 70 Cb 0.11 -4.70 -0.03 0.00 -0.02 0.00 0.00 35.03 30.38 2kfk n LYS 70 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2kfk s LEU 71 N -4.51 4.46 0.44 -0.35 1.02 0.67 -5.00 118.68 115.41 2kfk s LEU 71 Ca 0.23 2.31 -0.22 0.00 0.02 0.00 0.00 54.13 56.47 2kfk s LEU 71 Cb -0.10 -3.62 -0.09 0.00 0.02 0.00 0.00 46.19 42.40 2kfk s LEU 71 CO 0.29 -0.36 1.04 -0.54 0.02 0.00 0.00 176.35 176.80 2kfk s LYS 72 N -0.62 3.99 0.16 1.70 -0.14 -1.26 -4.62 119.74 118.95 2kfk s LYS 72 Ca 0.51 1.44 0.07 0.00 -1.36 0.00 0.00 55.97 56.63 2kfk s LYS 72 Cb -0.34 -2.33 -0.04 0.00 -1.68 0.00 0.00 37.83 33.45 2kfk s LYS 72 CO 0.39 -0.28 -0.15 0.42 -0.76 0.00 0.00 175.35 174.97 2kfk s ILE 73 N -1.81 1.58 -0.17 2.17 1.01 -1.00 0.17 121.20 123.14 2kfk s ILE 73 Ca 0.62 -1.92 -0.01 0.00 0.00 0.00 0.00 60.65 59.35 2kfk s ILE 73 Cb -0.19 -1.77 0.05 0.00 0.01 0.00 0.00 42.46 40.55 2kfk s ILE 73 CO 0.24 -0.44 -0.03 -0.44 0.00 0.00 0.00 174.94 174.26 2kfk s SER 74 N -2.77 2.86 -0.03 3.58 0.01 0.66 -0.09 113.70 117.92 2kfk s SER 74 Ca 0.15 -0.70 -0.05 0.00 1.31 0.00 0.00 55.95 56.66 2kfk s SER 74 Cb -0.04 -0.85 -0.04 0.00 0.21 0.00 0.00 66.02 65.30 2kfk s SER 74 CO 0.05 -0.21 0.20 0.54 0.41 0.00 0.00 173.24 174.23 2kfk s VAL 75 N 1.67 5.41 0.12 3.43 0.11 0.87 -1.02 120.40 130.99 2kfk s VAL 75 Ca 0.00 0.05 -0.07 0.00 -2.93 0.00 0.00 61.98 59.03 2kfk s VAL 75 Cb -0.16 -3.52 -0.01 0.00 -1.53 0.00 0.00 36.38 31.16 2kfk s VAL 75 CO -0.07 0.42 0.18 -1.00 -3.33 0.00 0.00 175.10 171.29 2kfk s HIS 76 N -1.24 0.40 0.68 1.54 3.76 0.25 -3.38 115.29 117.30 2kfk s HIS 76 Ca 0.24 -0.81 -0.14 0.00 -0.15 0.00 0.00 55.06 54.20 2kfk s HIS 76 Cb -0.13 -0.16 0.01 0.00 1.11 0.00 0.00 32.58 33.41 2kfk s HIS 76 CO 0.14 -0.59 1.11 0.34 -0.85 0.00 0.00 174.74 174.90 2kfk s ASP 77 N -2.94 4.99 0.00 1.40 -1.08 -1.26 0.59 116.67 118.36 2kfk s ASP 77 Ca 0.13 2.00 0.02 0.00 -0.52 0.00 0.00 52.55 54.18 2kfk s ASP 77 Cb 0.05 -2.55 0.01 0.00 -1.46 0.00 0.00 42.92 38.97 2kfk s ASP 77 CO -0.05 -1.71 0.56 -0.38 0.52 0.00 0.00 175.17 174.11