#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 0.54 0.00 -2.13 0.24 -1.26 -2.09 118.33 113.63 1kn6 n VAL 5 Ca 0.00 0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.48 1kn6 n VAL 5 Cb 0.00 -1.17 0.00 0.00 -1.47 0.00 0.00 33.84 31.20 1kn6 n VAL 5 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1kn6 n ASN 6 N -3.00 0.00 -3.34 -1.34 6.94 -1.26 -4.87 115.26 108.39 1kn6 n ASN 6 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 54.58 54.44 1kn6 n ASN 6 Cb 0.00 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.35 1kn6 n ASN 6 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1kn6 s GLU 7 N 0.00 0.38 -0.13 -3.83 2.02 0.36 -4.52 118.70 112.97 1kn6 s GLU 7 Ca 0.00 0.08 -0.21 0.00 0.02 0.00 0.00 54.97 54.85 1kn6 s GLU 7 Cb 0.00 -0.44 -0.03 0.00 0.10 0.00 0.00 34.13 33.75 1kn6 s GLU 7 CO 0.00 -1.00 0.63 -0.46 0.02 0.00 0.00 175.26 174.45 1kn6 s TRP 8 N 2.48 3.48 -0.05 1.61 -0.00 -0.98 0.16 118.94 125.63 1kn6 s TRP 8 Ca 0.10 1.04 0.03 0.00 -0.00 0.00 0.00 56.10 57.27 1kn6 s TRP 8 Cb -0.13 -2.76 0.00 0.00 -0.00 0.00 0.00 33.47 30.59 1kn6 s TRP 8 CO -0.30 -0.01 -0.15 0.00 -0.00 0.00 0.00 176.95 176.49 1kn6 s ALA 9 N 1.26 1.38 0.20 5.86 0.00 -0.75 -1.20 121.76 128.51 1kn6 s ALA 9 Ca 0.31 -0.57 -0.13 0.00 0.00 0.00 0.00 51.96 51.58 1kn6 s ALA 9 Cb -0.16 -0.51 0.01 0.00 0.00 0.00 0.00 23.12 22.45 1kn6 s ALA 9 CO 0.13 0.21 0.42 0.00 0.00 0.00 0.00 175.76 176.52 1kn6 s ALA 10 N 0.27 -0.39 -0.27 0.00 0.00 -1.13 -3.29 121.76 116.95 1kn6 s ALA 10 Ca -0.08 -0.66 -0.05 0.00 0.00 0.00 0.00 51.96 51.18 1kn6 s ALA 10 Cb -0.13 0.92 0.02 0.00 0.00 0.00 0.00 23.12 23.92 1kn6 s ALA 10 CO 0.03 -0.76 0.02 -1.21 0.00 0.00 0.00 175.76 173.84 1kn6 s GLU 11 N -3.95 2.99 -0.11 0.00 2.02 -1.21 -0.63 118.70 117.81 1kn6 s GLU 11 Ca 0.16 -0.90 -0.00 0.00 0.02 0.00 0.00 54.97 54.25 1kn6 s GLU 11 Cb 0.01 -3.20 0.02 0.00 0.10 0.00 0.00 34.13 31.06 1kn6 s GLU 11 CO 0.02 -0.42 -0.08 -1.50 0.02 0.00 0.00 175.26 173.30 1kn6 s ILE 12 N 1.43 1.03 -0.04 -1.63 -1.16 0.15 -3.40 121.20 117.57 1kn6 s ILE 12 Ca 0.02 -0.30 -0.25 0.00 -0.51 0.00 0.00 60.65 59.61 1kn6 s ILE 12 Cb -0.17 -1.04 -0.19 0.00 0.61 0.00 0.00 42.46 41.67 1kn6 s ILE 12 CO -0.00 0.36 1.10 -0.65 -2.81 0.00 0.00 174.94 172.94 1kn6 h PRO 13 N 8.06 -0.09 0.00 3.50 0.11 -1.89 -3.37 132.00 138.32 1kn6 h PRO 13 Ca -0.30 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1kn6 h PRO 13 Cb 1.14 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1kn6 h PRO 13 CO 0.41 0.43 0.00 0.41 -0.21 0.00 0.00 178.00 179.04 1kn6 n GLY 14 N 0.44 0.23 1.10 -0.55 0.00 -1.26 -4.72 105.19 100.43 1kn6 n GLY 14 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.68 1.68 0.38 -0.02 0.00 -1.26 -4.23 105.19 102.42 1kn6 n GLY 15 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 0.61 -0.90 -0.72 1.61 4.20 -1.86 1.16 115.11 119.22 1kn6 h GLN 16 Ca 0.00 0.06 0.16 0.00 0.06 0.00 0.00 58.65 58.93 1kn6 h GLN 16 Cb 0.80 0.21 -0.04 0.00 0.30 0.00 0.00 27.48 28.74 1kn6 h GLN 16 CO 0.00 -0.57 0.49 0.93 -0.67 0.00 0.00 178.83 179.01 1kn6 h GLU 17 N -1.12 0.26 0.17 1.46 5.08 -2.00 0.24 114.58 118.68 1kn6 h GLU 17 Ca -0.10 -0.02 -0.30 0.00 -1.00 0.00 0.00 59.36 57.95 1kn6 h GLU 17 Cb 0.75 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.95 1kn6 h GLU 17 CO 0.16 0.17 -1.36 0.00 -1.00 0.00 0.00 179.01 176.98 1kn6 h ALA 18 N 1.66 0.03 -0.51 3.43 0.00 -1.80 -3.01 119.26 119.06 1kn6 h ALA 18 Ca 0.35 -0.91 0.10 0.00 0.00 0.00 0.00 54.91 54.46 1kn6 h ALA 18 Cb 0.99 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.79 1kn6 h ALA 18 CO -0.08 0.91 0.01 0.00 0.00 0.00 0.00 179.25 180.08 1kn6 h ALA 19 N 0.43 0.49 0.00 0.00 0.00 0.35 0.64 119.26 121.18 1kn6 h ALA 19 Ca -0.19 0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1kn6 h ALA 19 Cb 2.04 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 20.08 1kn6 h ALA 19 CO 0.22 -0.38 -0.32 1.03 0.00 0.00 0.00 179.25 179.80 1kn6 h SER 20 N 0.12 0.00 0.77 0.00 0.87 -1.55 -2.91 113.55 110.86 1kn6 h SER 20 Ca 0.26 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.66 1kn6 h SER 20 Cb 0.39 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 1kn6 h SER 20 CO -0.43 0.32 -0.77 0.00 -0.53 0.00 0.00 176.83 175.42 1kn6 h ALA 21 N 1.68 0.72 0.61 6.23 0.00 -0.19 -3.15 119.26 125.15 1kn6 h ALA 21 Ca -0.00 -0.70 -0.03 0.00 0.00 0.00 0.00 54.91 54.17 1kn6 h ALA 21 Cb 0.83 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1kn6 h ALA 21 CO 0.04 0.97 -0.29 0.82 0.00 0.00 0.00 179.25 180.79 1kn6 h ILE 22 N 0.00 0.20 -1.06 0.00 2.04 0.26 0.62 117.51 119.58 1kn6 h ILE 22 Ca -0.01 -0.35 0.29 0.00 1.00 0.00 0.00 64.86 65.79 1kn6 h ILE 22 Cb 1.37 0.28 -0.11 0.00 -0.74 0.00 0.00 36.82 37.62 1kn6 h ILE 22 CO 0.10 0.03 0.66 0.00 0.00 0.00 0.00 178.15 178.94 1kn6 h ALA 23 N -0.94 2.15 0.08 1.87 0.00 -1.65 0.45 119.26 121.22 1kn6 h ALA 23 Ca -0.08 0.10 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 1kn6 h ALA 23 Cb 0.67 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1kn6 h ALA 23 CO 0.14 -0.62 -1.19 0.93 0.00 0.00 0.00 179.25 178.51 1kn6 h GLU 24 N 0.40 0.17 0.17 0.00 5.08 -1.48 0.96 114.58 119.88 1kn6 h GLU 24 Ca 0.65 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.71 1kn6 h GLU 24 Cb 1.57 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.93 1kn6 h GLU 24 CO -0.39 1.12 -0.08 0.93 -1.00 0.00 0.00 179.01 179.59 1kn6 h GLU 25 N 0.05 -0.22 0.37 2.33 3.07 0.49 -3.37 114.58 117.29 1kn6 h GLU 25 Ca -0.10 0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.76 1kn6 h GLU 25 Cb 1.91 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.87 1kn6 h GLU 25 CO 0.17 -0.15 -0.18 1.37 -1.40 0.00 0.00 179.01 178.83 1kn6 h LEU 26 N -0.29 -0.42 0.00 1.33 -0.00 -1.33 -3.48 115.31 111.12 1kn6 h LEU 26 Ca -0.02 -0.15 0.00 0.00 -0.00 0.00 0.00 57.88 57.71 1kn6 h LEU 26 Cb 0.18 0.11 0.00 0.00 -0.00 0.00 0.00 40.66 40.94 1kn6 h LEU 26 CO 0.04 -0.02 0.00 0.61 -0.00 0.00 0.00 178.44 179.07 1kn6 n GLY 27 N -0.21 0.10 3.83 0.17 0.00 -0.90 -4.96 105.19 103.22 1kn6 n GLY 27 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.12 2.01 -0.32 1.61 1.51 0.33 -4.88 117.35 117.48 1kn6 s TYR 28 Ca 0.00 -0.77 -0.07 0.00 -1.01 0.00 0.00 57.07 55.22 1kn6 s TYR 28 Cb 0.00 -1.89 0.02 0.00 -0.11 0.00 0.00 41.96 39.98 1kn6 s TYR 28 CO 0.00 -0.14 0.10 -0.51 -1.11 0.00 0.00 175.55 173.89 1kn6 s ASP 29 N -4.10 5.25 -0.32 2.29 1.01 -0.82 -3.91 116.67 116.07 1kn6 s ASP 29 Ca 0.32 -0.91 -0.22 0.00 0.71 0.00 0.00 52.55 52.45 1kn6 s ASP 29 Cb 0.00 -1.89 0.00 0.00 1.01 0.00 0.00 42.92 42.04 1kn6 s ASP 29 CO 0.19 -0.26 0.73 -0.22 0.21 0.00 0.00 175.17 175.81 1kn6 s LEU 30 N 1.46 4.13 -0.28 1.23 1.98 -1.26 -0.97 118.68 124.97 1kn6 s LEU 30 Ca 0.01 0.47 -0.00 0.00 -2.89 0.00 0.00 54.13 51.71 1kn6 s LEU 30 Cb -0.18 -2.96 0.14 0.00 0.66 0.00 0.00 46.19 43.84 1kn6 s LEU 30 CO 0.03 -0.60 0.31 -0.76 -1.89 0.00 0.00 176.35 173.44 1kn6 s LEU 31 N 2.87 -0.34 -0.28 -0.68 2.01 0.52 -4.94 118.68 117.84 1kn6 s LEU 31 Ca 0.29 -0.62 0.00 0.00 0.01 0.00 0.00 54.13 53.81 1kn6 s LEU 31 Cb -0.14 0.63 0.15 0.00 0.01 0.00 0.00 46.19 46.83 1kn6 s LEU 31 CO 0.14 -0.38 0.36 -0.83 1.01 0.00 0.00 176.35 176.65 1kn6 s GLY 32 N 2.40 -0.39 -0.45 -3.19 0.00 -1.25 -3.36 107.32 101.07 1kn6 s GLY 32 Ca 0.09 0.15 0.06 0.00 0.00 0.00 0.00 44.72 45.02 1kn6 s GLY 32 CO -0.31 2.83 0.54 1.20 0.00 0.00 0.00 173.10 177.36 1kn6 s GLN 33 N 2.48 0.94 0.11 2.90 -0.21 -1.25 -3.92 119.66 120.70 1kn6 s GLN 33 Ca 0.10 -1.31 0.24 0.00 0.02 0.00 0.00 55.36 54.41 1kn6 s GLN 33 Cb -0.13 -0.57 0.32 0.00 1.00 0.00 0.00 33.01 33.62 1kn6 s GLN 33 CO -0.28 -1.32 1.30 0.44 -2.12 0.00 0.00 175.29 173.31 1kn6 n ILE 34 N 3.22 0.34 0.00 1.08 -6.64 -1.26 -4.96 119.36 111.14 1kn6 n ILE 34 Ca 0.20 -0.27 0.00 0.00 -1.77 0.00 0.00 62.75 60.91 1kn6 n ILE 34 Cb 0.52 -0.10 0.00 0.00 -1.44 0.00 0.00 39.64 38.62 1kn6 n ILE 34 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1kn6 n GLY 35 N 1.34 1.43 0.64 3.28 0.00 -1.26 -4.73 105.19 105.89 1kn6 n GLY 35 Ca 0.03 0.00 0.47 0.00 0.00 0.00 0.00 46.02 46.52 1kn6 n GLY 35 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1kn6 n SER 36 N 2.85 0.00 0.00 1.61 7.64 -1.26 -1.24 113.62 123.22 1kn6 n SER 36 Ca 0.00 0.89 0.00 0.00 1.01 0.00 0.00 58.87 60.77 1kn6 n SER 36 Cb 0.00 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 1kn6 n SER 36 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1kn6 n LEU 37 N -3.69 0.03 -3.52 -3.43 -0.00 -1.26 -5.08 117.00 100.04 1kn6 n LEU 37 Ca 0.39 -0.19 -0.39 0.00 -0.00 0.00 0.00 56.01 55.83 1kn6 n LEU 37 Cb 1.82 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 45.28 1kn6 n LEU 37 CO 0.39 0.01 -0.27 -1.84 -0.00 0.00 0.00 177.39 175.67 1kn6 n GLU 38 N -0.32 -1.92 0.00 1.47 0.28 -0.37 -4.74 120.64 115.04 1kn6 n GLU 38 Ca 0.00 1.40 0.00 0.00 -0.16 0.00 0.00 57.16 58.40 1kn6 n GLU 38 Cb 0.01 -2.05 0.00 0.00 1.43 0.00 0.00 31.44 30.83 1kn6 n GLU 38 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1kn6 n ASN 39 N -0.29 0.00 -4.77 -1.84 2.04 -1.26 -4.85 115.26 104.29 1kn6 n ASN 39 Ca -0.10 0.00 -0.40 0.00 -0.44 0.00 0.00 54.58 53.65 1kn6 n ASN 39 Cb 0.69 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.94 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 0.00 2.69 -0.18 -2.53 2.46 -1.26 0.33 115.29 116.81 1kn6 s HIS 40 Ca 0.00 1.36 -0.07 0.00 0.47 0.00 0.00 55.06 56.82 1kn6 s HIS 40 Cb 0.00 -3.75 0.08 0.00 -0.13 0.00 0.00 32.58 28.77 1kn6 s HIS 40 CO 0.00 -2.38 0.39 0.71 -2.47 0.00 0.00 174.74 170.99 1kn6 s TYR 41 N -1.25 -0.68 0.06 3.88 1.51 0.20 -3.90 117.35 117.18 1kn6 s TYR 41 Ca 0.58 1.36 0.09 0.00 -1.01 0.00 0.00 57.07 58.10 1kn6 s TYR 41 Cb -0.40 0.24 -0.03 0.00 -0.11 0.00 0.00 41.96 41.67 1kn6 s TYR 41 CO 0.51 -0.41 -0.25 -1.17 -1.11 0.00 0.00 175.55 173.12 1kn6 s LEU 42 N 2.16 2.20 0.22 -1.29 0.20 -1.21 -2.83 118.68 118.12 1kn6 s LEU 42 Ca -0.04 -0.61 0.09 0.00 0.69 0.00 0.00 54.13 54.26 1kn6 s LEU 42 Cb -0.11 -1.20 -0.04 0.00 -0.43 0.00 0.00 46.19 44.41 1kn6 s LEU 42 CO -0.12 0.22 -0.07 -0.36 -0.29 0.00 0.00 176.35 175.73 1kn6 s PHE 43 N -0.86 2.63 -0.16 5.38 0.08 -0.34 0.20 117.98 124.90 1kn6 s PHE 43 Ca 0.11 -0.23 -0.07 0.00 0.12 0.00 0.00 56.93 56.86 1kn6 s PHE 43 Cb -0.10 -1.22 0.07 0.00 -0.57 0.00 0.00 43.02 41.20 1kn6 s PHE 43 CO 0.03 0.57 0.36 0.15 -0.10 0.00 0.00 175.22 176.23 1kn6 s LYS 44 N -3.21 0.29 -0.30 0.44 3.01 -0.14 -2.33 119.74 117.50 1kn6 s LYS 44 Ca 0.28 0.82 -0.10 0.00 -1.01 0.00 0.00 55.97 55.95 1kn6 s LYS 44 Cb -0.08 0.07 0.19 0.00 -1.01 0.00 0.00 37.83 37.00 1kn6 s LYS 44 CO 0.17 -0.21 1.02 -1.58 0.51 0.00 0.00 175.35 175.25 1kn6 s HIS 45 N 1.96 -0.57 -0.58 3.18 2.46 -1.26 -1.95 115.29 118.53 1kn6 s HIS 45 Ca -0.05 0.34 -0.04 0.00 0.47 0.00 0.00 55.06 55.79 1kn6 s HIS 45 Cb -0.11 0.10 0.15 0.00 -0.13 0.00 0.00 32.58 32.60 1kn6 s HIS 45 CO -0.11 -0.33 0.40 0.15 -2.47 0.00 0.00 174.74 172.38 1kn6 s LYS 46 N 2.95 2.48 0.53 2.88 3.01 -1.26 -4.92 119.74 125.41 1kn6 s LYS 46 Ca 0.25 -2.35 0.22 0.00 -1.01 0.00 0.00 55.97 53.08 1kn6 s LYS 46 Cb -0.03 -3.73 1.39 0.00 -1.01 0.00 0.00 37.83 34.44 1kn6 s LYS 46 CO -0.23 -1.16 2.07 1.03 0.51 0.00 0.00 175.35 177.57 1kn6 h SER 47 N 7.33 0.00 -2.20 2.83 0.87 -1.99 -3.29 113.55 117.09 1kn6 h SER 47 Ca -0.04 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 60.00 1kn6 h SER 47 Cb 0.98 0.00 -0.35 0.00 -0.44 0.00 0.00 62.40 62.59 1kn6 h SER 47 CO 0.72 0.00 -0.87 -1.38 -0.53 0.00 0.00 176.83 174.77 1kn6 s HIS 48 N -4.98 0.56 -0.99 2.24 0.00 -1.26 -5.07 115.29 105.78 1kn6 s HIS 48 Ca -0.05 -1.84 -0.25 0.00 -3.00 0.00 0.00 55.06 49.92 1kn6 s HIS 48 Cb 0.18 -0.71 -0.13 0.00 -4.00 0.00 0.00 32.58 27.91 1kn6 s HIS 48 CO 0.68 -0.90 2.12 -1.25 -1.00 0.00 0.00 174.74 174.40 1kn6 s PRO 49 N 0.48 1.86 -0.20 -0.38 0.04 -1.24 -4.90 135.00 130.66 1kn6 s PRO 49 Ca 0.28 -0.31 -0.02 0.00 0.04 0.00 0.00 61.00 60.99 1kn6 s PRO 49 Cb -0.03 -5.00 0.00 0.00 0.04 0.00 0.00 34.50 29.51 1kn6 s PRO 49 CO -0.13 -4.45 -0.11 1.03 0.04 0.00 0.00 177.00 173.39 1kn6 s ARG 50 N 7.84 3.22 -0.32 4.56 0.52 -1.26 -5.01 118.95 128.50 1kn6 s ARG 50 Ca 0.79 -0.71 -0.33 0.00 -0.52 0.00 0.00 55.73 54.96 1kn6 s ARG 50 Cb -0.07 -2.83 -0.10 0.00 0.52 0.00 0.00 34.95 32.48 1kn6 s ARG 50 CO 0.10 -0.20 2.20 -2.13 0.02 0.00 0.00 175.30 175.30 1kn6 n ARG 51 N 4.70 1.28 -2.56 3.54 0.63 -1.24 -0.46 116.66 122.56 1kn6 n ARG 51 Ca -0.19 0.35 -0.02 0.00 -0.92 0.00 0.00 57.85 57.06 1kn6 n ARG 51 Cb 0.51 -2.65 0.01 0.00 0.45 0.00 0.00 32.46 30.77 1kn6 n ARG 51 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1kn6 n SER 52 N 10.35 -2.34 0.09 6.15 2.88 -0.89 -4.97 113.62 124.90 1kn6 n SER 52 Ca 0.39 -0.05 -0.04 0.00 -1.33 0.00 0.00 58.87 57.84 1kn6 n SER 52 Cb 0.28 -0.88 0.16 0.00 -0.75 0.00 0.00 64.21 63.02 1kn6 n SER 52 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 1kn6 h ARG 53 N -0.22 0.22 -6.29 -1.46 0.11 -0.95 -3.47 114.38 102.31 1kn6 h ARG 53 Ca -0.05 -0.14 -0.46 0.00 0.10 0.00 0.00 59.98 59.43 1kn6 h ARG 53 Cb 1.03 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 32.11 1kn6 h ARG 53 CO 0.05 0.71 -0.83 0.54 0.10 0.00 0.00 179.97 180.54 1kn6 n ARG 54 N -3.92 -4.46 -4.25 0.08 5.12 -1.26 -4.98 116.66 103.00 1kn6 n ARG 54 Ca -0.02 0.54 -0.18 0.00 -1.93 0.00 0.00 57.85 56.26 1kn6 n ARG 54 Cb 0.57 -5.05 -0.15 0.00 -1.16 0.00 0.00 32.46 26.67 1kn6 n ARG 54 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 1kn6 s SER 55 N -4.08 0.87 -0.30 0.55 0.01 -1.26 -5.11 113.70 104.37 1kn6 s SER 55 Ca 0.19 -0.13 -0.18 0.00 1.31 0.00 0.00 55.95 57.14 1kn6 s SER 55 Cb -0.10 -0.18 0.18 0.00 0.21 0.00 0.00 66.02 66.13 1kn6 s SER 55 CO 0.85 0.05 1.22 0.00 0.41 0.00 0.00 173.24 175.77 1kn6 s ALA 56 N 0.09 -3.65 0.04 1.44 0.00 -1.26 -5.04 121.76 113.39 1kn6 s ALA 56 Ca -0.01 1.45 -0.03 0.00 0.00 0.00 0.00 51.96 53.38 1kn6 s ALA 56 Cb -0.06 -2.51 -0.01 0.00 0.00 0.00 0.00 23.12 20.55 1kn6 s ALA 56 CO -0.00 -1.34 -0.05 1.47 0.00 0.00 0.00 175.76 175.84 1kn6 n LEU 57 N 5.22 1.08 0.07 0.00 -0.00 -1.26 -4.42 117.00 117.69 1kn6 n LEU 57 Ca -0.08 0.15 0.08 0.00 -0.00 0.00 0.00 56.01 56.15 1kn6 n LEU 57 Cb 0.55 -0.35 0.52 0.00 -0.00 0.00 0.00 43.42 44.14 1kn6 n LEU 57 CO -0.12 -0.56 1.14 0.45 -0.00 0.00 0.00 177.39 178.30 1kn6 h HIS 58 N -0.15 0.30 -0.35 1.47 -0.00 -1.98 0.16 115.15 114.60 1kn6 h HIS 58 Ca -0.02 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 1kn6 h HIS 58 Cb 0.31 -0.10 0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1kn6 h HIS 58 CO -0.05 0.18 0.00 -0.89 -0.00 0.00 0.00 177.93 177.16 1kn6 n ILE 59 N -4.49 0.46 -1.72 2.45 2.08 -1.26 -3.79 119.36 113.09 1kn6 n ILE 59 Ca 0.03 -0.49 -0.04 0.00 0.56 0.00 0.00 62.75 62.80 1kn6 n ILE 59 Cb 0.15 0.30 0.15 0.00 -0.75 0.00 0.00 39.64 39.50 1kn6 n ILE 59 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 1kn6 n THR 60 N 0.60 2.34 0.00 1.39 -2.24 0.55 -4.47 114.28 112.45 1kn6 n THR 60 Ca 0.14 -3.52 0.00 0.00 -2.27 0.00 0.00 64.05 58.40 1kn6 n THR 60 Cb 0.34 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1kn6 n THR 60 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1kn6 n LYS 61 N -0.99 0.00 0.00 -0.78 2.85 -1.23 -4.87 118.16 113.13 1kn6 n LYS 61 Ca 0.28 0.00 0.09 0.00 -1.05 0.00 0.00 58.31 57.63 1kn6 n LYS 61 Cb 0.79 0.00 0.41 0.00 -0.65 0.00 0.00 35.03 35.58 1kn6 n LYS 61 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 1kn6 n ARG 62 N -1.31 0.02 0.02 -1.58 3.00 -1.26 -1.77 116.66 113.79 1kn6 n ARG 62 Ca 0.00 0.17 -0.01 0.00 -0.00 0.00 0.00 57.85 58.01 1kn6 n ARG 62 Cb 0.00 -1.50 -0.01 0.00 0.00 0.00 0.00 32.46 30.95 1kn6 n ARG 62 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1kn6 h LEU 63 N 0.00 -0.08 -1.45 6.15 7.12 -1.80 -1.32 115.31 123.93 1kn6 h LEU 63 Ca 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.98 1kn6 h LEU 63 Cb 0.31 0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 40.45 1kn6 h LEU 63 CO 0.00 0.07 0.00 0.77 -0.13 0.00 0.00 178.44 179.15 1kn6 h SER 64 N -0.35 0.33 -0.05 1.25 4.64 -1.81 0.83 113.55 118.38 1kn6 h SER 64 Ca -0.01 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 1kn6 h SER 64 Cb 0.07 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1kn6 h SER 64 CO 0.02 0.39 0.00 0.44 -0.87 0.00 0.00 176.83 176.81 1kn6 h ASP 65 N 0.35 0.08 0.22 4.97 5.19 -1.47 -2.63 116.42 123.14 1kn6 h ASP 65 Ca 0.08 -0.30 -0.33 0.00 -0.62 0.00 0.00 57.03 55.86 1kn6 h ASP 65 Cb 0.23 -0.02 0.03 0.00 0.18 0.00 0.00 39.33 39.75 1kn6 h ASP 65 CO 0.01 0.36 -1.54 0.44 -3.12 0.00 0.00 179.24 175.39 1kn6 h ASP 66 N -0.19 0.74 0.00 6.45 3.32 -0.97 -3.28 116.42 122.48 1kn6 h ASP 66 Ca 0.01 -0.93 0.00 0.00 0.02 0.00 0.00 57.03 56.14 1kn6 h ASP 66 Cb 0.31 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1kn6 h ASP 66 CO 0.00 1.72 0.00 -0.67 -1.72 0.00 0.00 179.24 178.57 1kn6 n ASP 67 N -3.71 0.00 -0.10 6.45 2.03 0.28 -3.41 116.55 118.10 1kn6 n ASP 67 Ca -0.20 -0.89 0.26 0.00 0.52 0.00 0.00 54.79 54.49 1kn6 n ASP 67 Cb 1.07 0.00 0.67 0.00 -0.72 0.00 0.00 41.12 42.14 1kn6 n ASP 67 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1kn6 h ARG 68 N 0.00 0.00 -0.12 -0.67 0.11 -1.53 -2.90 114.38 109.27 1kn6 h ARG 68 Ca 0.00 0.00 0.01 0.00 0.10 0.00 0.00 59.98 60.09 1kn6 h ARG 68 Cb 0.00 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.07 1kn6 h ARG 68 CO 0.00 0.00 -0.07 1.33 0.10 0.00 0.00 179.97 181.33 1kn6 n VAL 69 N -3.70 -0.08 0.00 0.08 0.24 -1.22 -4.47 118.33 109.19 1kn6 n VAL 69 Ca 0.16 0.34 0.00 0.00 -2.04 0.00 0.00 64.34 62.80 1kn6 n VAL 69 Cb 1.02 -0.42 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 1kn6 n VAL 69 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1kn6 n THR 70 N -3.72 0.00 -3.74 3.34 -1.04 -1.09 -4.89 114.28 103.13 1kn6 n THR 70 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 1kn6 n THR 70 Cb 0.03 -0.02 -0.07 0.00 -1.82 0.00 0.00 70.33 68.45 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 -0.73 -0.11 -0.16 -1.42 1.48 -1.22 -5.08 118.94 111.70 1kn6 s TRP 71 Ca 0.00 -0.06 -0.08 0.00 -1.06 0.00 0.00 56.10 54.90 1kn6 s TRP 71 Cb 0.00 0.11 0.06 0.00 -1.16 0.00 0.00 33.47 32.48 1kn6 s TRP 71 CO 0.00 -0.53 0.38 0.00 -4.06 0.00 0.00 176.95 172.74 1kn6 s ALA 72 N -2.77 -0.96 -0.04 2.67 0.00 -1.26 -3.32 121.76 116.08 1kn6 s ALA 72 Ca -0.03 1.40 -0.11 0.00 0.00 0.00 0.00 51.96 53.22 1kn6 s ALA 72 Cb -0.00 -0.97 0.02 0.00 0.00 0.00 0.00 23.12 22.17 1kn6 s ALA 72 CO -0.05 -0.38 0.24 -2.00 0.00 0.00 0.00 175.76 173.57 1kn6 s GLU 73 N 1.69 0.49 0.56 0.00 2.56 -1.21 -5.03 118.70 117.76 1kn6 s GLU 73 Ca -0.07 -0.08 -0.03 0.00 0.00 0.00 0.00 54.97 54.79 1kn6 s GLU 73 Cb -0.10 0.22 0.02 0.00 2.00 0.00 0.00 34.13 36.27 1kn6 s GLU 73 CO -0.12 -0.11 0.83 -0.65 -0.56 0.00 0.00 175.26 174.64 1kn6 s GLN 74 N -0.87 2.76 -0.18 4.30 -0.21 -1.26 -1.81 119.66 122.40 1kn6 s GLN 74 Ca -0.10 -0.35 -0.09 0.00 0.02 0.00 0.00 55.36 54.84 1kn6 s GLN 74 Cb -0.05 -2.39 0.07 0.00 1.00 0.00 0.00 33.01 31.64 1kn6 s GLN 74 CO 0.02 -0.67 0.41 -0.65 -2.12 0.00 0.00 175.29 172.29 1kn6 s GLN 75 N -4.86 0.38 0.00 2.91 1.11 0.12 -4.82 119.66 114.51 1kn6 s GLN 75 Ca 0.54 0.84 0.00 0.00 0.01 0.00 0.00 55.36 56.75 1kn6 s GLN 75 Cb -0.10 0.04 0.00 0.00 -1.01 0.00 0.00 33.01 31.94 1kn6 s GLN 75 CO 0.41 -0.18 0.00 2.48 0.01 0.00 0.00 175.29 178.02