#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 -2.13 0.24 -1.26 -3.72 118.33 111.46 1kn6 n VAL 5 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1kn6 n VAL 5 Cb 0.00 -0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.29 1kn6 n VAL 5 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1kn6 n ASN 6 N -2.31 0.00 -4.13 -1.34 5.15 -1.26 -4.53 115.26 106.84 1kn6 n ASN 6 Ca 0.00 0.00 -0.09 0.00 -0.60 0.00 0.00 54.58 53.89 1kn6 n ASN 6 Cb 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.15 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 0.89 -0.08 1.20 -1.05 -1.19 -4.60 118.70 113.87 1kn6 s GLU 7 Ca 0.00 -1.40 -0.19 0.00 -0.15 0.00 0.00 54.97 53.23 1kn6 s GLU 7 Cb 0.00 0.24 -0.05 0.00 -0.44 0.00 0.00 34.13 33.89 1kn6 s GLU 7 CO 0.00 -0.24 0.52 -0.46 0.95 0.00 0.00 175.26 176.02 1kn6 s TRP 8 N -4.03 3.58 -0.06 4.83 -0.00 -0.64 -3.05 118.94 119.57 1kn6 s TRP 8 Ca 0.21 1.00 0.03 0.00 -0.00 0.00 0.00 56.10 57.35 1kn6 s TRP 8 Cb 0.07 -2.56 0.01 0.00 -0.00 0.00 0.00 33.47 30.99 1kn6 s TRP 8 CO -0.00 0.25 -0.15 0.00 -0.00 0.00 0.00 176.95 177.05 1kn6 s ALA 9 N 0.27 1.44 0.22 5.86 0.00 -1.14 -0.72 121.76 127.70 1kn6 s ALA 9 Ca 0.28 -0.57 -0.14 0.00 0.00 0.00 0.00 51.96 51.53 1kn6 s ALA 9 Cb -0.16 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.40 1kn6 s ALA 9 CO 0.13 0.19 0.47 0.00 0.00 0.00 0.00 175.76 176.55 1kn6 s ALA 10 N 0.38 -0.41 -0.26 0.00 0.00 0.02 -3.35 121.76 118.13 1kn6 s ALA 10 Ca -0.11 -0.69 -0.03 0.00 0.00 0.00 0.00 51.96 51.13 1kn6 s ALA 10 Cb -0.14 0.97 0.02 0.00 0.00 0.00 0.00 23.12 23.97 1kn6 s ALA 10 CO 0.04 -0.81 -0.01 -1.21 0.00 0.00 0.00 175.76 173.76 1kn6 s GLU 11 N -3.97 2.91 -0.14 0.00 2.02 -1.19 0.53 118.70 118.87 1kn6 s GLU 11 Ca 0.18 -0.94 -0.00 0.00 0.02 0.00 0.00 54.97 54.22 1kn6 s GLU 11 Cb -0.00 -3.12 0.03 0.00 0.10 0.00 0.00 34.13 31.14 1kn6 s GLU 11 CO 0.04 -0.42 -0.10 -1.50 0.02 0.00 0.00 175.26 173.31 1kn6 s ILE 12 N 1.38 1.26 0.09 -1.63 -1.16 0.34 -3.49 121.20 117.98 1kn6 s ILE 12 Ca 0.01 -0.49 -0.17 0.00 -0.51 0.00 0.00 60.65 59.49 1kn6 s ILE 12 Cb -0.17 -1.26 -0.08 0.00 0.61 0.00 0.00 42.46 41.56 1kn6 s ILE 12 CO -0.02 0.36 1.46 -0.65 -2.81 0.00 0.00 174.94 173.27 1kn6 h PRO 13 N 8.12 0.56 0.00 3.50 0.11 -1.85 -3.36 132.00 139.07 1kn6 h PRO 13 Ca -0.32 -0.24 0.00 0.00 0.11 0.00 0.00 66.00 65.55 1kn6 h PRO 13 Cb 1.13 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1kn6 h PRO 13 CO 0.45 0.80 0.00 0.41 -0.21 0.00 0.00 178.00 179.45 1kn6 n GLY 14 N -0.05 0.98 0.98 -0.55 0.00 -1.26 -4.81 105.19 100.48 1kn6 n GLY 14 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 0.34 1.10 0.33 -0.02 0.00 -1.26 -4.11 105.19 101.58 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 0.87 -0.75 -0.68 1.61 4.20 -1.87 1.04 115.11 119.52 1kn6 h GLN 16 Ca 0.00 0.05 0.13 0.00 0.06 0.00 0.00 58.65 58.89 1kn6 h GLN 16 Cb 0.55 0.17 -0.04 0.00 0.30 0.00 0.00 27.48 28.46 1kn6 h GLN 16 CO 0.00 -0.46 0.46 0.93 -0.67 0.00 0.00 178.83 179.08 1kn6 h GLU 17 N -0.88 0.39 0.10 1.46 5.08 -2.01 0.01 114.58 118.73 1kn6 h GLU 17 Ca -0.08 -0.02 -0.26 0.00 -1.00 0.00 0.00 59.36 58.00 1kn6 h GLU 17 Cb 0.63 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1kn6 h GLU 17 CO 0.13 0.26 -1.21 0.00 -1.00 0.00 0.00 179.01 177.19 1kn6 h ALA 18 N 1.67 0.17 -0.39 3.43 0.00 -1.78 -3.04 119.26 119.31 1kn6 h ALA 18 Ca 0.33 -0.91 0.06 0.00 0.00 0.00 0.00 54.91 54.38 1kn6 h ALA 18 Cb 0.72 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 1kn6 h ALA 18 CO -0.10 1.05 0.09 0.00 0.00 0.00 0.00 179.25 180.30 1kn6 h ALA 19 N 0.68 0.43 0.00 0.00 0.00 0.31 0.12 119.26 120.79 1kn6 h ALA 19 Ca -0.11 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1kn6 h ALA 19 Cb 1.93 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.79 1kn6 h ALA 19 CO 0.18 -0.31 -0.28 0.77 0.00 0.00 0.00 179.25 179.61 1kn6 h SER 20 N 0.23 0.00 0.22 0.00 0.02 -1.51 -3.00 113.55 109.51 1kn6 h SER 20 Ca 0.18 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.95 1kn6 h SER 20 Cb 0.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 1kn6 h SER 20 CO -0.23 0.28 -0.73 0.00 -1.14 0.00 0.00 176.83 175.01 1kn6 h ALA 21 N 1.72 0.57 0.25 3.77 0.00 -0.92 -3.14 119.26 121.51 1kn6 h ALA 21 Ca -0.00 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.29 1kn6 h ALA 21 Cb 0.79 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1kn6 h ALA 21 CO 0.04 0.76 -0.12 0.82 0.00 0.00 0.00 179.25 180.74 1kn6 h ILE 22 N 0.30 0.80 -1.00 0.00 2.04 -0.71 0.22 117.51 119.16 1kn6 h ILE 22 Ca -0.03 -0.34 0.25 0.00 1.00 0.00 0.00 64.86 65.74 1kn6 h ILE 22 Cb 1.31 0.99 -0.08 0.00 -0.74 0.00 0.00 36.82 38.31 1kn6 h ILE 22 CO 0.13 0.07 0.66 0.00 0.00 0.00 0.00 178.15 179.01 1kn6 h ALA 23 N 0.18 2.29 0.08 1.87 0.00 -1.62 0.34 119.26 122.40 1kn6 h ALA 23 Ca -0.03 0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.66 1kn6 h ALA 23 Cb 0.38 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1kn6 h ALA 23 CO 0.06 -0.64 -1.15 0.93 0.00 0.00 0.00 179.25 178.44 1kn6 h GLU 24 N 0.37 0.18 0.00 0.00 5.08 -1.41 0.92 114.58 119.72 1kn6 h GLU 24 Ca 0.55 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 1kn6 h GLU 24 Cb 1.44 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.80 1kn6 h GLU 24 CO -0.23 1.14 0.00 0.39 -1.00 0.00 0.00 179.01 179.31 1kn6 n GLU 25 N -3.48 0.00 0.36 2.33 -0.58 0.11 -4.35 120.64 115.04 1kn6 n GLU 25 Ca -0.06 0.03 -0.17 0.00 -0.42 0.00 0.00 57.16 56.54 1kn6 n GLU 25 Cb 0.99 -0.88 -0.09 0.00 -0.57 0.00 0.00 31.44 30.89 1kn6 n GLU 25 CO 0.00 0.00 0.00 1.37 -0.48 0.00 0.00 177.13 178.02 1kn6 h LEU 26 N 0.00 -0.76 0.00 -4.62 -0.00 -1.55 -3.48 115.31 104.90 1kn6 h LEU 26 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 1kn6 h LEU 26 Cb 0.00 0.20 0.00 0.00 -0.00 0.00 0.00 40.66 40.86 1kn6 h LEU 26 CO 0.00 -0.50 0.00 0.61 -0.00 0.00 0.00 178.44 178.55 1kn6 n GLY 27 N -1.31 0.27 3.50 0.17 0.00 -1.01 -5.02 105.19 101.77 1kn6 n GLY 27 Ca -0.13 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 0.78 -0.62 1.61 1.51 0.32 -4.91 117.35 116.04 1kn6 s TYR 28 Ca 0.00 -1.07 -0.07 0.00 -1.01 0.00 0.00 57.07 54.92 1kn6 s TYR 28 Cb 0.00 -0.02 0.16 0.00 -0.11 0.00 0.00 41.96 41.99 1kn6 s TYR 28 CO 0.00 -1.02 0.48 0.34 -1.11 0.00 0.00 175.55 174.24 1kn6 s ASP 29 N -3.13 5.73 -0.07 2.29 2.15 -1.09 -4.30 116.67 118.24 1kn6 s ASP 29 Ca 0.28 -2.52 -0.23 0.00 0.43 0.00 0.00 52.55 50.52 1kn6 s ASP 29 Cb 0.00 -1.98 -0.04 0.00 -0.30 0.00 0.00 42.92 40.61 1kn6 s ASP 29 CO 0.14 -0.52 0.67 -0.22 -0.17 0.00 0.00 175.17 175.07 1kn6 s LEU 30 N 0.44 4.32 -0.29 -1.34 1.98 -1.26 0.15 118.68 122.69 1kn6 s LEU 30 Ca 0.14 1.14 -0.00 0.00 -2.89 0.00 0.00 54.13 52.52 1kn6 s LEU 30 Cb -0.20 -3.03 0.14 0.00 0.66 0.00 0.00 46.19 43.76 1kn6 s LEU 30 CO -0.04 -0.09 0.31 -0.76 -1.89 0.00 0.00 176.35 173.88 1kn6 s LEU 31 N 0.72 -0.32 -0.56 -0.68 1.43 0.31 -4.89 118.68 114.68 1kn6 s LEU 31 Ca 0.36 -0.67 0.04 0.00 -1.03 0.00 0.00 54.13 52.83 1kn6 s LEU 31 Cb -0.17 0.59 0.15 0.00 0.03 0.00 0.00 46.19 46.79 1kn6 s LEU 31 CO 0.17 -0.38 0.35 -0.83 0.23 0.00 0.00 176.35 175.89 1kn6 s GLY 32 N 2.39 2.36 -0.42 -3.19 0.00 -1.26 -2.78 107.32 104.41 1kn6 s GLY 32 Ca 0.09 -3.27 0.05 0.00 0.00 0.00 0.00 44.72 41.59 1kn6 s GLY 32 CO -0.32 1.25 0.49 1.62 0.00 0.00 0.00 173.10 176.15 1kn6 s GLN 33 N -0.57 0.84 -0.23 2.90 2.00 -1.25 -4.74 119.66 118.60 1kn6 s GLN 33 Ca 0.22 -1.15 -0.11 0.00 -2.00 0.00 0.00 55.36 52.32 1kn6 s GLN 33 Cb -0.15 -0.62 -0.10 0.00 0.80 0.00 0.00 33.01 32.94 1kn6 s GLN 33 CO -0.08 -1.28 -0.30 0.44 -0.50 0.00 0.00 175.29 173.57 1kn6 n ILE 34 N 3.59 1.29 0.00 -2.34 -0.00 -1.26 -5.05 119.36 115.59 1kn6 n ILE 34 Ca 0.17 -0.33 0.00 0.00 -0.00 0.00 0.00 62.75 62.59 1kn6 n ILE 34 Cb 0.50 -1.80 0.00 0.00 -0.00 0.00 0.00 39.64 38.34 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 1.56 2.97 0.32 3.28 0.00 -1.26 -4.88 105.19 107.18 1kn6 n GLY 35 Ca -0.46 -0.79 0.18 0.00 0.00 0.00 0.00 46.02 44.95 1kn6 n GLY 35 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1kn6 h SER 36 N 0.00 -0.01 0.00 1.61 0.87 -2.05 -2.63 113.55 111.35 1kn6 h SER 36 Ca 0.00 0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 1kn6 h SER 36 Cb 0.00 0.31 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1kn6 h SER 36 CO 0.00 -0.25 -1.05 0.00 -0.53 0.00 0.00 176.83 175.00 1kn6 n LEU 37 N -5.28 0.01 -3.22 2.23 -0.00 -1.26 -5.08 117.00 104.41 1kn6 n LEU 37 Ca 0.26 -0.05 -0.15 0.00 -0.00 0.00 0.00 56.01 56.07 1kn6 n LEU 37 Cb 0.84 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 44.27 1kn6 n LEU 37 CO 0.02 0.00 -0.40 -0.62 -0.00 0.00 0.00 177.39 176.40 1kn6 n GLU 38 N -1.56 -0.87 0.00 1.47 1.02 -0.99 -4.76 120.64 114.95 1kn6 n GLU 38 Ca -0.00 0.98 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 1kn6 n GLU 38 Cb 0.08 -1.31 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 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 0.74 0.00 -4.78 1.62 0.23 -1.26 -4.84 115.26 106.98 1kn6 n ASN 39 Ca -0.03 0.00 -0.41 0.00 -0.53 0.00 0.00 54.58 53.61 1kn6 n ASN 39 Cb 0.55 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.25 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 2.68 -0.07 -2.53 2.46 -1.26 0.13 115.29 116.70 1kn6 s HIS 40 Ca 0.00 1.22 -0.06 0.00 0.47 0.00 0.00 55.06 56.69 1kn6 s HIS 40 Cb 0.00 -3.96 0.02 0.00 -0.13 0.00 0.00 32.58 28.51 1kn6 s HIS 40 CO 0.00 -2.77 0.18 0.71 -2.47 0.00 0.00 174.74 170.39 1kn6 s TYR 41 N -1.13 -0.20 -0.00 3.88 1.51 0.19 -3.77 117.35 117.83 1kn6 s TYR 41 Ca 0.52 0.49 -0.01 0.00 -1.01 0.00 0.00 57.07 57.05 1kn6 s TYR 41 Cb -0.45 0.06 -0.00 0.00 -0.11 0.00 0.00 41.96 41.46 1kn6 s TYR 41 CO 0.61 -0.10 0.03 -0.48 -1.11 0.00 0.00 175.55 174.50 1kn6 s LEU 42 N 0.16 1.93 -0.15 -1.29 2.34 -1.12 -0.80 118.68 119.75 1kn6 s LEU 42 Ca -0.01 -0.09 -0.07 0.00 0.06 0.00 0.00 54.13 54.03 1kn6 s LEU 42 Cb -0.02 0.16 -0.04 0.00 -0.56 0.00 0.00 46.19 45.73 1kn6 s LEU 42 CO -0.00 -0.11 0.08 -0.36 -1.06 0.00 0.00 176.35 174.90 1kn6 s PHE 43 N -0.45 3.35 -0.33 3.48 0.40 0.10 0.11 117.98 124.65 1kn6 s PHE 43 Ca -0.05 0.26 0.03 0.00 -0.60 0.00 0.00 56.93 56.56 1kn6 s PHE 43 Cb -0.03 -2.00 0.10 0.00 0.51 0.00 0.00 43.02 41.60 1kn6 s PHE 43 CO -0.00 0.39 0.06 0.15 0.70 0.00 0.00 175.22 176.52 1kn6 s LYS 44 N -0.25 1.27 -0.23 0.44 3.01 0.39 -1.63 119.74 122.75 1kn6 s LYS 44 Ca 0.09 -1.62 -0.07 0.00 -1.01 0.00 0.00 55.97 53.35 1kn6 s LYS 44 Cb -0.12 -2.84 0.10 0.00 -1.01 0.00 0.00 37.83 33.96 1kn6 s LYS 44 CO 0.01 -0.94 0.47 -1.58 0.51 0.00 0.00 175.35 173.82 1kn6 s HIS 45 N 1.12 -0.94 0.00 3.18 2.46 -1.26 -2.66 115.29 117.18 1kn6 s HIS 45 Ca 0.10 1.70 0.16 0.00 0.47 0.00 0.00 55.06 57.49 1kn6 s HIS 45 Cb -0.18 0.42 0.26 0.00 -0.13 0.00 0.00 32.58 32.95 1kn6 s HIS 45 CO -0.13 -0.54 1.08 1.63 -2.47 0.00 0.00 174.74 174.31 1kn6 n LYS 46 N 5.40 0.00 0.21 2.88 5.02 -1.26 -4.90 118.16 125.52 1kn6 n LYS 46 Ca -0.09 -1.57 0.17 0.00 -2.02 0.00 0.00 58.31 54.81 1kn6 n LYS 46 Cb 0.49 0.05 0.84 0.00 -0.02 0.00 0.00 35.03 36.39 1kn6 n LYS 46 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1kn6 h SER 47 N 0.61 0.00 0.00 4.39 0.87 -1.97 -3.18 113.55 114.27 1kn6 h SER 47 Ca -0.26 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 1kn6 h SER 47 Cb 1.69 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.65 1kn6 h SER 47 CO -0.00 0.00 -0.38 0.00 -0.53 0.00 0.00 176.83 175.91 1kn6 n HIS 48 N -3.77 0.58 -1.38 2.24 -0.00 -1.26 -5.01 115.22 106.63 1kn6 n HIS 48 Ca 0.01 0.25 -0.22 0.00 -0.00 0.00 0.00 57.72 57.77 1kn6 n HIS 48 Cb 0.31 -0.58 0.16 0.00 -0.00 0.00 0.00 29.99 29.88 1kn6 n HIS 48 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1kn6 n PRO 49 N -3.88 -1.57 -2.19 -1.40 -0.04 -1.20 -5.04 135.00 119.68 1kn6 n PRO 49 Ca -0.05 -1.42 -0.01 0.00 -0.04 0.00 0.00 63.50 61.98 1kn6 n PRO 49 Cb 0.20 -1.08 0.04 0.00 -0.04 0.00 0.00 33.50 32.63 1kn6 n PRO 49 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1kn6 n ARG 50 N -3.40 0.97 -2.16 0.54 0.63 -1.26 -4.88 116.66 107.10 1kn6 n ARG 50 Ca 0.12 -2.16 -0.05 0.00 -0.92 0.00 0.00 57.85 54.85 1kn6 n ARG 50 Cb 0.42 -0.37 0.02 0.00 0.45 0.00 0.00 32.46 32.99 1kn6 n ARG 50 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1kn6 n ARG 51 N -0.51 -0.79 0.00 -0.14 1.74 -1.26 -4.73 116.66 110.97 1kn6 n ARG 51 Ca -0.06 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.47 1kn6 n ARG 51 Cb 0.88 -3.16 0.00 0.00 -1.02 0.00 0.00 32.46 29.16 1kn6 n ARG 51 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1kn6 n SER 52 N -1.98 0.00 -4.55 0.55 3.41 -1.24 -3.01 113.62 106.79 1kn6 n SER 52 Ca -0.02 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.28 1kn6 n SER 52 Cb 0.54 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.44 1kn6 n SER 52 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1kn6 n ARG 53 N 0.00 0.89 -0.93 4.33 3.00 -1.26 -4.71 116.66 117.97 1kn6 n ARG 53 Ca 0.00 -0.20 0.13 0.00 -0.00 0.00 0.00 57.85 57.78 1kn6 n ARG 53 Cb 0.00 -3.42 -0.03 0.00 0.00 0.00 0.00 32.46 29.01 1kn6 n ARG 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1kn6 n ARG 54 N 8.91 -1.88 -3.44 -0.14 1.74 -1.26 -4.51 116.66 116.09 1kn6 n ARG 54 Ca 0.41 1.24 -0.16 0.00 -0.77 0.00 0.00 57.85 58.56 1kn6 n ARG 54 Cb 0.50 -2.29 -0.04 0.00 -1.02 0.00 0.00 32.46 29.61 1kn6 n ARG 54 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1kn6 n SER 55 N -4.28 1.94 -3.08 0.55 7.64 -1.26 -4.91 113.62 110.22 1kn6 n SER 55 Ca 0.01 -2.25 0.00 0.00 1.01 0.00 0.00 58.87 57.64 1kn6 n SER 55 Cb 0.43 0.40 0.00 0.00 -1.01 0.00 0.00 64.21 64.02 1kn6 n SER 55 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1kn6 n ALA 56 N -1.99 0.00 0.01 -0.43 0.00 -1.26 -4.99 120.51 111.84 1kn6 n ALA 56 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1kn6 n ALA 56 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 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 0.00 -0.13 0.22 0.00 -0.00 -1.26 -4.93 117.00 110.90 1kn6 n LEU 57 Ca 0.00 0.15 0.15 0.00 -0.00 0.00 0.00 56.01 56.31 1kn6 n LEU 57 Cb 0.00 0.28 0.75 0.00 -0.00 0.00 0.00 43.42 44.44 1kn6 n LEU 57 CO 0.00 -0.03 0.95 1.12 -0.00 0.00 0.00 177.39 179.43 1kn6 h HIS 58 N 0.00 0.00 -0.37 1.47 2.07 -1.96 0.14 115.15 116.50 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 -2.57 0.49 -1.31 6.12 3.06 -1.26 -3.94 119.36 119.95 1kn6 n ILE 59 Ca -0.01 -0.57 -0.18 0.00 -2.50 0.00 0.00 62.75 59.49 1kn6 n ILE 59 Cb 0.12 0.44 0.18 0.00 0.54 0.00 0.00 39.64 40.92 1kn6 n ILE 59 CO 0.00 0.00 0.00 0.41 -2.50 0.00 0.00 176.55 174.46 1kn6 n THR 60 N 0.83 3.02 0.00 9.51 -1.04 0.50 -3.99 114.28 123.11 1kn6 n THR 60 Ca 0.17 -2.24 0.00 0.00 -2.04 0.00 0.00 64.05 59.93 1kn6 n THR 60 Cb 0.41 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.47 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 -1.13 0.00 0.29 -2.82 -0.00 -1.25 -4.79 118.16 108.45 1kn6 n LYS 61 Ca 0.52 0.00 0.16 0.00 -0.00 0.00 0.00 58.31 58.99 1kn6 n LYS 61 Cb 1.44 0.00 0.85 0.00 -0.00 0.00 0.00 35.03 37.32 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 0.00 0.00 0.46 -1.58 2.47 -1.84 0.63 114.38 114.52 1kn6 h ARG 62 Ca 0.00 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 1kn6 h ARG 62 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1kn6 h ARG 62 CO 0.00 0.06 -0.22 1.25 0.56 0.00 0.00 179.97 181.62 1kn6 h LEU 63 N 0.00 -0.52 -0.84 3.04 7.12 -1.87 0.25 115.31 122.50 1kn6 h LEU 63 Ca -0.00 -0.07 -0.12 0.00 0.13 0.00 0.00 57.88 57.82 1kn6 h LEU 63 Cb 0.29 0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.54 1kn6 h LEU 63 CO 0.01 -0.23 -0.50 0.77 -0.13 0.00 0.00 178.44 178.36 1kn6 h SER 64 N -0.81 0.23 -0.42 1.25 4.64 -1.73 0.40 113.55 117.11 1kn6 h SER 64 Ca -0.06 -0.11 0.02 0.00 -0.47 0.00 0.00 61.79 61.16 1kn6 h SER 64 Cb 0.56 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.56 1kn6 h SER 64 CO 0.10 0.69 0.25 -0.78 -0.87 0.00 0.00 176.83 176.22 1kn6 h ASP 65 N 0.17 0.41 1.73 4.97 1.82 -0.70 -1.69 116.42 123.13 1kn6 h ASP 65 Ca 0.01 0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.61 1kn6 h ASP 65 Cb 0.94 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 40.85 1kn6 h ASP 65 CO 0.08 0.30 -0.27 -0.78 -1.61 0.00 0.00 179.24 176.95 1kn6 h ASP 66 N 0.51 0.00 0.00 2.28 3.58 -0.30 -3.23 116.42 119.26 1kn6 h ASP 66 Ca 0.16 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.61 1kn6 h ASP 66 Cb -0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1kn6 h ASP 66 CO -0.07 0.17 0.16 -0.78 -2.88 0.00 0.00 179.24 175.84 1kn6 h ASP 67 N 0.00 0.00 -1.08 2.28 3.58 0.78 -2.23 116.42 119.75 1kn6 h ASP 67 Ca -0.01 0.00 0.31 0.00 0.42 0.00 0.00 57.03 57.76 1kn6 h ASP 67 Cb 1.13 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.14 1kn6 h ASP 67 CO 0.02 0.00 0.91 0.03 -2.88 0.00 0.00 179.24 177.32 1kn6 h ARG 68 N 0.00 0.00 -0.76 0.28 2.47 -1.56 -0.96 114.38 113.85 1kn6 h ARG 68 Ca 0.00 0.00 0.10 0.00 -1.26 0.00 0.00 59.98 58.82 1kn6 h ARG 68 Cb 0.33 0.00 -0.12 0.00 -1.65 0.00 0.00 29.97 28.53 1kn6 h ARG 68 CO 0.00 0.00 -0.48 -0.39 0.56 0.00 0.00 179.97 179.66 1kn6 h VAL 69 N 0.00 0.04 0.00 2.04 -1.51 -1.71 -3.45 116.25 111.66 1kn6 h VAL 69 Ca 0.51 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.98 1kn6 h VAL 69 Cb 2.33 0.04 0.00 0.00 -2.13 0.00 0.00 31.29 31.53 1kn6 h VAL 69 CO -0.01 0.00 0.00 0.41 -1.23 0.00 0.00 177.57 176.74 1kn6 n THR 70 N -5.38 0.00 -3.79 7.19 -1.04 -0.37 -4.74 114.28 106.16 1kn6 n THR 70 Ca 0.03 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.92 1kn6 n THR 70 Cb 0.34 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.76 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 -0.07 -0.18 -1.42 1.48 -1.23 -5.07 118.94 112.08 1kn6 s TRP 71 Ca 0.00 -0.01 -0.06 0.00 -1.06 0.00 0.00 56.10 54.98 1kn6 s TRP 71 Cb 0.00 0.05 0.08 0.00 -1.16 0.00 0.00 33.47 32.44 1kn6 s TRP 71 CO 0.00 -0.42 0.36 0.00 -4.06 0.00 0.00 176.95 172.83 1kn6 s ALA 72 N -1.99 -0.94 -0.05 2.67 0.00 -1.26 -3.14 121.76 117.04 1kn6 s ALA 72 Ca -0.09 1.27 -0.03 0.00 0.00 0.00 0.00 51.96 53.11 1kn6 s ALA 72 Cb -0.03 -1.24 0.03 0.00 0.00 0.00 0.00 23.12 21.88 1kn6 s ALA 72 CO -0.00 -0.75 0.12 -2.00 0.00 0.00 0.00 175.76 173.13 1kn6 s GLU 73 N 2.54 0.08 -0.01 0.00 2.56 -1.21 -4.99 118.70 117.66 1kn6 s GLU 73 Ca 0.00 0.30 -0.19 0.00 0.00 0.00 0.00 54.97 55.08 1kn6 s GLU 73 Cb -0.12 -0.15 -0.05 0.00 2.00 0.00 0.00 34.13 35.81 1kn6 s GLU 73 CO -0.11 -0.14 0.55 -0.65 -0.56 0.00 0.00 175.26 174.34 1kn6 s GLN 74 N 0.95 4.26 -0.06 4.30 -0.21 -1.26 -2.86 119.66 124.77 1kn6 s GLN 74 Ca -0.07 0.64 0.03 0.00 0.02 0.00 0.00 55.36 55.98 1kn6 s GLN 74 Cb -0.10 -3.33 0.01 0.00 1.00 0.00 0.00 33.01 30.59 1kn6 s GLN 74 CO -0.04 0.40 -0.14 -0.65 -2.12 0.00 0.00 175.29 172.74 1kn6 s GLN 75 N -0.26 1.77 0.00 2.91 -0.21 -1.17 -4.98 119.66 117.72 1kn6 s GLN 75 Ca 0.29 -0.48 0.25 0.00 0.02 0.00 0.00 55.36 55.44 1kn6 s GLN 75 Cb -0.18 -1.47 0.48 0.00 1.00 0.00 0.00 33.01 32.84 1kn6 s GLN 75 CO 0.16 0.09 1.42 0.66 -2.12 0.00 0.00 175.29 175.50