#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ken s GLU 2 N 0.00 3.61 0.72 0.03 1.03 -1.26 -5.07 118.70 117.76 2ken s GLU 2 Ca 0.00 0.04 -0.13 0.00 0.03 0.00 0.00 54.97 54.91 2ken s GLU 2 Cb 0.00 -2.57 0.03 0.00 -0.80 0.00 0.00 34.13 30.79 2ken s GLU 2 CO 0.00 0.11 1.11 -1.25 -1.33 0.00 0.00 175.26 173.89 2ken s PRO 3 N -3.91 2.46 -0.28 -4.83 0.04 -1.26 -4.97 135.00 122.24 2ken s PRO 3 Ca 0.45 1.32 -0.28 0.00 0.04 0.00 0.00 61.00 62.53 2ken s PRO 3 Cb -0.10 -1.91 0.01 0.00 0.04 0.00 0.00 34.50 32.54 2ken s PRO 3 CO 0.33 -1.51 0.99 -1.14 0.04 0.00 0.00 177.00 175.72 2ken s GLN 4 N -4.45 4.12 -0.10 4.56 0.74 -1.26 -4.97 119.66 118.30 2ken s GLN 4 Ca 0.65 1.07 -0.22 0.00 0.05 0.00 0.00 55.36 56.90 2ken s GLN 4 Cb -0.20 -3.70 -0.03 0.00 1.10 0.00 0.00 33.01 30.18 2ken s GLN 4 CO 0.49 -0.75 0.66 -0.51 -0.55 0.00 0.00 175.29 174.63 2ken s LEU 5 N 3.33 4.28 0.05 3.68 2.01 -1.26 -1.65 118.68 129.11 2ken s LEU 5 Ca 0.42 1.07 0.07 0.00 0.01 0.00 0.00 54.13 55.70 2ken s LEU 5 Cb -0.14 -2.99 -0.03 0.00 0.01 0.00 0.00 46.19 43.04 2ken s LEU 5 CO 0.11 -0.13 -0.20 -0.89 1.01 0.00 0.00 176.35 176.24 2ken s THR 6 N 1.01 1.65 -0.03 5.49 2.01 -1.07 -4.96 115.64 119.74 2ken s THR 6 Ca 0.34 -1.24 -0.08 0.00 0.31 0.00 0.00 61.69 61.02 2ken s THR 6 Cb -0.17 -1.44 -0.05 0.00 0.01 0.00 0.00 72.50 70.85 2ken s THR 6 CO 0.15 0.16 0.26 -0.54 -0.69 0.00 0.00 174.62 173.96 2ken s LYS 7 N -1.28 3.60 0.31 4.92 3.01 -1.26 -4.78 119.74 124.26 2ken s LYS 7 Ca 0.07 -0.01 0.05 0.00 -1.01 0.00 0.00 55.97 55.07 2ken s LYS 7 Cb -0.09 -3.13 0.69 0.00 -1.01 0.00 0.00 37.83 34.29 2ken s LYS 7 CO 0.02 0.69 1.81 -0.84 0.51 0.00 0.00 175.35 177.54 2ken h ILE 8 N 3.38 0.81 0.00 2.17 3.07 -1.97 0.76 117.51 125.73 2ken h ILE 8 Ca -0.52 -0.29 0.00 0.00 1.55 0.00 0.00 64.86 65.61 2ken h ILE 8 Cb 1.21 -0.10 0.00 0.00 -0.27 0.00 0.00 36.82 37.66 2ken h ILE 8 CO 0.63 0.15 0.00 0.55 -1.05 0.00 0.00 178.15 178.44 2ken n VAL 9 N -4.67 0.88 0.53 0.16 3.14 -1.26 -1.86 118.33 115.25 2ken n VAL 9 Ca 0.21 0.22 0.11 0.00 -2.96 0.00 0.00 64.34 61.92 2ken n VAL 9 Cb 0.48 -1.04 0.25 0.00 -1.06 0.00 0.00 33.84 32.47 2ken n VAL 9 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2ken n ASP 10 N -1.85 3.02 -4.66 6.55 2.03 0.26 -4.89 116.55 117.01 2ken n ASP 10 Ca 0.03 -1.93 -0.40 0.00 0.52 0.00 0.00 54.79 53.01 2ken n ASP 10 Cb 0.21 -0.22 -0.05 0.00 -0.72 0.00 0.00 41.12 40.33 2ken n ASP 10 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2ken s ILE 11 N -1.56 4.99 0.00 5.18 1.01 -0.77 -4.84 121.20 125.21 2ken s ILE 11 Ca 0.37 1.30 0.00 0.00 0.00 0.00 0.00 60.65 62.32 2ken s ILE 11 Cb 0.21 -3.99 0.00 0.00 0.01 0.00 0.00 42.46 38.69 2ken s ILE 11 CO 0.30 0.10 0.25 1.33 0.00 0.00 0.00 174.94 176.91 2ken n VAL 12 N 4.66 0.00 -4.00 2.92 0.24 -1.26 -5.08 118.33 115.82 2ken n VAL 12 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.14 2ken n VAL 12 Cb 0.50 0.67 -0.15 0.00 -1.47 0.00 0.00 33.84 33.38 2ken n VAL 12 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2ken s GLU 13 N 0.00 0.32 0.27 7.34 2.12 -1.26 -5.15 118.70 122.33 2ken s GLU 13 Ca 0.00 -0.02 -0.05 0.00 0.36 0.00 0.00 54.97 55.26 2ken s GLU 13 Cb 0.00 -0.40 -0.05 0.00 0.26 0.00 0.00 34.13 33.94 2ken s GLU 13 CO 0.00 -0.04 0.53 -0.80 -0.54 0.00 0.00 175.26 174.41 2ken s ASN 14 N 0.52 6.47 0.00 -1.70 -0.87 -1.26 -4.17 114.94 113.92 2ken s ASN 14 Ca -0.05 0.71 0.00 0.00 -1.57 0.00 0.00 52.86 51.95 2ken s ASN 14 Cb -0.08 -2.14 0.00 0.00 -0.02 0.00 0.00 41.25 39.01 2ken s ASN 14 CO -0.01 -0.15 0.00 0.61 -2.57 0.00 0.00 177.10 174.98 2ken n GLY 15 N -0.75 0.50 3.88 0.66 0.00 -0.37 -4.96 105.19 104.16 2ken n GLY 15 Ca -0.02 -0.60 -0.33 0.00 0.00 0.00 0.00 46.02 45.07 2ken n GLY 15 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ken s GLN 16 N -1.13 3.65 -0.15 1.61 0.74 -1.26 -4.84 119.66 118.27 2ken s GLN 16 Ca 0.00 -0.01 -0.05 0.00 0.05 0.00 0.00 55.36 55.35 2ken s GLN 16 Cb 0.00 -2.97 -0.03 0.00 1.10 0.00 0.00 33.01 31.11 2ken s GLN 16 CO 0.00 0.55 0.01 -1.58 -0.55 0.00 0.00 175.29 173.72 2ken s TRP 17 N -1.47 3.14 0.19 1.67 0.52 -1.26 -2.49 118.94 119.25 2ken s TRP 17 Ca 0.34 -0.05 -0.08 0.00 0.02 0.00 0.00 56.10 56.34 2ken s TRP 17 Cb -0.13 -1.96 0.03 0.00 -1.15 0.00 0.00 33.47 30.27 2ken s TRP 17 CO 0.20 0.16 0.43 0.00 0.02 0.00 0.00 176.95 177.76 2ken n ALA 18 N 3.18 -0.99 -2.33 0.98 0.00 -1.07 -4.98 120.51 115.31 2ken n ALA 18 Ca -0.17 -0.64 -0.31 0.00 0.00 0.00 0.00 53.44 52.31 2ken n ALA 18 Cb 0.53 0.50 -0.16 0.00 0.00 0.00 0.00 19.45 20.32 2ken n ALA 18 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2ken s ASN 19 N -2.10 3.15 0.05 0.00 2.47 -0.66 -2.29 114.94 115.56 2ken s ASN 19 Ca 0.09 -0.46 0.03 0.00 0.42 0.00 0.00 52.86 52.94 2ken s ASN 19 Cb -0.02 -0.38 -0.02 0.00 -1.45 0.00 0.00 41.25 39.37 2ken s ASN 19 CO 0.06 0.31 -0.10 -0.76 -3.72 0.00 0.00 177.10 172.89 2ken s LEU 20 N -0.70 2.24 -0.06 3.21 1.43 -0.69 -2.60 118.68 121.52 2ken s LEU 20 Ca 0.10 -0.54 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 2ken s LEU 20 Cb -0.10 -0.33 0.02 0.00 0.03 0.00 0.00 46.19 45.81 2ken s LEU 20 CO -0.00 -0.12 -0.05 -0.75 0.23 0.00 0.00 176.35 175.65 2ken s LYS 21 N -1.51 1.02 0.35 1.70 2.20 -1.26 -1.48 119.74 120.75 2ken s LYS 21 Ca -0.06 -0.14 -0.17 0.00 -0.36 0.00 0.00 55.97 55.24 2ken s LYS 21 Cb -0.09 -1.03 0.05 0.00 -1.51 0.00 0.00 37.83 35.25 2ken s LYS 21 CO 0.01 -0.11 0.81 0.00 -0.36 0.00 0.00 175.35 175.70 2ken s ALA 22 N 1.10 -0.91 0.14 3.13 0.00 -1.12 -4.90 121.76 119.21 2ken s ALA 22 Ca -0.08 -0.64 0.06 0.00 0.00 0.00 0.00 51.96 51.31 2ken s ALA 22 Cb -0.14 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.64 2ken s ALA 22 CO -0.01 -1.00 0.03 0.21 0.00 0.00 0.00 175.76 174.98 2ken s LYS 23 N -2.52 2.55 -0.65 0.00 2.20 -1.08 -1.95 119.74 118.29 2ken s LYS 23 Ca 0.15 -0.97 -0.21 0.00 -0.36 0.00 0.00 55.97 54.58 2ken s LYS 23 Cb -0.05 -2.47 0.08 0.00 -1.51 0.00 0.00 37.83 33.88 2ken s LYS 23 CO 0.10 0.49 0.90 0.08 -0.36 0.00 0.00 175.35 176.56 2ken s VAL 24 N -1.59 4.48 -0.08 4.02 1.01 -1.11 0.63 120.40 127.75 2ken s VAL 24 Ca 0.28 -0.59 0.14 0.00 0.00 0.00 0.00 61.98 61.80 2ken s VAL 24 Cb -0.10 -4.64 0.01 0.00 0.00 0.00 0.00 36.38 31.66 2ken s VAL 24 CO 0.19 -1.37 1.43 0.16 0.00 0.00 0.00 175.10 175.51 2ken h ILE 25 N 5.95 1.04 -2.16 2.22 3.07 -1.90 -2.33 117.51 123.40 2ken h ILE 25 Ca -0.27 -2.42 -0.07 0.00 1.55 0.00 0.00 64.86 63.65 2ken h ILE 25 Cb 1.07 2.48 -0.20 0.00 -0.27 0.00 0.00 36.82 39.91 2ken h ILE 25 CO 1.16 0.58 0.10 -1.58 -1.05 0.00 0.00 178.15 177.36 2ken s GLN 26 N -2.95 0.94 0.12 0.16 2.00 -1.25 -4.87 119.66 113.80 2ken s GLN 26 Ca 0.03 0.38 0.03 0.00 -2.00 0.00 0.00 55.36 53.80 2ken s GLN 26 Cb 0.08 0.44 -0.04 0.00 0.80 0.00 0.00 33.01 34.30 2ken s GLN 26 CO 0.76 -0.25 -0.09 -0.48 -0.50 0.00 0.00 175.29 174.73 2ken s LEU 27 N -0.81 2.49 -0.19 3.68 2.34 -1.26 -2.41 118.68 122.51 2ken s LEU 27 Ca -0.08 -0.96 -0.04 0.00 0.06 0.00 0.00 54.13 53.10 2ken s LEU 27 Cb -0.02 -0.23 0.08 0.00 -0.56 0.00 0.00 46.19 45.46 2ken s LEU 27 CO 0.07 -0.36 0.15 0.86 -1.06 0.00 0.00 176.35 176.01 2ken s TRP 28 N -3.21 -0.02 -0.00 3.48 -0.11 0.18 -4.92 118.94 114.35 2ken s TRP 28 Ca 0.12 -0.10 -0.30 0.00 1.22 0.00 0.00 56.10 57.03 2ken s TRP 28 Cb 0.02 -0.55 -0.06 0.00 -1.50 0.00 0.00 33.47 31.38 2ken s TRP 28 CO -0.02 -0.58 1.53 -2.00 -4.62 0.00 0.00 176.95 171.27 2ken s GLU 29 N 2.22 4.23 -0.06 5.86 2.12 -1.26 -1.35 118.70 130.46 2ken s GLU 29 Ca 0.05 2.11 -0.00 0.00 0.36 0.00 0.00 54.97 57.48 2ken s GLU 29 Cb -0.16 -3.69 0.03 0.00 0.26 0.00 0.00 34.13 30.57 2ken s GLU 29 CO -0.12 -0.69 -0.02 1.21 -0.54 0.00 0.00 175.26 175.10 2ken s ASN 30 N 2.39 1.39 -0.03 -1.70 2.47 -1.06 -4.93 114.94 113.47 2ken s ASN 30 Ca 0.69 -0.11 0.12 0.00 0.42 0.00 0.00 52.86 53.97 2ken s ASN 30 Cb -0.34 -0.46 0.21 0.00 -1.45 0.00 0.00 41.25 39.20 2ken s ASN 30 CO 0.28 -0.14 1.09 0.35 -3.72 0.00 0.00 177.10 174.96 2ken n THR 31 N 4.75 0.33 0.00 -5.21 -2.24 -1.24 -3.60 114.28 107.08 2ken n THR 31 Ca -0.14 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 60.85 2ken n THR 31 Cb 0.50 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 2ken n THR 31 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2ken n HIS 32 N -0.04 0.00 0.00 4.78 -0.00 -1.26 -4.85 115.22 113.85 2ken n HIS 32 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.77 2ken n HIS 32 Cb 0.85 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.84 2ken n HIS 32 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 2ken n GLU 33 N -0.16 0.00 -0.09 1.57 2.13 -1.26 -4.85 120.64 117.98 2ken n GLU 33 Ca 0.00 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.85 2ken n GLU 33 Cb 0.00 0.00 0.08 0.00 0.27 0.00 0.00 31.44 31.79 2ken n GLU 33 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2ken n SER 34 N 0.00 2.45 -4.73 4.31 7.64 -1.26 -5.01 113.62 117.03 2ken n SER 34 Ca 0.00 -2.09 -0.41 0.00 1.01 0.00 0.00 58.87 57.38 2ken n SER 34 Cb 0.00 -0.13 -0.04 0.00 -1.01 0.00 0.00 64.21 63.03 2ken n SER 34 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2ken s ILE 35 N -1.16 4.66 -0.14 0.44 1.01 -1.26 -2.97 121.20 121.79 2ken s ILE 35 Ca 0.12 1.96 -0.10 0.00 0.00 0.00 0.00 60.65 62.63 2ken s ILE 35 Cb 0.07 -4.27 -0.07 0.00 0.01 0.00 0.00 42.46 38.20 2ken s ILE 35 CO 0.07 0.28 0.03 -1.28 0.00 0.00 0.00 174.94 174.03 2ken h SER 36 N 5.98 0.00 -5.05 3.58 0.87 -0.96 -3.30 113.55 114.67 2ken h SER 36 Ca -0.42 -0.18 -0.09 0.00 -1.23 0.00 0.00 61.79 59.87 2ken h SER 36 Cb 1.21 0.00 -0.17 0.00 -0.44 0.00 0.00 62.40 63.01 2ken h SER 36 CO 0.73 0.83 -0.18 -1.58 -0.53 0.00 0.00 176.83 176.09 2ken s GLN 37 N -2.06 0.86 -0.00 2.24 0.74 -1.16 -2.58 119.66 117.71 2ken s GLN 37 Ca -0.13 -0.45 0.00 0.00 0.05 0.00 0.00 55.36 54.83 2ken s GLN 37 Cb 0.02 0.38 0.00 0.00 1.10 0.00 0.00 33.01 34.51 2ken s GLN 37 CO 0.26 -0.29 -0.01 0.08 -0.55 0.00 0.00 175.29 174.79 2ken s VAL 38 N -2.55 0.06 0.00 1.34 1.01 -0.46 -1.80 120.40 118.01 2ken s VAL 38 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.90 2ken s VAL 38 Cb -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 36.38 36.30 2ken s VAL 38 CO -0.03 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.70 2ken n GLY 39 N 3.10 2.14 3.10 4.51 0.00 -1.06 0.50 105.19 117.48 2ken n GLY 39 Ca -0.13 -0.56 -0.13 0.00 0.00 0.00 0.00 46.02 45.20 2ken n GLY 39 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ken s LEU 40 N 0.00 2.32 -0.13 0.99 1.02 -1.01 -2.24 118.68 119.62 2ken s LEU 40 Ca 0.00 -0.66 -0.02 0.00 0.02 0.00 0.00 54.13 53.47 2ken s LEU 40 Cb 0.00 -0.20 -0.02 0.00 0.02 0.00 0.00 46.19 45.98 2ken s LEU 40 CO 0.00 -0.24 -0.07 -0.76 0.02 0.00 0.00 176.35 175.30 2ken s LEU 41 N -1.93 3.08 -0.64 1.79 1.43 0.53 -3.56 118.68 119.39 2ken s LEU 41 Ca -0.04 -0.17 -0.20 0.00 -1.03 0.00 0.00 54.13 52.69 2ken s LEU 41 Cb -0.07 -1.72 0.10 0.00 0.03 0.00 0.00 46.19 44.53 2ken s LEU 41 CO -0.00 0.20 0.82 -0.83 0.23 0.00 0.00 176.35 176.77 2ken s GLY 42 N 0.16 1.67 0.25 -3.19 0.00 0.21 -2.55 107.32 103.87 2ken s GLY 42 Ca -0.03 -2.16 0.05 0.00 0.00 0.00 0.00 44.72 42.58 2ken s GLY 42 CO 0.03 1.76 0.37 0.99 0.00 0.00 0.00 173.10 176.25 2ken s ASP 43 N 3.62 6.22 0.37 1.64 1.11 0.47 -2.62 116.67 127.49 2ken s ASP 43 Ca 0.16 0.01 0.27 0.00 0.18 0.00 0.00 52.55 53.18 2ken s ASP 43 Cb -0.20 -1.74 1.13 0.00 1.07 0.00 0.00 42.92 43.18 2ken s ASP 43 CO 0.06 -0.12 1.82 1.05 1.18 0.00 0.00 175.17 179.16 2ken h GLU 44 N 1.15 0.00 0.00 8.23 4.11 -1.91 -2.43 114.58 123.73 2ken h GLU 44 Ca -0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.92 2ken h GLU 44 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2ken h GLU 44 CO 0.60 0.00 -0.97 0.25 0.07 0.00 0.00 179.01 178.95 2ken n THR 45 N -2.55 0.04 0.00 -1.06 -2.24 -1.26 -5.06 114.28 102.14 2ken n THR 45 Ca 0.02 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2ken n THR 45 Cb 0.26 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 2ken n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ken n GLY 46 N 1.45 -0.28 3.26 3.38 0.00 -0.92 -4.82 105.19 107.27 2ken n GLY 46 Ca 0.03 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 45.04 2ken n GLY 46 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ken s ILE 47 N -4.00 0.96 -0.07 -0.61 -5.25 -1.26 -0.39 121.20 110.58 2ken s ILE 47 Ca 0.00 -2.02 -0.25 0.00 -0.99 0.00 0.00 60.65 57.39 2ken s ILE 47 Cb 0.00 -2.01 0.06 0.00 2.95 0.00 0.00 42.46 43.46 2ken s ILE 47 CO 0.00 -0.60 0.57 -0.51 -1.79 0.00 0.00 174.94 172.61 2ken s ILE 48 N -3.47 0.02 0.67 8.37 1.10 -1.06 -4.95 121.20 121.88 2ken s ILE 48 Ca 0.21 -0.13 -0.10 0.00 -0.51 0.00 0.00 60.65 60.12 2ken s ILE 48 Cb 0.04 -0.87 0.01 0.00 0.15 0.00 0.00 42.46 41.79 2ken s ILE 48 CO 0.03 -0.07 1.04 -0.54 -2.11 0.00 0.00 174.94 173.29 2ken s LYS 49 N -1.00 2.94 -0.08 3.50 1.02 -1.26 -0.34 119.74 124.52 2ken s LYS 49 Ca -0.10 0.37 -0.25 0.00 0.02 0.00 0.00 55.97 56.01 2ken s LYS 49 Cb -0.02 -2.09 0.06 0.00 -0.52 0.00 0.00 37.83 35.26 2ken s LYS 49 CO 0.07 -0.91 0.58 -0.59 -0.92 0.00 0.00 175.35 173.58 2ken s PHE 50 N -3.25 -0.55 -0.03 3.18 -0.71 -0.95 -2.83 117.98 112.84 2ken s PHE 50 Ca 0.57 1.03 0.01 0.00 -1.04 0.00 0.00 56.93 57.49 2ken s PHE 50 Cb -0.11 0.30 0.02 0.00 -1.21 0.00 0.00 43.02 42.02 2ken s PHE 50 CO 0.50 -0.50 -0.02 -0.08 -1.34 0.00 0.00 175.22 173.78 2ken s THR 51 N -0.93 0.33 -0.16 -4.49 -1.32 -1.01 -2.58 115.64 105.48 2ken s THR 51 Ca -0.09 -0.04 -0.05 0.00 -1.21 0.00 0.00 61.69 60.30 2ken s THR 51 Cb -0.02 -0.37 -0.03 0.00 -1.51 0.00 0.00 72.50 70.57 2ken s THR 51 CO 0.07 0.16 -0.00 -0.63 -2.21 0.00 0.00 174.62 172.01 2ken s ILE 52 N 0.75 4.23 0.14 5.08 1.01 -0.74 -1.82 121.20 129.84 2ken s ILE 52 Ca -0.08 -0.24 -0.21 0.00 0.00 0.00 0.00 60.65 60.12 2ken s ILE 52 Cb -0.12 -2.87 -0.07 0.00 0.01 0.00 0.00 42.46 39.41 2ken s ILE 52 CO -0.01 0.48 0.67 0.26 0.00 0.00 0.00 174.94 176.35 2ken s TRP 53 N 0.34 3.79 0.39 3.97 0.52 -1.12 -0.68 118.94 126.15 2ken s TRP 53 Ca -0.01 1.40 0.10 0.00 0.02 0.00 0.00 56.10 57.60 2ken s TRP 53 Cb -0.13 -2.60 0.87 0.00 -1.15 0.00 0.00 33.47 30.45 2ken s TRP 53 CO 0.02 0.49 1.96 0.87 0.02 0.00 0.00 176.95 180.31 2ken h LYS 54 N 4.13 0.58 0.00 4.98 1.79 -1.83 0.21 116.57 126.43 2ken h LYS 54 Ca -0.48 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 57.95 2ken h LYS 54 Cb 1.20 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.72 2ken h LYS 54 CO 0.65 0.39 0.01 0.09 -1.08 0.00 0.00 179.45 179.50 2ken n ASN 55 N -4.49 0.00 0.01 0.86 3.02 -1.26 -0.54 115.26 112.86 2ken n ASN 55 Ca 0.11 0.22 -0.10 0.00 -0.03 0.00 0.00 54.58 54.79 2ken n ASN 55 Cb 0.32 -0.22 -0.14 0.00 -0.61 0.00 0.00 39.78 39.13 2ken n ASN 55 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ken h ALA 56 N 1.94 0.62 -6.27 5.41 0.00 -0.89 -3.40 119.26 116.66 2ken h ALA 56 Ca 0.00 -1.31 -0.45 0.00 0.00 0.00 0.00 54.91 53.15 2ken h ALA 56 Cb 0.01 0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.15 2ken h ALA 56 CO 0.00 1.46 -0.86 0.39 0.00 0.00 0.00 179.25 180.24 2ken n GLU 57 N -3.17 -3.96 -4.14 0.00 1.02 0.29 -4.78 120.64 105.90 2ken n GLU 57 Ca -0.14 0.52 -0.28 0.00 -0.02 0.00 0.00 57.16 57.24 2ken n GLU 57 Cb 1.03 -4.83 -0.07 0.00 -0.02 0.00 0.00 31.44 27.54 2ken n GLU 57 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2ken s LEU 58 N -6.78 3.48 0.56 -4.62 1.43 -1.26 -5.09 118.68 106.40 2ken s LEU 58 Ca 0.03 -0.24 -0.20 0.00 -1.03 0.00 0.00 54.13 52.70 2ken s LEU 58 Cb -0.01 -2.17 -0.06 0.00 0.03 0.00 0.00 46.19 43.98 2ken s LEU 58 CO 0.85 0.13 0.94 -2.65 0.23 0.00 0.00 176.35 175.85 2ken n PRO 59 N 0.18 0.98 -2.18 1.29 -0.02 -1.26 -4.93 135.00 129.05 2ken n PRO 59 Ca -0.10 0.37 -0.38 0.00 -2.02 0.00 0.00 63.50 61.37 2ken n PRO 59 Cb 0.53 -2.11 -0.01 0.00 -0.02 0.00 0.00 33.50 31.90 2ken n PRO 59 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2ken s LEU 60 N -1.49 4.11 0.34 2.45 1.43 -1.26 -5.00 118.68 119.27 2ken s LEU 60 Ca 0.72 2.44 -0.25 0.00 -1.03 0.00 0.00 54.13 56.01 2ken s LEU 60 Cb -0.45 -4.08 -0.10 0.00 0.03 0.00 0.00 46.19 41.59 2ken s LEU 60 CO 0.50 -0.87 0.94 -0.76 0.23 0.00 0.00 176.35 176.39 2ken s LEU 61 N -2.73 4.28 -0.16 1.79 1.02 -1.26 -5.05 118.68 116.58 2ken s LEU 61 Ca 0.60 1.80 -0.07 0.00 0.02 0.00 0.00 54.13 56.48 2ken s LEU 61 Cb -0.33 -4.08 -0.04 0.00 0.02 0.00 0.00 46.19 41.76 2ken s LEU 61 CO 0.40 -0.11 0.09 -0.70 0.02 0.00 0.00 176.35 176.06 2ken s GLU 62 N -2.22 3.75 0.25 1.70 2.12 -1.26 -5.07 118.70 117.97 2ken s GLU 62 Ca 0.52 -0.27 -0.30 0.00 0.36 0.00 0.00 54.97 55.28 2ken s GLU 62 Cb -0.17 -3.20 -0.09 0.00 0.26 0.00 0.00 34.13 30.93 2ken s GLU 62 CO 0.22 0.47 1.13 -1.14 -0.54 0.00 0.00 175.26 175.40 2ken s GLN 63 N -0.17 4.59 0.00 4.30 0.74 -1.26 -2.89 119.66 124.97 2ken s GLN 63 Ca 0.09 1.83 0.00 0.00 0.05 0.00 0.00 55.36 57.33 2ken s GLN 63 Cb -0.12 -3.20 0.00 0.00 1.10 0.00 0.00 33.01 30.79 2ken s GLN 63 CO 0.01 0.11 0.00 0.41 -0.55 0.00 0.00 175.29 175.27 2ken n GLY 64 N 1.49 1.20 3.80 2.59 0.00 -0.88 -5.03 105.19 108.36 2ken n GLY 64 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2ken n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ken s GLU 65 N -0.56 2.89 0.21 1.61 0.41 -1.14 -4.92 118.70 117.19 2ken s GLU 65 Ca 0.00 -0.97 -0.14 0.00 -0.41 0.00 0.00 54.97 53.45 2ken s GLU 65 Cb 0.00 -2.59 -0.08 0.00 -1.78 0.00 0.00 34.13 29.68 2ken s GLU 65 CO 0.00 0.44 0.60 -1.54 -0.49 0.00 0.00 175.26 174.28 2ken s SER 66 N -3.45 6.78 0.01 -0.19 1.04 -1.26 -2.75 113.70 113.88 2ken s SER 66 Ca 0.32 1.10 -0.01 0.00 0.48 0.00 0.00 55.95 57.84 2ken s SER 66 Cb -0.09 -2.30 -0.01 0.00 0.10 0.00 0.00 66.02 63.72 2ken s SER 66 CO 0.24 -0.02 0.00 -0.31 0.98 0.00 0.00 173.24 174.13 2ken s TYR 67 N -1.68 0.13 -0.13 5.02 2.02 -0.82 -2.76 117.35 119.13 2ken s TYR 67 Ca 0.44 -0.26 -0.01 0.00 -0.37 0.00 0.00 57.07 56.87 2ken s TYR 67 Cb -0.13 -0.10 -0.02 0.00 -0.40 0.00 0.00 41.96 41.31 2ken s TYR 67 CO 0.20 -0.12 -0.09 -1.17 -1.57 0.00 0.00 175.55 172.80 2ken s LEU 68 N -0.83 2.98 -0.23 -1.29 2.96 0.60 -2.79 118.68 120.08 2ken s LEU 68 Ca -0.09 -0.21 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 2ken s LEU 68 Cb -0.06 -1.69 0.03 0.00 0.50 0.00 0.00 46.19 44.98 2ken s LEU 68 CO -0.00 0.19 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.34 2ken s LEU 69 N 0.21 2.88 0.08 -0.68 1.02 -0.55 -0.83 118.68 120.80 2ken s LEU 69 Ca -0.05 -0.90 0.05 0.00 0.02 0.00 0.00 54.13 53.25 2ken s LEU 69 Cb -0.15 -1.58 -0.04 0.00 0.02 0.00 0.00 46.19 44.45 2ken s LEU 69 CO 0.04 -0.09 -0.02 -0.13 0.02 0.00 0.00 176.35 176.16 2ken s ARG 70 N 1.27 2.49 -1.09 1.70 0.52 -1.08 -1.70 118.95 121.06 2ken s ARG 70 Ca -0.00 -0.84 -0.10 0.00 -0.52 0.00 0.00 55.73 54.26 2ken s ARG 70 Cb -0.16 -2.51 -0.05 0.00 0.52 0.00 0.00 34.95 32.76 2ken s ARG 70 CO -0.07 0.55 0.88 0.43 0.02 0.00 0.00 175.30 177.10 2ken n SER 71 N 0.73 -5.97 -4.73 0.23 7.64 -1.23 -1.95 113.62 108.35 2ken n SER 71 Ca -0.12 -0.81 -0.23 0.00 1.01 0.00 0.00 58.87 58.73 2ken n SER 71 Cb 0.52 -4.61 -0.06 0.00 -1.01 0.00 0.00 64.21 59.05 2ken n SER 71 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2ken s VAL 72 N -3.42 3.42 0.09 0.44 -7.23 -0.97 -3.39 120.40 109.33 2ken s VAL 72 Ca 0.44 -1.70 0.09 0.00 -1.81 0.00 0.00 61.98 59.00 2ken s VAL 72 Cb -0.09 -3.01 -0.03 0.00 0.56 0.00 0.00 36.38 33.80 2ken s VAL 72 CO 0.78 -0.27 -0.23 0.54 -0.31 0.00 0.00 175.10 175.61 2ken s VAL 73 N -2.34 1.87 -0.13 1.32 0.11 -1.25 -2.59 120.40 117.39 2ken s VAL 73 Ca 0.35 -1.48 -0.21 0.00 -2.93 0.00 0.00 61.98 57.71 2ken s VAL 73 Cb -0.05 -1.66 -0.03 0.00 -1.53 0.00 0.00 36.38 33.11 2ken s VAL 73 CO 0.22 0.09 0.60 -0.69 -3.33 0.00 0.00 175.10 171.99 2ken s VAL 74 N -1.00 5.09 0.21 2.04 1.01 -1.04 -2.20 120.40 124.51 2ken s VAL 74 Ca 0.09 1.18 0.08 0.00 0.00 0.00 0.00 61.98 63.32 2ken s VAL 74 Cb -0.10 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 2ken s VAL 74 CO 0.04 0.23 0.04 -0.83 0.00 0.00 0.00 175.10 174.58 2ken s GLY 75 N 0.87 1.66 -0.14 4.51 0.00 0.03 -1.23 107.32 113.02 2ken s GLY 75 Ca 0.30 -1.43 -0.05 0.00 0.00 0.00 0.00 44.72 43.54 2ken s GLY 75 CO 0.13 -1.47 0.03 1.85 0.00 0.00 0.00 173.10 173.64 2ken s GLU 76 N -3.27 3.52 -0.14 2.90 2.56 -1.26 -2.59 118.70 120.42 2ken s GLU 76 Ca 0.29 -0.38 -0.00 0.00 0.00 0.00 0.00 54.97 54.88 2ken s GLU 76 Cb -0.08 -3.00 0.03 0.00 2.00 0.00 0.00 34.13 33.08 2ken s GLU 76 CO 0.20 0.46 -0.07 -0.47 -0.56 0.00 0.00 175.26 174.83 2ken s TYR 77 N -0.20 1.57 0.00 5.30 5.04 -0.74 -4.97 117.35 123.36 2ken s TYR 77 Ca 0.06 -0.89 0.00 0.00 -2.44 0.00 0.00 57.07 53.81 2ken s TYR 77 Cb -0.12 -1.27 0.00 0.00 0.35 0.00 0.00 41.96 40.92 2ken s TYR 77 CO 0.02 -0.56 0.00 0.09 -1.34 0.00 0.00 175.55 173.76 2ken n ASN 78 N 4.92 0.00 0.00 4.32 3.02 -1.26 -0.05 115.26 126.21 2ken n ASN 78 Ca -0.12 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 2ken n ASN 78 Cb 0.49 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 2ken n ASN 78 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2ken n ASP 79 N 1.39 2.84 -4.91 6.41 5.75 -1.26 -5.05 116.55 121.71 2ken n ASP 79 Ca 0.00 -0.09 -0.28 0.00 -0.01 0.00 0.00 54.79 54.41 2ken n ASP 79 Cb 0.00 0.75 -0.03 0.00 -1.03 0.00 0.00 41.12 40.81 2ken n ASP 79 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2ken s ARG 80 N -1.31 3.59 0.05 0.11 0.52 0.93 -5.09 118.95 117.74 2ken s ARG 80 Ca 0.00 -0.10 0.00 0.00 -0.52 0.00 0.00 55.73 55.12 2ken s ARG 80 Cb 0.00 -2.68 -0.04 0.00 0.52 0.00 0.00 34.95 32.75 2ken s ARG 80 CO 0.00 0.23 0.16 -0.06 0.02 0.00 0.00 175.30 175.65 2ken s PHE 81 N -2.09 3.42 0.13 -0.53 0.40 -1.26 -1.79 117.98 116.26 2ken s PHE 81 Ca 0.42 0.22 -0.14 0.00 -0.60 0.00 0.00 56.93 56.83 2ken s PHE 81 Cb -0.11 -1.73 0.02 0.00 0.51 0.00 0.00 43.02 41.72 2ken s PHE 81 CO 0.31 0.58 0.37 1.14 0.70 0.00 0.00 175.22 178.32 2ken s GLN 82 N -2.33 1.09 -0.20 0.44 -2.07 -1.07 -4.34 119.66 111.18 2ken s GLN 82 Ca 0.31 -0.81 -0.07 0.00 -1.82 0.00 0.00 55.36 52.97 2ken s GLN 82 Cb -0.13 0.45 -0.04 0.00 -1.09 0.00 0.00 33.01 32.20 2ken s GLN 82 CO 0.24 -0.42 0.06 0.14 -1.32 0.00 0.00 175.29 173.99 2ken s VAL 83 N -3.84 4.64 -0.22 3.63 -7.23 -1.13 -0.79 120.40 115.47 2ken s VAL 83 Ca 0.05 -0.08 -0.10 0.00 -1.81 0.00 0.00 61.98 60.04 2ken s VAL 83 Cb 0.02 -3.11 -0.05 0.00 0.56 0.00 0.00 36.38 33.80 2ken s VAL 83 CO -0.09 0.43 0.14 -1.10 -0.31 0.00 0.00 175.10 174.17 2ken s GLN 84 N 0.65 4.10 -0.17 4.82 -0.21 -0.93 -2.41 119.66 125.51 2ken s GLN 84 Ca 0.03 -0.26 -0.09 0.00 0.02 0.00 0.00 55.36 55.06 2ken s GLN 84 Cb -0.13 -3.48 -0.05 0.00 1.00 0.00 0.00 33.01 30.36 2ken s GLN 84 CO 0.02 0.16 0.15 0.08 -2.12 0.00 0.00 175.29 173.57 2ken s VAL 85 N 0.78 5.42 0.00 1.09 1.01 -0.76 -3.76 120.40 124.19 2ken s VAL 85 Ca 0.07 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.29 2ken s VAL 85 Cb -0.13 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2ken s VAL 85 CO 0.02 0.49 0.00 0.59 0.00 0.00 0.00 175.10 176.20 2ken n ASN 86 N 3.04 0.75 -0.29 3.32 3.02 -1.26 -2.78 115.26 121.06 2ken n ASN 86 Ca -0.17 -0.62 -0.05 0.00 -0.03 0.00 0.00 54.58 53.71 2ken n ASN 86 Cb 0.53 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.76 2ken n ASN 86 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 2ken h LYS 87 N 0.00 1.13 -0.20 3.52 1.57 -1.86 -2.18 116.57 118.55 2ken h LYS 87 Ca 0.00 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 2ken h LYS 87 Cb 0.00 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 2ken h LYS 87 CO 0.00 0.87 0.01 -0.91 -0.57 0.00 0.00 179.45 178.85 2ken h ASN 88 N 1.10 0.26 -4.47 0.86 -0.26 -1.96 -3.43 115.58 107.70 2ken h ASN 88 Ca 0.27 -0.03 -0.49 0.00 -0.56 0.00 0.00 56.30 55.49 2ken h ASN 88 Cb 0.12 -0.07 0.08 0.00 -1.06 0.00 0.00 38.32 37.39 2ken h ASN 88 CO -0.03 0.30 0.41 -0.94 -1.06 0.00 0.00 177.43 176.11 2ken s SER 89 N -6.86 5.33 0.16 5.81 1.04 -0.82 -4.84 113.70 113.52 2ken s SER 89 Ca -0.06 1.14 -0.01 0.00 0.48 0.00 0.00 55.95 57.50 2ken s SER 89 Cb 0.16 -1.92 -0.04 0.00 0.10 0.00 0.00 66.02 64.33 2ken s SER 89 CO 0.72 -1.42 0.08 -0.55 0.98 0.00 0.00 173.24 173.05 2ken s SER 90 N -4.33 0.34 -0.02 7.02 0.15 -0.82 -4.76 113.70 111.29 2ken s SER 90 Ca 0.59 -1.27 0.00 0.00 0.70 0.00 0.00 55.95 55.97 2ken s SER 90 Cb -0.11 0.31 0.02 0.00 -1.71 0.00 0.00 66.02 64.53 2ken s SER 90 CO 0.52 -0.76 0.02 -0.63 1.20 0.00 0.00 173.24 173.59 2ken s ILE 91 N -4.05 -0.01 -0.05 6.45 1.01 -1.26 -2.62 121.20 120.66 2ken s ILE 91 Ca 0.29 0.16 0.03 0.00 0.00 0.00 0.00 60.65 61.13 2ken s ILE 91 Cb 0.07 -0.10 0.01 0.00 0.01 0.00 0.00 42.46 42.45 2ken s ILE 91 CO 0.06 0.09 -0.13 -1.61 0.00 0.00 0.00 174.94 173.34 2ken s GLU 92 N 0.90 1.57 0.26 2.79 2.02 -0.01 -4.95 118.70 121.27 2ken s GLU 92 Ca -0.08 -0.44 -0.30 0.00 0.02 0.00 0.00 54.97 54.18 2ken s GLU 92 Cb -0.11 -1.34 -0.09 0.00 0.10 0.00 0.00 34.13 32.69 2ken s GLU 92 CO -0.02 0.10 1.03 0.21 0.02 0.00 0.00 175.26 176.60 2ken s LYS 93 N 0.42 4.73 -0.09 1.61 2.20 -1.26 -0.29 119.74 127.06 2ken s LYS 93 Ca -0.10 1.68 -0.05 0.00 -0.36 0.00 0.00 55.97 57.14 2ken s LYS 93 Cb -0.13 -3.23 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 2ken s LYS 93 CO 0.03 0.34 0.12 -0.51 -0.36 0.00 0.00 175.35 174.97 2ken s LEU 94 N -1.33 4.24 0.00 5.43 1.43 -1.11 -4.89 118.68 122.45 2ken s LEU 94 Ca 0.43 0.38 0.30 0.00 -1.03 0.00 0.00 54.13 54.21 2ken s LEU 94 Cb -0.30 -2.15 1.42 0.00 0.03 0.00 0.00 46.19 45.19 2ken s LEU 94 CO 0.37 0.37 1.96 -1.20 0.23 0.00 0.00 176.35 178.08 2ken n SER 95 N 1.74 0.59 -4.39 2.29 7.64 -1.26 -4.61 113.62 115.62 2ken n SER 95 Ca -0.18 -0.98 -0.33 0.00 1.01 0.00 0.00 58.87 58.40 2ken n SER 95 Cb 0.54 -0.03 -0.14 0.00 -1.01 0.00 0.00 64.21 63.57 2ken n SER 95 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2ken s GLU 96 N -2.18 3.27 0.57 1.43 2.12 -1.26 -5.12 118.70 117.53 2ken s GLU 96 Ca 0.38 -0.68 -0.17 0.00 0.36 0.00 0.00 54.97 54.85 2ken s GLU 96 Cb 0.21 -2.60 -0.05 0.00 0.26 0.00 0.00 34.13 31.95 2ken s GLU 96 CO 0.40 0.27 1.07 -1.25 -0.54 0.00 0.00 175.26 175.21 2ken s PRO 97 N 0.19 3.40 -0.11 4.30 0.04 -1.26 -4.73 135.00 136.83 2ken s PRO 97 Ca -0.08 1.31 -0.00 0.00 0.04 0.00 0.00 61.00 62.27 2ken s PRO 97 Cb -0.15 -2.04 -0.02 0.00 0.04 0.00 0.00 34.50 32.33 2ken s PRO 97 CO 0.05 -0.76 -0.09 0.42 0.04 0.00 0.00 177.00 176.66 2ken s ILE 98 N -2.23 3.50 -0.29 0.56 1.01 -1.26 -5.07 121.20 117.42 2ken s ILE 98 Ca 0.66 -0.52 -0.17 0.00 0.00 0.00 0.00 60.65 60.62 2ken s ILE 98 Cb -0.17 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 2ken s ILE 98 CO 0.32 0.55 0.47 -0.70 0.00 0.00 0.00 174.94 175.57 2ken s GLU 99 N -0.16 3.92 0.00 2.79 2.12 -1.26 -4.82 118.70 121.30 2ken s GLU 99 Ca 0.01 0.09 0.00 0.00 0.36 0.00 0.00 54.97 55.43 2ken s GLU 99 Cb -0.13 -3.70 0.00 0.00 0.26 0.00 0.00 34.13 30.56 2ken s GLU 99 CO 0.03 -0.41 0.00 1.55 -0.54 0.00 0.00 175.26 175.89 2ken n VAL 100 N 5.22 0.00 -1.64 3.70 3.14 -1.26 -4.72 118.33 122.78 2ken n VAL 100 Ca -0.06 0.00 -0.39 0.00 -2.96 0.00 0.00 64.34 60.93 2ken n VAL 100 Cb 0.50 -0.24 -0.03 0.00 -1.06 0.00 0.00 33.84 33.01 2ken n VAL 100 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 2ken s GLY 101 N -1.72 0.01 -0.74 7.55 0.00 -1.26 -3.45 107.32 107.71 2ken s GLY 101 Ca 0.00 0.26 -0.08 0.00 0.00 0.00 0.00 44.72 44.90 2ken s GLY 101 CO 0.00 3.92 0.63 1.04 0.00 0.00 0.00 173.10 178.69 2ken n LEU 102 N 13.87 -2.80 -4.71 0.66 4.77 -1.26 -4.80 117.00 122.74 2ken n LEU 102 Ca 0.32 -0.67 -0.42 0.00 -0.03 0.00 0.00 56.01 55.22 2ken n LEU 102 Cb 0.51 -1.89 -0.03 0.00 -2.33 0.00 0.00 43.42 39.68 2ken n LEU 102 CO 0.69 0.04 1.21 -0.70 -1.33 0.00 0.00 177.39 177.30 2ken s GLU 103 N -4.18 4.24 0.31 3.23 2.12 -1.22 -4.98 118.70 118.21 2ken s GLU 103 Ca 0.08 2.26 -0.14 0.00 0.36 0.00 0.00 54.97 57.53 2ken s GLU 103 Cb -0.01 -3.32 0.02 0.00 0.26 0.00 0.00 34.13 31.08 2ken s GLU 103 CO 0.87 -0.60 0.63 -1.58 -0.54 0.00 0.00 175.26 174.04 2ken s HIS 104 N 1.61 0.28 0.00 5.30 2.46 -1.26 -5.12 115.29 118.55 2ken s HIS 104 Ca 0.69 -0.73 0.00 0.00 0.47 0.00 0.00 55.06 55.49 2ken s HIS 104 Cb -0.40 0.46 0.00 0.00 -0.13 0.00 0.00 32.58 32.50 2ken s HIS 104 CO 0.31 -1.24 0.00 0.72 -2.47 0.00 0.00 174.74 172.05 2ken n HIS 105 N -0.48 -0.69 0.85 3.88 8.25 -1.26 -4.76 115.22 121.02 2ken n HIS 105 Ca -0.04 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.54 2ken n HIS 105 Cb 0.61 0.00 0.52 0.00 1.12 0.00 0.00 29.99 32.23 2ken n HIS 105 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2ken n HIS 106 N -0.69 0.00 -1.68 4.41 8.25 -1.26 -4.79 115.22 119.45 2ken n HIS 106 Ca 0.00 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.02 2ken n HIS 106 Cb 0.00 -0.48 -0.04 0.00 1.12 0.00 0.00 29.99 30.60 2ken n HIS 106 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2ken n HIS 107 N -1.48 2.52 -3.76 4.41 -0.00 -1.26 -4.97 115.22 110.69 2ken n HIS 107 Ca 0.06 -0.06 -0.13 0.00 -0.00 0.00 0.00 57.72 57.59 2ken n HIS 107 Cb 0.27 -2.69 -0.11 0.00 -0.00 0.00 0.00 29.99 27.46 2ken n HIS 107 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2ken s HIS 108 N 2.68 -0.37 -2.00 1.57 2.46 -1.26 -4.95 115.29 113.42 2ken s HIS 108 Ca 0.83 0.88 0.28 0.00 0.47 0.00 0.00 55.06 57.53 2ken s HIS 108 Cb -0.55 0.12 1.66 0.00 -0.13 0.00 0.00 32.58 33.69 2ken s HIS 108 CO 0.40 -0.18 2.00 -2.39 -2.47 0.00 0.00 174.74 172.10