#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kn6 n VAL 5 N 0.00 0.00 0.00 -4.37 0.31 -1.26 -3.93 118.33 109.07 1kn6 n VAL 5 Ca 0.00 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1kn6 n VAL 5 Cb 0.00 0.55 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 1kn6 n VAL 5 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1kn6 n ASN 6 N -0.27 0.00 -4.26 4.52 2.85 -1.26 -4.55 115.26 112.29 1kn6 n ASN 6 Ca 0.00 0.00 -0.25 0.00 -0.11 0.00 0.00 54.58 54.22 1kn6 n ASN 6 Cb 0.00 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 40.93 1kn6 n ASN 6 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 1kn6 s GLU 7 N 0.00 1.89 -0.02 1.20 4.04 -1.11 -4.12 118.70 120.58 1kn6 s GLU 7 Ca 0.00 -2.14 -0.01 0.00 0.04 0.00 0.00 54.97 52.87 1kn6 s GLU 7 Cb 0.00 -0.76 -0.04 0.00 0.02 0.00 0.00 34.13 33.35 1kn6 s GLU 7 CO 0.00 -0.40 0.06 -0.46 -1.84 0.00 0.00 175.26 172.63 1kn6 s TRP 8 N -3.20 3.26 0.00 4.83 -0.00 -1.14 -2.32 118.94 120.37 1kn6 s TRP 8 Ca 0.25 0.21 0.01 0.00 -0.00 0.00 0.00 56.10 56.57 1kn6 s TRP 8 Cb 0.04 -1.75 -0.01 0.00 -0.00 0.00 0.00 33.47 31.76 1kn6 s TRP 8 CO 0.14 0.54 -0.04 0.00 -0.00 0.00 0.00 176.95 177.59 1kn6 s ALA 9 N -1.13 0.31 0.24 5.86 0.00 -1.13 0.36 121.76 126.27 1kn6 s ALA 9 Ca 0.21 -0.22 -0.12 0.00 0.00 0.00 0.00 51.96 51.83 1kn6 s ALA 9 Cb -0.12 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 1kn6 s ALA 9 CO 0.11 0.06 0.46 0.00 0.00 0.00 0.00 175.76 176.39 1kn6 s ALA 10 N -0.24 -0.18 -0.16 0.00 0.00 0.37 -3.14 121.76 118.40 1kn6 s ALA 10 Ca -0.00 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.06 1kn6 s ALA 10 Cb -0.02 1.07 0.03 0.00 0.00 0.00 0.00 23.12 24.20 1kn6 s ALA 10 CO -0.00 -0.84 -0.11 -1.21 0.00 0.00 0.00 175.76 173.60 1kn6 s GLU 11 N -4.02 2.05 -0.22 0.00 2.02 -1.20 0.14 118.70 117.47 1kn6 s GLU 11 Ca 0.23 -0.60 -0.04 0.00 0.02 0.00 0.00 54.97 54.57 1kn6 s GLU 11 Cb -0.00 -2.13 0.11 0.00 0.10 0.00 0.00 34.13 32.21 1kn6 s GLU 11 CO 0.09 -0.32 0.39 -1.50 0.02 0.00 0.00 175.26 173.94 1kn6 s ILE 12 N 1.50 -0.62 0.51 -1.63 -1.16 -1.07 -3.50 121.20 115.23 1kn6 s ILE 12 Ca 0.03 0.04 0.31 0.00 -0.51 0.00 0.00 60.65 60.53 1kn6 s ILE 12 Cb -0.14 -0.74 0.50 0.00 0.61 0.00 0.00 42.46 42.70 1kn6 s ILE 12 CO -0.09 -0.03 1.82 -0.65 -2.81 0.00 0.00 174.94 173.17 1kn6 h PRO 13 N 8.18 0.08 0.00 3.50 0.11 -1.85 -3.38 132.00 138.64 1kn6 h PRO 13 Ca -0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1kn6 h PRO 13 Cb 1.13 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1kn6 h PRO 13 CO 0.20 0.06 0.00 0.41 -0.21 0.00 0.00 178.00 178.46 1kn6 n GLY 14 N -1.69 0.44 2.88 -0.55 0.00 -1.26 -4.78 105.19 100.22 1kn6 n GLY 14 Ca 0.24 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.06 1kn6 n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kn6 n GLY 15 N 4.53 -0.20 0.04 -0.02 0.00 -1.26 -4.74 105.19 103.55 1kn6 n GLY 15 Ca 0.00 0.03 -0.00 0.00 0.00 0.00 0.00 46.02 46.05 1kn6 n GLY 15 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1kn6 h GLN 16 N -0.39 0.00 0.00 1.61 4.20 -1.89 -1.80 115.11 116.83 1kn6 h GLN 16 Ca -0.27 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.40 1kn6 h GLN 16 Cb 0.66 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 1kn6 h GLN 16 CO 0.41 0.00 -0.19 0.93 -0.67 0.00 0.00 178.83 179.31 1kn6 h GLU 17 N -0.89 0.00 0.00 1.46 5.08 -1.99 -3.16 114.58 115.08 1kn6 h GLU 17 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1kn6 h GLU 17 Cb 0.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 1kn6 h GLU 17 CO 0.00 0.19 -0.03 0.00 -1.00 0.00 0.00 179.01 178.17 1kn6 h ALA 18 N 1.81 0.00 -0.73 3.43 0.00 -1.93 -2.56 119.26 119.28 1kn6 h ALA 18 Ca -0.00 -0.09 0.16 0.00 0.00 0.00 0.00 54.91 54.98 1kn6 h ALA 18 Cb 1.04 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.73 1kn6 h ALA 18 CO 0.02 0.02 0.09 0.00 0.00 0.00 0.00 179.25 179.38 1kn6 h ALA 19 N -0.88 0.85 -0.01 0.00 0.00 -1.45 1.01 119.26 118.78 1kn6 h ALA 19 Ca -0.00 0.20 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 1kn6 h ALA 19 Cb 0.15 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1kn6 h ALA 19 CO -0.00 -0.39 -0.41 0.66 0.00 0.00 0.00 179.25 179.11 1kn6 h SER 20 N 0.17 0.02 1.18 0.00 4.64 -1.70 -2.54 113.55 115.31 1kn6 h SER 20 Ca 0.41 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.63 1kn6 h SER 20 Cb 0.71 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.78 1kn6 h SER 20 CO -0.58 0.43 -0.45 0.00 -0.87 0.00 0.00 176.83 175.36 1kn6 h ALA 21 N 1.58 0.81 0.75 5.18 0.00 0.11 -3.17 119.26 124.52 1kn6 h ALA 21 Ca -0.00 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1kn6 h ALA 21 Cb 0.73 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.46 1kn6 h ALA 21 CO 0.05 0.56 -0.36 0.82 0.00 0.00 0.00 179.25 180.32 1kn6 h ILE 22 N 0.00 0.00 -1.08 0.00 2.04 0.77 -0.92 117.51 118.32 1kn6 h ILE 22 Ca -0.00 -0.25 0.29 0.00 1.00 0.00 0.00 64.86 65.90 1kn6 h ILE 22 Cb 1.15 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.14 1kn6 h ILE 22 CO 0.06 0.00 0.71 0.00 0.00 0.00 0.00 178.15 178.92 1kn6 h ALA 23 N -1.28 2.39 -0.36 1.87 0.00 -1.64 0.63 119.26 120.87 1kn6 h ALA 23 Ca -0.10 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 1kn6 h ALA 23 Cb 0.78 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1kn6 h ALA 23 CO 0.17 -0.81 -0.36 0.93 0.00 0.00 0.00 179.25 179.18 1kn6 h GLU 24 N 0.31 0.82 0.00 0.00 5.08 -1.48 0.87 114.58 120.18 1kn6 h GLU 24 Ca 0.61 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1kn6 h GLU 24 Cb 1.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.96 1kn6 h GLU 24 CO -0.27 1.05 0.00 0.39 -1.00 0.00 0.00 179.01 179.17 1kn6 n GLU 25 N -4.06 0.00 -0.18 2.33 4.71 0.21 -4.17 120.64 119.48 1kn6 n GLU 25 Ca -0.02 0.00 -0.01 0.00 -0.01 0.00 0.00 57.16 57.12 1kn6 n GLU 25 Cb 0.52 -0.67 0.06 0.00 -1.01 0.00 0.00 31.44 30.34 1kn6 n GLU 25 CO 0.00 0.00 0.00 1.37 0.09 0.00 0.00 177.13 178.59 1kn6 h LEU 26 N 0.00 -0.43 0.00 -4.62 -0.00 -1.58 -3.46 115.31 105.22 1kn6 h LEU 26 Ca 0.00 0.16 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 1kn6 h LEU 26 Cb 0.00 0.31 0.00 0.00 -0.00 0.00 0.00 40.66 40.97 1kn6 h LEU 26 CO 0.00 -0.16 0.00 0.61 -0.00 0.00 0.00 178.44 178.89 1kn6 n GLY 27 N -1.38 0.86 1.82 0.17 0.00 -0.44 -4.90 105.19 101.32 1kn6 n GLY 27 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 1kn6 n GLY 27 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1kn6 n TYR 28 N 0.00 0.25 -3.98 1.61 4.02 0.29 -4.99 117.16 114.36 1kn6 n TYR 28 Ca 0.00 -1.23 -0.31 0.00 -0.01 0.00 0.00 57.90 56.36 1kn6 n TYR 28 Cb 0.00 -0.18 -0.15 0.00 -0.02 0.00 0.00 39.34 38.99 1kn6 n TYR 28 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1kn6 s ASP 29 N -2.43 4.63 -0.23 7.72 1.11 -1.19 -4.24 116.67 122.04 1kn6 s ASP 29 Ca 0.03 -2.23 -0.21 0.00 0.18 0.00 0.00 52.55 50.32 1kn6 s ASP 29 Cb -0.00 -1.55 -0.02 0.00 1.07 0.00 0.00 42.92 42.41 1kn6 s ASP 29 CO 0.02 -0.36 0.63 -0.22 1.18 0.00 0.00 175.17 176.42 1kn6 s LEU 30 N 0.80 4.10 -0.28 1.23 1.98 -1.26 -0.77 118.68 124.48 1kn6 s LEU 30 Ca 0.12 0.76 -0.01 0.00 -2.89 0.00 0.00 54.13 52.11 1kn6 s LEU 30 Cb -0.20 -2.87 0.13 0.00 0.66 0.00 0.00 46.19 43.91 1kn6 s LEU 30 CO -0.08 -0.33 0.29 -0.76 -1.89 0.00 0.00 176.35 173.58 1kn6 s LEU 31 N 2.23 -0.22 -0.46 -0.68 2.01 0.42 -4.82 118.68 117.15 1kn6 s LEU 31 Ca 0.27 -0.67 0.06 0.00 0.01 0.00 0.00 54.13 53.79 1kn6 s LEU 31 Cb -0.16 0.50 0.18 0.00 0.01 0.00 0.00 46.19 46.72 1kn6 s LEU 31 CO 0.09 -0.38 0.56 -0.83 1.01 0.00 0.00 176.35 176.80 1kn6 s GLY 32 N 2.36 -0.28 -0.31 -3.19 0.00 -1.26 -3.41 107.32 101.23 1kn6 s GLY 32 Ca 0.09 -1.16 0.02 0.00 0.00 0.00 0.00 44.72 43.68 1kn6 s GLY 32 CO -0.30 3.04 0.39 -0.86 0.00 0.00 0.00 173.10 175.36 1kn6 s GLN 33 N 0.68 0.46 -0.04 2.90 -2.07 -1.21 -3.77 119.66 116.61 1kn6 s GLN 33 Ca 0.29 -0.14 0.12 0.00 -1.82 0.00 0.00 55.36 53.81 1kn6 s GLN 33 Cb -0.00 -0.44 -0.18 0.00 -1.09 0.00 0.00 33.01 31.30 1kn6 s GLN 33 CO -0.10 -1.07 0.22 -0.89 -1.32 0.00 0.00 175.29 172.12 1kn6 n ILE 34 N 5.08 0.18 0.00 3.63 -0.00 -1.26 -5.01 119.36 121.99 1kn6 n ILE 34 Ca 0.03 -0.33 0.00 0.00 -0.00 0.00 0.00 62.75 62.45 1kn6 n ILE 34 Cb 0.48 0.01 0.00 0.00 -0.00 0.00 0.00 39.64 40.13 1kn6 n ILE 34 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1kn6 n GLY 35 N 1.92 1.85 0.35 7.39 0.00 -1.26 -4.73 105.19 110.71 1kn6 n GLY 35 Ca -0.06 -0.32 0.17 0.00 0.00 0.00 0.00 46.02 45.81 1kn6 n GLY 35 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1kn6 h SER 36 N 0.00 0.00 0.00 1.61 0.02 -2.04 -2.55 113.55 110.59 1kn6 h SER 36 Ca 0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1kn6 h SER 36 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1kn6 h SER 36 CO 0.00 0.00 -1.43 0.00 -1.14 0.00 0.00 176.83 174.26 1kn6 n LEU 37 N -4.10 0.00 -2.11 5.07 -0.00 -1.26 -4.99 117.00 109.61 1kn6 n LEU 37 Ca 0.04 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.95 1kn6 n LEU 37 Cb 0.42 0.10 -0.02 0.00 -0.00 0.00 0.00 43.42 43.93 1kn6 n LEU 37 CO 0.32 0.10 -0.13 -0.62 -0.00 0.00 0.00 177.39 177.06 1kn6 n GLU 38 N -2.06 -2.00 -2.67 1.47 -0.58 -0.96 -4.72 120.64 109.12 1kn6 n GLU 38 Ca -0.07 0.55 -0.04 0.00 -0.42 0.00 0.00 57.16 57.17 1kn6 n GLU 38 Cb 0.51 -5.02 0.08 0.00 -0.57 0.00 0.00 31.44 26.44 1kn6 n GLU 38 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1kn6 n ASN 39 N -1.30 -1.31 -3.27 1.62 2.04 -1.26 -3.88 115.26 107.90 1kn6 n ASN 39 Ca -0.12 -1.82 -0.06 0.00 -0.44 0.00 0.00 54.58 52.14 1kn6 n ASN 39 Cb 0.52 0.79 -0.04 0.00 -2.53 0.00 0.00 39.78 38.52 1kn6 n ASN 39 CO 0.00 0.00 0.00 -2.28 -0.44 0.00 0.00 177.26 174.54 1kn6 s HIS 40 N 0.11 -1.18 -0.08 -2.53 2.46 -1.25 -2.60 115.29 110.23 1kn6 s HIS 40 Ca 0.25 0.20 0.02 0.00 0.47 0.00 0.00 55.06 56.00 1kn6 s HIS 40 Cb 0.22 -0.02 -0.02 0.00 -0.13 0.00 0.00 32.58 32.63 1kn6 s HIS 40 CO -0.10 -1.05 -0.12 0.71 -2.47 0.00 0.00 174.74 171.71 1kn6 s TYR 41 N 2.20 2.79 0.01 3.88 1.51 0.36 -3.33 117.35 124.78 1kn6 s TYR 41 Ca 0.13 -0.24 0.01 0.00 -1.01 0.00 0.00 57.07 55.95 1kn6 s TYR 41 Cb -0.11 -1.71 -0.01 0.00 -0.11 0.00 0.00 41.96 40.02 1kn6 s TYR 41 CO -0.19 0.11 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.17 1kn6 s LEU 42 N -0.43 2.11 0.53 -1.29 0.20 -1.22 0.14 118.68 118.71 1kn6 s LEU 42 Ca 0.05 -0.24 0.07 0.00 0.69 0.00 0.00 54.13 54.70 1kn6 s LEU 42 Cb -0.12 -0.04 0.05 0.00 -0.43 0.00 0.00 46.19 45.66 1kn6 s LEU 42 CO 0.02 -0.10 0.73 -0.36 -0.29 0.00 0.00 176.35 176.35 1kn6 s PHE 43 N -0.63 2.18 -0.25 5.38 0.40 0.16 0.16 117.98 125.37 1kn6 s PHE 43 Ca -0.06 -0.44 -0.02 0.00 -0.60 0.00 0.00 56.93 55.81 1kn6 s PHE 43 Cb -0.05 -2.45 0.13 0.00 0.51 0.00 0.00 43.02 41.17 1kn6 s PHE 43 CO -0.00 -0.90 0.37 0.15 0.70 0.00 0.00 175.22 175.54 1kn6 s LYS 44 N -4.62 0.35 0.00 0.44 3.01 0.05 -2.90 119.74 116.06 1kn6 s LYS 44 Ca 0.59 0.48 0.00 0.00 -1.01 0.00 0.00 55.97 56.03 1kn6 s LYS 44 Cb -0.08 -0.50 0.00 0.00 -1.01 0.00 0.00 37.83 36.24 1kn6 s LYS 44 CO 0.37 -0.68 0.00 1.58 0.51 0.00 0.00 175.35 177.13 1kn6 n HIS 45 N 5.36 0.00 -3.78 3.18 -0.00 -1.26 -3.16 115.22 115.57 1kn6 n HIS 45 Ca -0.03 0.00 -0.26 0.00 0.46 0.00 0.00 57.72 57.88 1kn6 n HIS 45 Cb 0.50 0.00 0.04 0.00 -0.12 0.00 0.00 29.99 30.41 1kn6 n HIS 45 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1kn6 n LYS 46 N 0.00 -6.08 -1.75 1.57 4.76 -1.26 -4.77 118.16 110.63 1kn6 n LYS 46 Ca 0.00 0.67 -0.34 0.00 -2.87 0.00 0.00 58.31 55.77 1kn6 n LYS 46 Cb 0.00 -5.55 -0.03 0.00 -1.84 0.00 0.00 35.03 27.61 1kn6 n LYS 46 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1kn6 n SER 47 N -2.94 7.42 0.00 4.39 2.88 -1.26 -3.94 113.62 120.17 1kn6 n SER 47 Ca -0.05 -3.12 0.00 0.00 -1.33 0.00 0.00 58.87 54.37 1kn6 n SER 47 Cb 0.57 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.70 1kn6 n SER 47 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1kn6 n HIS 48 N 1.52 0.00 -1.44 0.66 -0.00 -1.26 -5.17 115.22 109.54 1kn6 n HIS 48 Ca 0.58 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 58.00 1kn6 n HIS 48 Cb 0.38 0.00 0.19 0.00 -0.00 0.00 0.00 29.99 30.56 1kn6 n HIS 48 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.34 174.20 1kn6 s PRO 49 N 0.00 0.12 -0.15 -1.40 0.02 -1.25 -5.03 135.00 127.31 1kn6 s PRO 49 Ca 0.00 0.02 0.02 0.00 0.02 0.00 0.00 61.00 61.06 1kn6 s PRO 49 Cb 0.00 -1.75 -0.11 0.00 0.02 0.00 0.00 34.50 32.67 1kn6 s PRO 49 CO 0.00 -2.83 -0.11 0.54 -0.33 0.00 0.00 177.00 174.27 1kn6 n ARG 50 N -4.16 0.61 0.00 5.54 1.74 -1.26 -5.00 116.66 114.14 1kn6 n ARG 50 Ca 0.11 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 1kn6 n ARG 50 Cb 0.59 -1.30 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 1kn6 n ARG 50 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1kn6 n ARG 51 N -2.87 0.00 -3.19 5.56 1.74 -1.26 -4.77 116.66 111.86 1kn6 n ARG 51 Ca -0.26 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.64 1kn6 n ARG 51 Cb 0.80 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 32.29 1kn6 n ARG 51 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1kn6 n SER 52 N 0.00 -5.41 -4.61 0.55 7.64 -1.25 -4.84 113.62 105.70 1kn6 n SER 52 Ca 0.00 -0.36 -0.37 0.00 1.01 0.00 0.00 58.87 59.15 1kn6 n SER 52 Cb 0.00 -4.10 -0.11 0.00 -1.01 0.00 0.00 64.21 59.00 1kn6 n SER 52 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1kn6 s ARG 53 N -5.84 3.97 -0.35 1.43 3.00 -1.26 -5.02 118.95 114.87 1kn6 s ARG 53 Ca 0.39 -0.32 -0.40 0.00 -1.00 0.00 0.00 55.73 54.40 1kn6 s ARG 53 Cb -0.17 -3.56 -0.15 0.00 0.00 0.00 0.00 34.95 31.06 1kn6 s ARG 53 CO 0.48 -0.07 1.93 2.89 0.00 0.00 0.00 175.30 180.54 1kn6 n ARG 54 N 4.68 0.86 0.05 5.12 1.85 -1.26 -4.30 116.66 123.67 1kn6 n ARG 54 Ca -0.15 0.29 0.00 0.00 -1.00 0.00 0.00 57.85 56.99 1kn6 n ARG 54 Cb 0.52 -2.07 0.00 0.00 -1.05 0.00 0.00 32.46 29.86 1kn6 n ARG 54 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1kn6 n SER 55 N 6.96 -0.92 -4.65 2.89 7.64 -1.26 -5.11 113.62 119.18 1kn6 n SER 55 Ca 0.36 0.57 -0.43 0.00 1.01 0.00 0.00 58.87 60.38 1kn6 n SER 55 Cb 0.12 1.22 -0.02 0.00 -1.01 0.00 0.00 64.21 64.52 1kn6 n SER 55 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1kn6 s ALA 56 N -2.00 3.49 0.21 -0.43 0.00 -1.26 -4.69 121.76 117.07 1kn6 s ALA 56 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1kn6 s ALA 56 Cb 0.00 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.38 1kn6 s ALA 56 CO 0.00 -1.55 0.00 1.47 0.00 0.00 0.00 175.76 175.68 1kn6 n LEU 57 N 7.45 -1.37 -0.14 0.00 -0.00 -1.26 -4.90 117.00 116.78 1kn6 n LEU 57 Ca 0.16 0.39 0.28 0.00 -0.00 0.00 0.00 56.01 56.84 1kn6 n LEU 57 Cb 0.45 1.46 0.68 0.00 -0.00 0.00 0.00 43.42 46.01 1kn6 n LEU 57 CO 0.61 -0.31 1.26 1.12 -0.00 0.00 0.00 177.39 180.07 1kn6 h HIS 58 N 0.00 0.00 0.00 1.47 2.07 -1.92 0.89 115.15 117.66 1kn6 h HIS 58 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1kn6 h HIS 58 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1kn6 h HIS 58 CO 0.00 0.00 0.00 1.51 -3.07 0.00 0.00 177.93 176.37 1kn6 n ILE 59 N -3.76 1.23 -0.22 6.12 0.00 -1.26 -1.46 119.36 120.00 1kn6 n ILE 59 Ca 0.18 0.47 -0.02 0.00 0.00 0.00 0.00 62.75 63.38 1kn6 n ILE 59 Cb 1.09 -1.41 0.20 0.00 0.00 0.00 0.00 39.64 39.52 1kn6 n ILE 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1kn6 n THR 60 N -1.93 1.91 0.03 9.51 -1.04 0.31 -3.12 114.28 119.95 1kn6 n THR 60 Ca 0.01 -0.96 -0.01 0.00 -2.04 0.00 0.00 64.05 61.05 1kn6 n THR 60 Cb 0.10 -0.47 -0.00 0.00 -1.82 0.00 0.00 70.33 68.13 1kn6 n THR 60 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1kn6 n LYS 61 N 0.09 0.06 0.18 -2.82 0.00 -0.54 -4.69 118.16 110.44 1kn6 n LYS 61 Ca 0.23 0.02 0.12 0.00 -0.00 0.00 0.00 58.31 58.69 1kn6 n LYS 61 Cb 0.96 -0.58 0.12 0.00 -0.00 0.00 0.00 35.03 35.53 1kn6 n LYS 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1kn6 h ARG 62 N -0.12 0.00 0.57 -1.58 2.47 -1.75 -2.58 114.38 111.40 1kn6 h ARG 62 Ca 0.00 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 1kn6 h ARG 62 Cb 0.12 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.44 1kn6 h ARG 62 CO 0.00 0.00 -0.27 1.25 0.56 0.00 0.00 179.97 181.51 1kn6 h LEU 63 N 0.00 -0.65 -0.43 3.04 7.12 -1.84 0.55 115.31 123.10 1kn6 h LEU 63 Ca 0.00 -0.03 -0.17 0.00 0.13 0.00 0.00 57.88 57.81 1kn6 h LEU 63 Cb 1.00 0.17 -0.00 0.00 -0.53 0.00 0.00 40.66 41.29 1kn6 h LEU 63 CO 0.00 -0.27 -0.56 0.77 -0.13 0.00 0.00 178.44 178.24 1kn6 h SER 64 N -1.10 0.74 -0.53 1.25 4.64 -1.79 0.88 113.55 117.65 1kn6 h SER 64 Ca -0.08 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1kn6 h SER 64 Cb 0.64 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.49 1kn6 h SER 64 CO 0.13 1.15 0.33 -0.78 -0.87 0.00 0.00 176.83 176.79 1kn6 h ASP 65 N 0.51 0.62 1.60 4.97 1.82 -1.49 -1.98 116.42 122.45 1kn6 h ASP 65 Ca 0.01 -0.03 -0.07 0.00 -0.39 0.00 0.00 57.03 56.54 1kn6 h ASP 65 Cb 1.13 -0.15 -0.01 0.00 0.68 0.00 0.00 39.33 40.98 1kn6 h ASP 65 CO 0.11 0.47 -0.41 0.44 -1.61 0.00 0.00 179.24 178.24 1kn6 h ASP 66 N 0.71 0.00 0.00 2.28 5.19 0.22 -3.23 116.42 121.59 1kn6 h ASP 66 Ca 0.19 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 1kn6 h ASP 66 Cb -0.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.46 1kn6 h ASP 66 CO -0.04 0.34 0.20 -0.78 -3.12 0.00 0.00 179.24 175.84 1kn6 h ASP 67 N 0.00 0.00 -0.89 6.45 3.58 0.16 -2.43 116.42 123.29 1kn6 h ASP 67 Ca -0.01 0.00 0.26 0.00 0.42 0.00 0.00 57.03 57.70 1kn6 h ASP 67 Cb 1.27 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.28 1kn6 h ASP 67 CO 0.04 0.00 0.90 0.08 -2.88 0.00 0.00 179.24 177.39 1kn6 h ARG 68 N 0.00 0.00 -0.54 0.28 0.11 -1.56 -0.76 114.38 111.91 1kn6 h ARG 68 Ca 0.00 0.00 0.08 0.00 0.10 0.00 0.00 59.98 60.16 1kn6 h ARG 68 Cb 0.40 0.00 -0.10 0.00 1.11 0.00 0.00 29.97 31.38 1kn6 h ARG 68 CO 0.00 0.00 -0.45 -0.39 0.10 0.00 0.00 179.97 179.23 1kn6 h VAL 69 N 0.00 0.08 0.00 0.08 -1.51 -1.75 -3.45 116.25 109.71 1kn6 h VAL 69 Ca 0.42 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.89 1kn6 h VAL 69 Cb 2.23 0.08 0.00 0.00 -2.13 0.00 0.00 31.29 31.47 1kn6 h VAL 69 CO -0.00 0.00 0.00 0.41 -1.23 0.00 0.00 177.57 176.75 1kn6 n THR 70 N -5.40 0.00 -3.75 7.19 -1.04 -0.29 -4.91 114.28 106.08 1kn6 n THR 70 Ca 0.01 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.88 1kn6 n THR 70 Cb 0.35 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.77 1kn6 n THR 70 CO 0.00 0.00 0.00 -1.66 -0.64 0.00 0.00 175.07 172.77 1kn6 s TRP 71 N -0.23 -0.20 -0.17 -1.42 1.48 -1.23 -5.07 118.94 112.10 1kn6 s TRP 71 Ca 0.00 0.30 -0.05 0.00 -1.06 0.00 0.00 56.10 55.29 1kn6 s TRP 71 Cb 0.00 0.11 0.08 0.00 -1.16 0.00 0.00 33.47 32.51 1kn6 s TRP 71 CO 0.00 -0.40 0.34 0.00 -4.06 0.00 0.00 176.95 172.82 1kn6 s ALA 72 N -1.33 -0.84 -0.02 2.67 0.00 -1.26 -3.22 121.76 117.76 1kn6 s ALA 72 Ca -0.13 1.12 0.01 0.00 0.00 0.00 0.00 51.96 52.95 1kn6 s ALA 72 Cb -0.05 -1.24 0.01 0.00 0.00 0.00 0.00 23.12 21.85 1kn6 s ALA 72 CO 0.04 -0.79 -0.01 -2.00 0.00 0.00 0.00 175.76 173.00 1kn6 s GLU 73 N 2.51 0.27 0.30 0.00 2.56 -1.19 -4.98 118.70 118.18 1kn6 s GLU 73 Ca 0.02 -0.01 -0.09 0.00 0.00 0.00 0.00 54.97 54.89 1kn6 s GLU 73 Cb -0.13 -0.36 -0.07 0.00 2.00 0.00 0.00 34.13 35.58 1kn6 s GLU 73 CO -0.11 -0.04 0.62 -0.65 -0.56 0.00 0.00 175.26 174.52 1kn6 s GLN 74 N 0.49 3.76 -0.06 4.30 -0.21 -1.26 -2.83 119.66 123.85 1kn6 s GLN 74 Ca -0.05 0.27 -0.01 0.00 0.02 0.00 0.00 55.36 55.59 1kn6 s GLN 74 Cb -0.08 -2.56 0.03 0.00 1.00 0.00 0.00 33.01 31.40 1kn6 s GLN 74 CO -0.01 0.18 0.02 -0.65 -2.12 0.00 0.00 175.29 172.72 1kn6 s GLN 75 N -3.32 0.33 0.00 2.91 -0.21 -0.98 -4.94 119.66 113.45 1kn6 s GLN 75 Ca 0.48 0.21 0.00 0.00 0.02 0.00 0.00 55.36 56.07 1kn6 s GLN 75 Cb -0.11 -0.77 0.00 0.00 1.00 0.00 0.00 33.01 33.13 1kn6 s GLN 75 CO 0.26 -0.30 0.28 0.66 -2.12 0.00 0.00 175.29 174.07