#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 -0.02 -2.13 3.14 -1.26 -1.42 118.33 116.65 1kn6 n VAL 5 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1kn6 n VAL 5 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1kn6 n VAL 5 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1kn6 n ASN 6 N -0.83 0.00 -3.61 6.55 5.15 -1.26 -4.56 115.26 116.70 1kn6 n ASN 6 Ca 0.00 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.87 1kn6 n ASN 6 Cb 0.00 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.21 1kn6 n ASN 6 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 1kn6 s GLU 7 N 0.00 1.74 -0.44 1.20 1.03 -1.11 -4.80 118.70 116.32 1kn6 s GLU 7 Ca 0.00 -1.49 -0.22 0.00 0.03 0.00 0.00 54.97 53.29 1kn6 s GLU 7 Cb 0.00 0.46 0.02 0.00 -0.80 0.00 0.00 34.13 33.82 1kn6 s GLU 7 CO 0.00 -0.73 0.72 -0.46 -1.33 0.00 0.00 175.26 173.46 1kn6 s TRP 8 N -3.48 3.03 -0.16 4.83 -0.00 -0.95 -2.49 118.94 119.72 1kn6 s TRP 8 Ca 0.26 0.06 -0.06 0.00 -0.00 0.00 0.00 56.10 56.36 1kn6 s TRP 8 Cb -0.01 -3.52 -0.04 0.00 -0.00 0.00 0.00 33.47 29.91 1kn6 s TRP 8 CO 0.14 -0.93 0.05 0.00 -0.00 0.00 0.00 176.95 176.20 1kn6 s ALA 9 N 3.08 3.40 0.04 5.86 0.00 -1.05 -2.51 121.76 130.58 1kn6 s ALA 9 Ca 0.27 -0.75 -0.15 0.00 0.00 0.00 0.00 51.96 51.32 1kn6 s ALA 9 Cb -0.13 -1.81 0.03 0.00 0.00 0.00 0.00 23.12 21.20 1kn6 s ALA 9 CO 0.21 0.30 0.34 0.00 0.00 0.00 0.00 175.76 176.61 1kn6 s ALA 10 N -0.00 -0.79 -0.33 0.00 0.00 -0.92 -3.35 121.76 116.37 1kn6 s ALA 10 Ca 0.05 0.11 -0.12 0.00 0.00 0.00 0.00 51.96 52.00 1kn6 s ALA 10 Cb -0.12 0.33 -0.02 0.00 0.00 0.00 0.00 23.12 23.31 1kn6 s ALA 10 CO 0.01 -0.43 0.21 -1.21 0.00 0.00 0.00 175.76 174.35 1kn6 s GLU 11 N -2.52 3.46 -0.18 0.00 2.02 -1.19 0.40 118.70 120.70 1kn6 s GLU 11 Ca -0.05 -0.66 -0.00 0.00 0.02 0.00 0.00 54.97 54.28 1kn6 s GLU 11 Cb -0.01 -3.73 0.04 0.00 0.10 0.00 0.00 34.13 30.53 1kn6 s GLU 11 CO -0.03 -0.43 -0.06 -1.50 0.02 0.00 0.00 175.26 173.25 1kn6 s ILE 12 N 1.69 1.26 0.08 -1.63 -1.16 0.16 -3.50 121.20 118.10 1kn6 s ILE 12 Ca 0.06 -0.76 -0.23 0.00 -0.51 0.00 0.00 60.65 59.21 1kn6 s ILE 12 Cb -0.17 -1.42 -0.14 0.00 0.61 0.00 0.00 42.46 41.34 1kn6 s ILE 12 CO 0.09 0.12 1.67 -0.65 -2.81 0.00 0.00 174.94 173.36 1kn6 h PRO 13 N 8.07 0.07 0.00 3.50 0.11 -1.85 -3.37 132.00 138.53 1kn6 h PRO 13 Ca -0.25 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1kn6 h PRO 13 Cb 1.11 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1kn6 h PRO 13 CO 0.42 0.13 -0.02 0.41 -0.21 0.00 0.00 178.00 178.73 1kn6 n GLY 14 N -0.87 0.96 0.87 -0.55 0.00 -1.26 -4.78 105.19 99.56 1kn6 n GLY 14 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 0.60 0.98 0.20 -0.02 0.00 -1.26 -4.00 105.19 101.70 1kn6 n GLY 15 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 0.82 -0.41 -0.93 1.61 4.20 -1.86 1.24 115.11 119.77 1kn6 h GLN 16 Ca 0.00 0.03 0.16 0.00 0.06 0.00 0.00 58.65 58.90 1kn6 h GLN 16 Cb 0.46 0.09 -0.08 0.00 0.30 0.00 0.00 27.48 28.25 1kn6 h GLN 16 CO 0.00 -0.13 0.60 0.93 -0.67 0.00 0.00 178.83 179.56 1kn6 h GLU 17 N -0.69 0.68 0.03 1.46 5.08 -2.00 0.20 114.58 119.34 1kn6 h GLU 17 Ca -0.04 -0.04 -0.23 0.00 -1.00 0.00 0.00 59.36 58.05 1kn6 h GLU 17 Cb 0.48 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1kn6 h GLU 17 CO 0.07 0.45 -1.08 0.00 -1.00 0.00 0.00 179.01 177.45 1kn6 h ALA 18 N 1.60 0.29 -0.65 3.43 0.00 -1.81 -3.17 119.26 118.95 1kn6 h ALA 18 Ca 0.49 -0.91 0.12 0.00 0.00 0.00 0.00 54.91 54.60 1kn6 h ALA 18 Cb 0.81 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.41 1kn6 h ALA 18 CO -0.25 1.18 0.20 0.00 0.00 0.00 0.00 179.25 180.39 1kn6 h ALA 19 N 0.89 0.84 0.00 0.00 0.00 0.48 0.43 119.26 121.90 1kn6 h ALA 19 Ca -0.05 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1kn6 h ALA 19 Cb 1.83 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.73 1kn6 h ALA 19 CO 0.15 -0.26 -0.46 1.03 0.00 0.00 0.00 179.25 179.71 1kn6 h SER 20 N 0.34 0.00 0.83 0.00 0.87 -1.48 -2.87 113.55 111.25 1kn6 h SER 20 Ca 0.35 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.80 1kn6 h SER 20 Cb 0.51 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.45 1kn6 h SER 20 CO -0.39 0.46 -0.50 0.00 -0.53 0.00 0.00 176.83 175.86 1kn6 h ALA 21 N 1.54 0.92 0.48 6.23 0.00 -0.32 -3.15 119.26 124.96 1kn6 h ALA 21 Ca -0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1kn6 h ALA 21 Cb 0.95 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1kn6 h ALA 21 CO 0.06 0.63 -0.23 0.82 0.00 0.00 0.00 179.25 180.53 1kn6 h ILE 22 N 0.00 0.12 -1.14 0.00 2.04 -0.21 -1.39 117.51 116.93 1kn6 h ILE 22 Ca -0.01 -0.55 0.33 0.00 1.00 0.00 0.00 64.86 65.64 1kn6 h ILE 22 Cb 1.06 0.19 -0.11 0.00 -0.74 0.00 0.00 36.82 37.22 1kn6 h ILE 22 CO 0.07 0.03 0.73 0.00 0.00 0.00 0.00 178.15 178.98 1kn6 h ALA 23 N -1.04 2.42 0.01 1.87 0.00 -1.63 1.02 119.26 121.91 1kn6 h ALA 23 Ca -0.07 0.09 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 1kn6 h ALA 23 Cb 0.53 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1kn6 h ALA 23 CO 0.11 -0.92 -0.90 0.93 0.00 0.00 0.00 179.25 178.47 1kn6 h GLU 24 N 0.27 0.07 0.00 0.00 5.08 -1.52 0.14 114.58 118.62 1kn6 h GLU 24 Ca 0.68 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.95 1kn6 h GLU 24 Cb 1.92 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 31.20 1kn6 h GLU 24 CO -0.35 0.92 -0.01 0.93 -1.00 0.00 0.00 179.01 179.49 1kn6 h GLU 25 N 0.04 0.00 0.40 2.33 4.39 0.19 -3.40 114.58 118.53 1kn6 h GLU 25 Ca -0.03 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 1kn6 h GLU 25 Cb 1.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.21 1kn6 h GLU 25 CO 0.12 0.79 -0.19 -0.07 -1.16 0.00 0.00 179.01 178.50 1kn6 h LEU 26 N -1.00 -0.46 0.00 1.33 3.38 -0.07 -3.49 115.31 115.01 1kn6 h LEU 26 Ca -0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1kn6 h LEU 26 Cb 0.80 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1kn6 h LEU 26 CO -0.00 -0.18 0.00 0.61 0.09 0.00 0.00 178.44 178.95 1kn6 n GLY 27 N -0.07 0.14 3.35 0.83 0.00 -0.73 -4.85 105.19 103.86 1kn6 n GLY 27 Ca -0.07 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.76 1kn6 n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1kn6 s TYR 28 N -0.20 1.62 -0.43 1.61 2.02 0.41 -4.75 117.35 117.63 1kn6 s TYR 28 Ca 0.00 -1.34 -0.12 0.00 -0.37 0.00 0.00 57.07 55.24 1kn6 s TYR 28 Cb 0.00 -0.89 0.07 0.00 -0.40 0.00 0.00 41.96 40.73 1kn6 s TYR 28 CO 0.00 -0.48 0.30 -0.51 -1.57 0.00 0.00 175.55 173.29 1kn6 s ASP 29 N -3.39 5.85 -0.13 2.29 1.01 -1.18 -4.13 116.67 116.99 1kn6 s ASP 29 Ca 0.35 -1.33 -0.22 0.00 0.71 0.00 0.00 52.55 52.07 1kn6 s ASP 29 Cb 0.05 -2.07 -0.03 0.00 1.01 0.00 0.00 42.92 41.88 1kn6 s ASP 29 CO 0.17 -0.54 0.64 -0.22 0.21 0.00 0.00 175.17 175.42 1kn6 s LEU 30 N 1.53 4.23 -0.28 1.23 1.98 -1.26 -1.14 118.68 124.98 1kn6 s LEU 30 Ca 0.03 0.98 -0.00 0.00 -2.89 0.00 0.00 54.13 52.25 1kn6 s LEU 30 Cb -0.23 -2.94 0.14 0.00 0.66 0.00 0.00 46.19 43.82 1kn6 s LEU 30 CO 0.05 -0.17 0.31 -0.76 -1.89 0.00 0.00 176.35 173.89 1kn6 s LEU 31 N 1.29 -0.34 -0.58 -0.68 2.01 0.14 -4.88 118.68 115.64 1kn6 s LEU 31 Ca 0.32 -0.63 0.04 0.00 0.01 0.00 0.00 54.13 53.87 1kn6 s LEU 31 Cb -0.16 0.62 0.15 0.00 0.01 0.00 0.00 46.19 46.81 1kn6 s LEU 31 CO 0.13 -0.38 0.35 -0.83 1.01 0.00 0.00 176.35 176.64 1kn6 s GLY 32 N 2.40 2.47 -0.31 -3.19 0.00 -1.26 -3.38 107.32 104.05 1kn6 s GLY 32 Ca 0.09 -3.37 0.02 0.00 0.00 0.00 0.00 44.72 41.47 1kn6 s GLY 32 CO -0.31 1.17 0.39 1.20 0.00 0.00 0.00 173.10 175.56 1kn6 s GLN 33 N -0.65 0.47 0.00 2.90 -1.52 -1.24 -4.64 119.66 114.98 1kn6 s GLN 33 Ca 0.21 -0.16 0.00 0.00 -1.95 0.00 0.00 55.36 53.46 1kn6 s GLN 33 Cb -0.16 -0.44 0.00 0.00 -0.22 0.00 0.00 33.01 32.20 1kn6 s GLN 33 CO -0.08 -1.08 0.00 0.44 -0.25 0.00 0.00 175.29 174.32 1kn6 n ILE 34 N 5.05 0.00 0.00 1.08 -0.00 -1.26 -5.11 119.36 119.12 1kn6 n ILE 34 Ca 0.03 0.44 0.00 0.00 -0.00 0.00 0.00 62.75 63.22 1kn6 n ILE 34 Cb 0.48 -1.43 0.00 0.00 -0.00 0.00 0.00 39.64 38.69 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 1.72 0.97 0.00 3.28 0.00 -1.26 -5.02 105.19 104.88 1kn6 n GLY 35 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1kn6 n GLY 35 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1kn6 n SER 36 N 0.00 0.00 -0.00 1.61 2.88 -1.26 -4.90 113.62 111.95 1kn6 n SER 36 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 1kn6 n SER 36 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1kn6 n SER 36 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1kn6 n LEU 37 N 0.00 0.04 -0.49 2.46 -0.00 -1.26 -5.08 117.00 112.68 1kn6 n LEU 37 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 1kn6 n LEU 37 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1kn6 n LEU 37 CO 0.00 0.01 -0.00 -0.62 -0.00 0.00 0.00 177.39 176.78 1kn6 n GLU 38 N -1.44 -0.00 0.00 1.47 1.02 -1.26 -4.59 120.64 115.83 1kn6 n GLU 38 Ca -0.00 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1kn6 n GLU 38 Cb 0.07 -0.01 0.00 0.00 -0.02 0.00 0.00 31.44 31.48 1kn6 n GLU 38 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1kn6 n ASN 39 N 1.46 0.00 -4.74 1.62 0.23 -1.26 -4.82 115.26 107.75 1kn6 n ASN 39 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.63 1kn6 n ASN 39 Cb 0.00 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.68 1kn6 n ASN 39 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1kn6 s HIS 40 N 0.00 2.81 -0.08 -2.53 2.46 -1.26 0.35 115.29 117.04 1kn6 s HIS 40 Ca 0.00 0.61 -0.07 0.00 0.47 0.00 0.00 55.06 56.07 1kn6 s HIS 40 Cb 0.00 -4.10 0.03 0.00 -0.13 0.00 0.00 32.58 28.38 1kn6 s HIS 40 CO 0.00 -3.89 0.22 0.71 -2.47 0.00 0.00 174.74 169.31 1kn6 s TYR 41 N 0.46 -0.25 0.00 3.88 1.51 0.16 -3.65 117.35 119.47 1kn6 s TYR 41 Ca 0.68 0.60 -0.07 0.00 -1.01 0.00 0.00 57.07 57.27 1kn6 s TYR 41 Cb -0.49 0.07 0.00 0.00 -0.11 0.00 0.00 41.96 41.43 1kn6 s TYR 41 CO 0.42 -0.14 0.14 -0.48 -1.11 0.00 0.00 175.55 174.38 1kn6 s LEU 42 N 0.35 1.55 0.10 -1.29 -0.00 -1.22 -2.17 118.68 116.01 1kn6 s LEU 42 Ca -0.02 -0.20 0.05 0.00 -0.00 0.00 0.00 54.13 53.96 1kn6 s LEU 42 Cb -0.03 0.67 -0.04 0.00 -0.00 0.00 0.00 46.19 46.79 1kn6 s LEU 42 CO -0.01 -0.37 0.00 -0.36 -0.00 0.00 0.00 176.35 175.61 1kn6 s PHE 43 N -1.36 2.98 -0.25 3.48 0.08 -1.04 0.24 117.98 122.10 1kn6 s PHE 43 Ca -0.15 -0.04 -0.02 0.00 0.12 0.00 0.00 56.93 56.85 1kn6 s PHE 43 Cb -0.08 -1.52 0.12 0.00 -0.57 0.00 0.00 43.02 40.98 1kn6 s PHE 43 CO 0.02 0.48 0.31 0.15 -0.10 0.00 0.00 175.22 176.08 1kn6 s LYS 44 N -2.39 0.30 0.00 0.44 3.01 -0.29 -2.24 119.74 118.57 1kn6 s LYS 44 Ca 0.26 0.21 0.00 0.00 -1.01 0.00 0.00 55.97 55.43 1kn6 s LYS 44 Cb -0.11 -0.75 0.00 0.00 -1.01 0.00 0.00 37.83 35.96 1kn6 s LYS 44 CO 0.18 -0.79 0.00 1.58 0.51 0.00 0.00 175.35 176.84 1kn6 n HIS 45 N 5.33 0.00 0.27 3.18 -0.00 -1.26 -3.12 115.22 119.62 1kn6 n HIS 45 Ca -0.03 0.00 0.15 0.00 0.46 0.00 0.00 57.72 58.29 1kn6 n HIS 45 Cb 0.49 0.00 0.72 0.00 -0.12 0.00 0.00 29.99 31.07 1kn6 n HIS 45 CO 0.00 0.00 0.00 0.87 0.46 0.00 0.00 176.34 177.67 1kn6 h LYS 46 N 0.00 0.00 -0.09 1.57 1.79 -1.90 -3.42 116.57 114.51 1kn6 h LYS 46 Ca 0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1kn6 h LYS 46 Cb 0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1kn6 h LYS 46 CO 0.00 0.00 -0.03 0.43 -1.08 0.00 0.00 179.45 178.77 1kn6 n SER 47 N -2.53 -4.57 0.00 0.86 7.64 -1.26 -4.70 113.62 109.05 1kn6 n SER 47 Ca -0.01 0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.92 1kn6 n SER 47 Cb 0.12 -2.23 0.00 0.00 -1.01 0.00 0.00 64.21 61.09 1kn6 n SER 47 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1kn6 n HIS 48 N -2.50 0.00 -1.85 1.43 -0.00 -1.26 -5.09 115.22 105.95 1kn6 n HIS 48 Ca -0.02 0.00 -0.22 0.00 -0.00 0.00 0.00 57.72 57.48 1kn6 n HIS 48 Cb 0.29 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 30.20 1kn6 n HIS 48 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 1kn6 s PRO 49 N 0.00 1.96 -0.09 -1.40 0.04 -1.26 -4.68 135.00 129.56 1kn6 s PRO 49 Ca 0.00 -0.58 0.15 0.00 0.04 0.00 0.00 61.00 60.61 1kn6 s PRO 49 Cb 0.00 -5.07 0.60 0.00 0.04 0.00 0.00 34.50 30.06 1kn6 s PRO 49 CO 0.00 -4.45 1.48 0.54 0.04 0.00 0.00 177.00 174.61 1kn6 n ARG 50 N 8.40 3.24 -4.13 4.56 3.00 -1.26 -4.92 116.66 125.55 1kn6 n ARG 50 Ca 0.43 -2.35 -0.33 0.00 -0.01 0.00 0.00 57.85 55.59 1kn6 n ARG 50 Cb 0.46 -1.78 -0.02 0.00 0.00 0.00 0.00 32.46 31.12 1kn6 n ARG 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1kn6 n ARG 51 N 0.90 -3.33 0.00 5.56 1.74 -1.16 -4.30 116.66 116.09 1kn6 n ARG 51 Ca 0.21 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.68 1kn6 n ARG 51 Cb 0.75 -4.94 0.00 0.00 -1.02 0.00 0.00 32.46 27.26 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 -2.76 0.00 -4.22 0.55 7.64 -0.51 -3.06 113.62 111.26 1kn6 n SER 52 Ca -0.04 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.55 1kn6 n SER 52 Cb 0.55 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.66 1kn6 n SER 52 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1kn6 n ARG 53 N 0.00 0.80 -2.51 1.43 5.12 -1.26 -4.90 116.66 115.34 1kn6 n ARG 53 Ca 0.00 -1.85 -0.41 0.00 -1.93 0.00 0.00 57.85 53.67 1kn6 n ARG 53 Cb 0.00 -3.44 -0.04 0.00 -1.16 0.00 0.00 32.46 27.82 1kn6 n ARG 53 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 1kn6 s ARG 54 N 7.00 4.64 0.00 5.56 1.70 -1.26 -4.82 118.95 131.77 1kn6 s ARG 54 Ca 0.71 1.75 0.00 0.00 -0.47 0.00 0.00 55.73 57.72 1kn6 s ARG 54 Cb 0.03 -3.23 0.00 0.00 -0.57 0.00 0.00 34.95 31.18 1kn6 s ARG 54 CO 0.19 0.17 0.00 -1.13 -1.08 0.00 0.00 175.30 173.46 1kn6 n SER 55 N 1.71 0.00 -1.97 -2.89 3.41 -1.26 -5.15 113.62 107.46 1kn6 n SER 55 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1kn6 n SER 55 Cb 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1kn6 n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kn6 n ALA 56 N -1.48 -2.11 -0.09 7.33 0.00 -1.26 -5.07 120.51 117.83 1kn6 n ALA 56 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1kn6 n ALA 56 Cb 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.06 1kn6 n ALA 56 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1kn6 n LEU 57 N 1.78 0.00 0.19 0.00 -0.00 -1.26 -4.83 117.00 112.87 1kn6 n LEU 57 Ca 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 56.01 56.19 1kn6 n LEU 57 Cb 0.00 0.00 0.81 0.00 -0.00 0.00 0.00 43.42 44.23 1kn6 n LEU 57 CO 0.00 -0.46 1.16 1.12 -0.00 0.00 0.00 177.39 179.21 1kn6 h HIS 58 N 0.00 0.00 -0.05 1.47 2.07 -1.98 0.87 115.15 117.53 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 -3.53 0.06 -1.57 6.12 0.00 -1.26 -3.44 119.36 115.74 1kn6 n ILE 59 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 62.75 62.70 1kn6 n ILE 59 Cb 0.46 -0.08 0.20 0.00 0.00 0.00 0.00 39.64 40.21 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 -0.46 2.37 0.00 9.51 -1.04 0.30 -4.32 114.28 120.64 1kn6 n THR 60 Ca 0.10 -3.11 0.00 0.00 -2.04 0.00 0.00 64.05 59.00 1kn6 n THR 60 Cb 0.09 -0.32 0.00 0.00 -1.82 0.00 0.00 70.33 68.28 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 -1.10 0.00 0.00 -2.82 2.85 -1.22 -4.73 118.16 111.13 1kn6 n LYS 61 Ca 0.26 0.00 0.15 0.00 -1.05 0.00 0.00 58.31 57.67 1kn6 n LYS 61 Cb 0.84 0.00 0.76 0.00 -0.65 0.00 0.00 35.03 35.98 1kn6 n LYS 61 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1kn6 n ARG 62 N -2.02 0.56 0.10 -1.58 1.74 -1.26 -2.43 116.66 111.78 1kn6 n ARG 62 Ca 0.00 -0.04 -0.05 0.00 -0.77 0.00 0.00 57.85 56.99 1kn6 n ARG 62 Cb 0.00 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 29.92 1kn6 n ARG 62 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1kn6 h LEU 63 N 0.10 -0.27 -0.58 0.55 7.12 -1.86 0.20 115.31 120.58 1kn6 h LEU 63 Ca 0.00 0.01 -0.13 0.00 0.13 0.00 0.00 57.88 57.89 1kn6 h LEU 63 Cb 0.26 0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.44 1kn6 h LEU 63 CO 0.00 0.01 -0.22 0.77 -0.13 0.00 0.00 178.44 178.87 1kn6 h SER 64 N -0.72 0.92 -0.51 1.25 4.64 -1.82 1.15 113.55 118.46 1kn6 h SER 64 Ca -0.03 -0.34 0.06 0.00 -0.47 0.00 0.00 61.79 61.00 1kn6 h SER 64 Cb 0.24 -0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 62.03 1kn6 h SER 64 CO 0.05 1.10 0.23 0.44 -0.87 0.00 0.00 176.83 177.79 1kn6 h ASP 65 N 0.78 0.30 1.72 4.97 5.19 -1.59 -0.53 116.42 127.26 1kn6 h ASP 65 Ca 0.10 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 1kn6 h ASP 65 Cb 0.77 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.27 1kn6 h ASP 65 CO 0.06 0.21 -0.18 -0.78 -3.12 0.00 0.00 179.24 175.43 1kn6 h ASP 66 N 0.45 0.00 0.00 6.45 1.82 -0.66 -3.26 116.42 121.22 1kn6 h ASP 66 Ca 0.24 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.87 1kn6 h ASP 66 Cb 0.19 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.20 1kn6 h ASP 66 CO -0.20 0.00 0.10 -0.78 -1.61 0.00 0.00 179.24 176.75 1kn6 h ASP 67 N 0.00 0.00 -0.96 2.28 3.58 0.31 -2.56 116.42 119.07 1kn6 h ASP 67 Ca 0.00 0.00 0.28 0.00 0.42 0.00 0.00 57.03 57.73 1kn6 h ASP 67 Cb 0.95 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.96 1kn6 h ASP 67 CO 0.00 0.00 0.90 0.03 -2.88 0.00 0.00 179.24 177.29 1kn6 h ARG 68 N 0.00 0.00 -0.78 0.28 -0.00 -1.59 -1.18 114.38 111.12 1kn6 h ARG 68 Ca 0.00 0.00 0.10 0.00 -0.50 0.00 0.00 59.98 59.58 1kn6 h ARG 68 Cb 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 29.97 30.04 1kn6 h ARG 68 CO 0.00 0.00 -0.49 -0.39 0.00 0.00 0.00 179.97 179.09 1kn6 h VAL 69 N 0.00 0.03 0.00 2.04 -1.51 -1.78 -3.45 116.25 111.58 1kn6 h VAL 69 Ca 0.45 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.92 1kn6 h VAL 69 Cb 2.25 0.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.43 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 -5.36 0.00 -3.81 7.19 -1.04 -0.45 -4.73 114.28 106.08 1kn6 n THR 70 Ca 0.03 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.91 1kn6 n THR 70 Cb 0.33 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.75 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 -0.38 -0.09 -0.12 -1.42 1.48 -1.23 -5.07 118.94 112.11 1kn6 s TRP 71 Ca 0.00 0.09 -0.04 0.00 -1.06 0.00 0.00 56.10 55.09 1kn6 s TRP 71 Cb 0.00 0.04 0.06 0.00 -1.16 0.00 0.00 33.47 32.41 1kn6 s TRP 71 CO 0.00 -0.35 0.20 0.00 -4.06 0.00 0.00 176.95 172.74 1kn6 s ALA 72 N -1.40 -0.29 0.00 2.67 0.00 -1.26 -3.16 121.76 118.32 1kn6 s ALA 72 Ca -0.14 0.62 0.00 0.00 0.00 0.00 0.00 51.96 52.44 1kn6 s ALA 72 Cb -0.06 -0.97 -0.00 0.00 0.00 0.00 0.00 23.12 22.09 1kn6 s ALA 72 CO 0.03 -0.70 -0.01 -2.00 0.00 0.00 0.00 175.76 173.07 1kn6 s GLU 73 N 2.34 0.11 -0.05 0.00 2.12 -1.21 -5.01 118.70 117.00 1kn6 s GLU 73 Ca 0.03 -0.12 -0.16 0.00 0.36 0.00 0.00 54.97 55.08 1kn6 s GLU 73 Cb -0.13 -0.05 -0.05 0.00 0.26 0.00 0.00 34.13 34.16 1kn6 s GLU 73 CO -0.08 0.01 0.43 -0.65 -0.54 0.00 0.00 175.26 174.43 1kn6 s GLN 74 N -0.24 4.11 0.04 4.30 1.11 -1.26 -2.53 119.66 125.19 1kn6 s GLN 74 Ca -0.02 0.40 0.08 0.00 0.01 0.00 0.00 55.36 55.83 1kn6 s GLN 74 Cb -0.02 -3.32 -0.03 0.00 -1.01 0.00 0.00 33.01 28.64 1kn6 s GLN 74 CO -0.00 0.46 -0.23 1.14 0.01 0.00 0.00 175.29 176.67 1kn6 s GLN 75 N -0.33 1.55 0.00 2.91 -2.07 -1.04 -4.95 119.66 115.73 1kn6 s GLN 75 Ca 0.24 -1.00 0.00 0.00 -1.82 0.00 0.00 55.36 52.78 1kn6 s GLN 75 Cb -0.16 -1.69 0.00 0.00 -1.09 0.00 0.00 33.01 30.07 1kn6 s GLN 75 CO 0.11 0.43 0.26 0.66 -1.32 0.00 0.00 175.29 175.44