#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ken n GLU 2 N 0.00 0.73 -1.33 0.03 2.13 -1.26 -5.15 120.64 115.79 2ken n GLU 2 Ca 0.00 -1.47 -0.31 0.00 0.66 0.00 0.00 57.16 56.04 2ken n GLU 2 Cb 0.00 -0.56 0.09 0.00 0.27 0.00 0.00 31.44 31.24 2ken n GLU 2 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2ken s PRO 3 N 0.18 2.22 -0.31 5.31 0.04 -1.26 -4.97 135.00 136.21 2ken s PRO 3 Ca 0.20 1.04 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 2ken s PRO 3 Cb 0.29 -1.90 0.01 0.00 0.04 0.00 0.00 34.50 32.94 2ken s PRO 3 CO -0.10 -1.63 1.21 -0.65 0.04 0.00 0.00 177.00 175.87 2ken s GLN 4 N -4.95 3.98 -0.09 4.56 -1.52 -1.26 -5.00 119.66 115.37 2ken s GLN 4 Ca 0.61 1.16 -0.19 0.00 -1.95 0.00 0.00 55.36 55.00 2ken s GLN 4 Cb -0.16 -3.82 -0.04 0.00 -0.22 0.00 0.00 33.01 28.76 2ken s GLN 4 CO 0.56 -1.03 0.51 -0.51 -0.25 0.00 0.00 175.29 174.56 2ken s LEU 5 N 4.07 4.31 -0.00 2.90 1.43 -1.26 -2.09 118.68 128.03 2ken s LEU 5 Ca 0.52 0.90 0.06 0.00 -1.03 0.00 0.00 54.13 54.58 2ken s LEU 5 Cb -0.15 -2.75 -0.02 0.00 0.03 0.00 0.00 46.19 43.31 2ken s LEU 5 CO 0.20 0.03 -0.20 -0.89 0.23 0.00 0.00 176.35 175.72 2ken s THR 6 N 0.42 1.59 0.13 5.49 2.01 -1.06 -4.91 115.64 119.30 2ken s THR 6 Ca 0.27 -0.93 -0.01 0.00 0.31 0.00 0.00 61.69 61.34 2ken s THR 6 Cb -0.16 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 70.97 2ken s THR 6 CO 0.12 0.39 0.31 -0.54 -0.69 0.00 0.00 174.62 174.22 2ken s LYS 7 N -0.62 3.51 0.19 4.92 -0.14 -1.26 -4.69 119.74 121.65 2ken s LYS 7 Ca 0.08 -0.33 -0.12 0.00 -1.36 0.00 0.00 55.97 54.23 2ken s LYS 7 Cb -0.08 -2.92 0.17 0.00 -1.68 0.00 0.00 37.83 33.31 2ken s LYS 7 CO -0.00 0.50 1.77 0.82 -0.76 0.00 0.00 175.35 177.69 2ken h ILE 8 N 1.88 0.91 0.00 2.17 2.04 -1.97 0.32 117.51 122.86 2ken h ILE 8 Ca -0.46 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.24 2ken h ILE 8 Cb 1.17 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 2ken h ILE 8 CO 0.72 0.09 0.00 1.62 0.00 0.00 0.00 178.15 180.58 2ken h VAL 9 N 0.47 0.00 -0.13 1.67 3.04 -1.94 -0.01 116.25 119.34 2ken h VAL 9 Ca 0.24 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.78 2ken h VAL 9 Cb 0.19 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 30.45 2ken h VAL 9 CO -0.19 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 176.84 2ken n ASP 10 N -2.75 2.07 -4.65 3.17 8.00 0.11 -4.85 116.55 117.65 2ken n ASP 10 Ca -0.01 -1.73 -0.41 0.00 0.71 0.00 0.00 54.79 53.35 2ken n ASP 10 Cb 0.14 -0.08 -0.05 0.00 -0.02 0.00 0.00 41.12 41.11 2ken n ASP 10 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2ken s ILE 11 N -1.85 4.90 0.00 0.53 1.01 -0.02 -4.82 121.20 120.95 2ken s ILE 11 Ca 0.34 1.46 0.00 0.00 0.00 0.00 0.00 60.65 62.45 2ken s ILE 11 Cb 0.20 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.60 2ken s ILE 11 CO 0.30 -0.01 0.20 1.33 0.00 0.00 0.00 174.94 176.76 2ken n VAL 12 N 5.06 0.00 -4.00 2.92 0.24 -1.26 -5.06 118.33 116.23 2ken n VAL 12 Ca 0.03 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.18 2ken n VAL 12 Cb 0.48 0.80 -0.15 0.00 -1.47 0.00 0.00 33.84 33.50 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 0.29 0.34 7.34 2.12 -1.26 -5.15 118.70 122.38 2ken s GLU 13 Ca 0.00 -0.03 -0.01 0.00 0.36 0.00 0.00 54.97 55.28 2ken s GLU 13 Cb 0.00 -0.36 -0.04 0.00 0.26 0.00 0.00 34.13 33.99 2ken s GLU 13 CO 0.00 -0.02 0.57 0.54 -0.54 0.00 0.00 175.26 175.81 2ken s ASN 14 N 0.41 6.32 -0.56 -1.70 2.20 -1.26 -4.22 114.94 116.13 2ken s ASN 14 Ca -0.04 0.55 0.00 0.00 -0.94 0.00 0.00 52.86 52.43 2ken s ASN 14 Cb -0.07 -2.07 0.00 0.00 -2.00 0.00 0.00 41.25 37.11 2ken s ASN 14 CO -0.01 -0.30 0.00 0.61 -2.94 0.00 0.00 177.10 174.47 2ken n GLY 15 N -1.63 0.75 3.91 0.45 0.00 0.16 -4.96 105.19 103.87 2ken n GLY 15 Ca -0.04 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.58 3.47 -0.21 1.61 0.74 -1.26 -4.84 119.66 116.58 2ken s GLN 16 Ca 0.00 -0.32 -0.13 0.00 0.05 0.00 0.00 55.36 54.96 2ken s GLN 16 Cb 0.00 -3.06 -0.05 0.00 1.10 0.00 0.00 33.01 31.01 2ken s GLN 16 CO 0.00 0.64 0.26 -1.58 -0.55 0.00 0.00 175.29 174.05 2ken s TRP 17 N -1.41 3.38 0.31 1.67 0.52 -1.26 -2.39 118.94 119.76 2ken s TRP 17 Ca 0.31 0.44 -0.13 0.00 0.02 0.00 0.00 56.10 56.74 2ken s TRP 17 Cb -0.13 -2.35 0.05 0.00 -1.15 0.00 0.00 33.47 29.90 2ken s TRP 17 CO 0.22 0.11 0.68 0.00 0.02 0.00 0.00 176.95 177.98 2ken n ALA 18 N 4.08 -1.57 -2.41 0.98 0.00 -1.06 -5.00 120.51 115.53 2ken n ALA 18 Ca -0.12 -1.03 -0.30 0.00 0.00 0.00 0.00 53.44 51.98 2ken n ALA 18 Cb 0.52 0.80 -0.13 0.00 0.00 0.00 0.00 19.45 20.63 2ken n ALA 18 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2ken s ASN 19 N -2.76 3.53 -0.05 0.00 -0.87 -0.89 -2.45 114.94 111.45 2ken s ASN 19 Ca 0.14 -0.52 0.01 0.00 -1.57 0.00 0.00 52.86 50.91 2ken s ASN 19 Cb -0.04 -0.45 0.02 0.00 -0.02 0.00 0.00 41.25 40.76 2ken s ASN 19 CO 0.09 0.24 -0.04 -0.22 -2.57 0.00 0.00 177.10 174.61 2ken s LEU 20 N -1.47 1.22 -0.12 0.60 2.96 -0.74 -2.57 118.68 118.55 2ken s LEU 20 Ca 0.14 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.92 2ken s LEU 20 Cb -0.10 -0.47 -0.01 0.00 0.50 0.00 0.00 46.19 46.10 2ken s LEU 20 CO 0.04 -0.07 -0.15 -0.75 -1.32 0.00 0.00 176.35 174.10 2ken s LYS 21 N 1.09 3.32 0.15 1.98 2.20 -1.26 -1.51 119.74 125.71 2ken s LYS 21 Ca -0.08 -0.71 -0.25 0.00 -0.36 0.00 0.00 55.97 54.57 2ken s LYS 21 Cb -0.14 -2.58 0.07 0.00 -1.51 0.00 0.00 37.83 33.67 2ken s LYS 21 CO -0.01 0.22 0.98 0.00 -0.36 0.00 0.00 175.35 176.18 2ken s ALA 22 N 0.32 -1.67 0.16 3.13 0.00 -1.09 -4.86 121.76 117.75 2ken s ALA 22 Ca -0.12 0.10 0.03 0.00 0.00 0.00 0.00 51.96 51.97 2ken s ALA 22 Cb -0.16 0.64 -0.03 0.00 0.00 0.00 0.00 23.12 23.56 2ken s ALA 22 CO 0.06 -1.05 0.29 0.21 0.00 0.00 0.00 175.76 175.27 2ken s LYS 23 N -3.14 3.43 -0.37 0.00 2.20 -1.01 -2.19 119.74 118.65 2ken s LYS 23 Ca 0.13 -0.62 -0.16 0.00 -0.36 0.00 0.00 55.97 54.97 2ken s LYS 23 Cb -0.01 -2.95 0.00 0.00 -1.51 0.00 0.00 37.83 33.36 2ken s LYS 23 CO 0.02 0.51 0.37 0.08 -0.36 0.00 0.00 175.35 175.98 2ken s VAL 24 N -1.76 5.16 -0.05 4.02 1.01 -1.12 0.63 120.40 128.28 2ken s VAL 24 Ca 0.34 -0.16 0.21 0.00 0.00 0.00 0.00 61.98 62.38 2ken s VAL 24 Cb -0.11 -3.89 -0.32 0.00 0.00 0.00 0.00 36.38 32.06 2ken s VAL 24 CO 0.28 -0.21 0.42 -0.38 0.00 0.00 0.00 175.10 175.21 2ken n ILE 25 N 5.29 0.16 -3.72 2.22 5.41 -1.20 -0.77 119.36 126.75 2ken n ILE 25 Ca -0.09 -0.53 -0.12 0.00 1.00 0.00 0.00 62.75 63.01 2ken n ILE 25 Cb 0.49 -0.05 -0.13 0.00 -0.71 0.00 0.00 39.64 39.24 2ken n ILE 25 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2ken s GLN 26 N -3.36 0.25 0.14 0.38 -1.52 -1.24 -4.90 119.66 109.40 2ken s GLN 26 Ca -0.08 0.57 0.06 0.00 -1.95 0.00 0.00 55.36 53.96 2ken s GLN 26 Cb 0.13 -0.09 -0.04 0.00 -0.22 0.00 0.00 33.01 32.79 2ken s GLN 26 CO 0.88 -0.16 -0.13 -0.48 -0.25 0.00 0.00 175.29 175.15 2ken s LEU 27 N 1.23 2.46 -0.19 2.90 2.34 -1.26 -0.95 118.68 125.21 2ken s LEU 27 Ca -0.09 -0.89 -0.04 0.00 0.06 0.00 0.00 54.13 53.17 2ken s LEU 27 Cb -0.10 -0.51 0.09 0.00 -0.56 0.00 0.00 46.19 45.12 2ken s LEU 27 CO -0.09 -0.20 0.20 0.26 -1.06 0.00 0.00 176.35 175.46 2ken s TRP 28 N -2.57 -0.22 -0.15 3.48 0.52 0.48 -4.93 118.94 115.55 2ken s TRP 28 Ca 0.13 0.18 -0.29 0.00 0.02 0.00 0.00 56.10 56.13 2ken s TRP 28 Cb -0.02 -0.40 -0.03 0.00 -1.15 0.00 0.00 33.47 31.87 2ken s TRP 28 CO 0.03 -0.58 1.55 -1.21 0.02 0.00 0.00 176.95 176.76 2ken s GLU 29 N 2.30 4.03 -0.13 4.98 2.02 -1.26 -2.66 118.70 127.98 2ken s GLU 29 Ca 0.06 1.84 -0.06 0.00 0.02 0.00 0.00 54.97 56.83 2ken s GLU 29 Cb -0.16 -3.96 -0.04 0.00 0.10 0.00 0.00 34.13 30.08 2ken s GLU 29 CO -0.11 -1.01 0.09 1.21 0.02 0.00 0.00 175.26 175.46 2ken s ASN 30 N 3.41 5.94 0.00 -0.19 3.84 -0.95 -4.97 114.94 122.02 2ken s ASN 30 Ca 0.68 0.30 0.00 0.00 0.21 0.00 0.00 52.86 54.06 2ken s ASN 30 Cb -0.27 -1.89 0.00 0.00 -0.55 0.00 0.00 41.25 38.54 2ken s ASN 30 CO 0.26 0.35 0.82 0.35 -2.79 0.00 0.00 177.10 176.09 2ken n THR 31 N 2.37 0.67 0.62 -5.21 -2.24 -1.26 -4.65 114.28 104.58 2ken n THR 31 Ca -0.19 -0.78 0.04 0.00 -2.27 0.00 0.00 64.05 60.85 2ken n THR 31 Cb 0.54 0.69 0.23 0.00 -2.10 0.00 0.00 70.33 69.69 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 -0.34 0.00 0.00 4.78 -0.00 -1.26 -4.80 115.22 113.60 2ken n HIS 32 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2ken n HIS 32 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.21 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 -0.89 0.00 -0.11 1.57 4.07 -1.26 -4.47 120.64 119.55 2ken n GLU 33 Ca 0.06 0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 57.07 2ken n GLU 33 Cb 0.03 -0.06 -0.00 0.00 -0.06 0.00 0.00 31.44 31.34 2ken n GLU 33 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 2ken h SER 34 N 0.00 0.43 -3.35 4.31 0.87 -1.96 -3.41 113.55 110.42 2ken h SER 34 Ca 0.00 -0.01 -0.66 0.00 -1.23 0.00 0.00 61.79 59.89 2ken h SER 34 Cb 0.00 -0.11 -0.18 0.00 -0.44 0.00 0.00 62.40 61.67 2ken h SER 34 CO 0.00 0.31 -0.64 -0.63 -0.53 0.00 0.00 176.83 175.34 2ken s ILE 35 N -6.16 4.13 -0.08 2.23 1.01 -1.26 -4.11 121.20 116.97 2ken s ILE 35 Ca -0.13 -0.29 -0.02 0.00 0.00 0.00 0.00 60.65 60.21 2ken s ILE 35 Cb 0.10 -2.77 -0.01 0.00 0.01 0.00 0.00 42.46 39.79 2ken s ILE 35 CO 0.72 0.55 -0.03 -1.28 0.00 0.00 0.00 174.94 174.89 2ken h SER 36 N 5.93 0.00 -4.90 3.58 0.87 -1.14 -3.39 113.55 114.50 2ken h SER 36 Ca -0.41 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.04 2ken h SER 36 Cb 1.19 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 62.95 2ken h SER 36 CO 0.59 0.41 -0.16 -1.58 -0.53 0.00 0.00 176.83 175.56 2ken s GLN 37 N -1.52 0.75 0.04 2.24 0.74 -1.07 -2.24 119.66 118.60 2ken s GLN 37 Ca -0.03 -0.02 0.00 0.00 0.05 0.00 0.00 55.36 55.37 2ken s GLN 37 Cb 0.00 0.34 -0.03 0.00 1.10 0.00 0.00 33.01 34.43 2ken s GLN 37 CO 0.04 -0.21 -0.04 0.14 -0.55 0.00 0.00 175.29 174.67 2ken s VAL 38 N -1.17 0.31 0.00 1.34 -7.23 -1.09 -0.15 120.40 112.41 2ken s VAL 38 Ca -0.12 -1.33 0.00 0.00 -1.81 0.00 0.00 61.98 58.72 2ken s VAL 38 Cb -0.04 -0.87 0.00 0.00 0.56 0.00 0.00 36.38 36.03 2ken s VAL 38 CO 0.05 -0.67 0.00 0.61 -0.31 0.00 0.00 175.10 174.79 2ken n GLY 39 N 0.93 1.04 3.24 2.32 0.00 -1.10 -0.39 105.19 111.24 2ken n GLY 39 Ca -0.19 -0.60 -0.25 0.00 0.00 0.00 0.00 46.02 44.98 2ken n GLY 39 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ken s LEU 40 N 0.00 2.17 -0.17 0.99 2.96 -0.13 -2.65 118.68 121.86 2ken s LEU 40 Ca 0.00 -0.52 -0.04 0.00 -0.22 0.00 0.00 54.13 53.34 2ken s LEU 40 Cb 0.00 -0.93 -0.03 0.00 0.50 0.00 0.00 46.19 45.74 2ken s LEU 40 CO 0.00 0.14 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.39 2ken s LEU 41 N -1.21 3.30 -0.64 -0.68 1.43 -0.06 -3.25 118.68 117.57 2ken s LEU 41 Ca 0.07 -0.13 -0.18 0.00 -1.03 0.00 0.00 54.13 52.86 2ken s LEU 41 Cb -0.09 -1.81 0.13 0.00 0.03 0.00 0.00 46.19 44.45 2ken s LEU 41 CO 0.02 0.15 0.71 -0.83 0.23 0.00 0.00 176.35 176.62 2ken s GLY 42 N 0.51 1.97 0.32 -3.19 0.00 0.20 -2.57 107.32 104.57 2ken s GLY 42 Ca -0.02 -2.49 0.07 0.00 0.00 0.00 0.00 44.72 42.28 2ken s GLY 42 CO 0.02 1.50 0.36 -0.35 0.00 0.00 0.00 173.10 174.63 2ken s ASP 43 N 3.43 5.65 0.54 1.64 2.15 0.11 -2.41 116.67 127.78 2ken s ASP 43 Ca 0.12 -0.31 0.32 0.00 0.43 0.00 0.00 52.55 53.11 2ken s ASP 43 Cb -0.22 -1.18 1.26 0.00 -0.30 0.00 0.00 42.92 42.49 2ken s ASP 43 CO 0.02 -0.33 1.95 -0.33 -0.17 0.00 0.00 175.17 176.30 2ken h GLU 44 N 1.13 0.00 0.00 4.34 5.08 -1.96 -2.55 114.58 120.61 2ken h GLU 44 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2ken h GLU 44 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2ken h GLU 44 CO 0.57 0.01 -0.64 0.25 -1.00 0.00 0.00 179.01 178.20 2ken n THR 45 N -3.11 0.16 0.00 1.13 -2.24 -1.26 -5.04 114.28 103.92 2ken n THR 45 Ca 0.01 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2ken n THR 45 Cb 0.33 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 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 1.42 -0.11 3.24 3.38 0.00 -0.96 -4.79 105.19 107.36 2ken n GLY 46 Ca 0.04 -1.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.92 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 1.12 -0.21 -0.61 -0.00 -1.26 -0.71 121.20 115.52 2ken s ILE 47 Ca 0.00 -2.02 -0.24 0.00 -0.00 0.00 0.00 60.65 58.39 2ken s ILE 47 Cb 0.00 -1.80 0.06 0.00 -0.00 0.00 0.00 42.46 40.72 2ken s ILE 47 CO 0.00 -0.74 0.66 -0.51 -0.00 0.00 0.00 174.94 174.34 2ken s ILE 48 N -3.28 0.00 0.18 8.37 2.07 -1.06 -4.97 121.20 122.51 2ken s ILE 48 Ca 0.15 -0.01 -0.17 0.00 -1.41 0.00 0.00 60.65 59.22 2ken s ILE 48 Cb 0.02 -0.93 -0.07 0.00 0.13 0.00 0.00 42.46 41.61 2ken s ILE 48 CO 0.00 -0.01 0.62 -0.75 -1.91 0.00 0.00 174.94 172.90 2ken s LYS 49 N 0.09 4.09 0.05 3.50 2.20 -1.26 -0.88 119.74 127.53 2ken s LYS 49 Ca -0.02 0.65 -0.02 0.00 -0.36 0.00 0.00 55.97 56.22 2ken s LYS 49 Cb -0.04 -2.91 -0.03 0.00 -1.51 0.00 0.00 37.83 33.34 2ken s LYS 49 CO 0.02 0.45 0.01 -0.59 -0.36 0.00 0.00 175.35 174.88 2ken s PHE 50 N -1.48 0.42 -0.01 4.03 -0.71 -1.08 -2.63 117.98 116.50 2ken s PHE 50 Ca 0.40 -0.90 0.02 0.00 -1.04 0.00 0.00 56.93 55.40 2ken s PHE 50 Cb -0.16 -0.31 0.00 0.00 -1.21 0.00 0.00 43.02 41.35 2ken s PHE 50 CO 0.20 -0.38 -0.06 -0.08 -1.34 0.00 0.00 175.22 173.56 2ken s THR 51 N -3.57 0.50 -0.17 -4.49 -1.32 -0.61 -2.71 115.64 103.27 2ken s THR 51 Ca 0.04 -0.23 -0.06 0.00 -1.21 0.00 0.00 61.69 60.23 2ken s THR 51 Cb 0.05 -0.45 -0.03 0.00 -1.51 0.00 0.00 72.50 70.56 2ken s THR 51 CO -0.09 0.16 0.01 -0.63 -2.21 0.00 0.00 174.62 171.87 2ken s ILE 52 N 0.10 4.35 0.18 5.08 1.01 0.78 -1.83 121.20 130.87 2ken s ILE 52 Ca -0.01 -0.19 -0.20 0.00 0.00 0.00 0.00 60.65 60.25 2ken s ILE 52 Cb -0.05 -2.94 -0.08 0.00 0.01 0.00 0.00 42.46 39.40 2ken s ILE 52 CO -0.00 0.47 0.69 0.26 0.00 0.00 0.00 174.94 176.36 2ken s TRP 53 N 0.39 3.72 0.43 3.97 0.52 -1.07 -0.68 118.94 126.23 2ken s TRP 53 Ca -0.00 1.39 0.11 0.00 0.02 0.00 0.00 56.10 57.61 2ken s TRP 53 Cb -0.13 -2.60 0.93 0.00 -1.15 0.00 0.00 33.47 30.52 2ken s TRP 53 CO 0.02 0.42 2.02 -0.22 0.02 0.00 0.00 176.95 179.21 2ken h LYS 54 N 3.79 0.26 0.00 4.98 1.63 -1.80 -0.95 116.57 124.48 2ken h LYS 54 Ca -0.48 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 2ken h LYS 54 Cb 1.20 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 2ken h LYS 54 CO 0.65 0.27 0.02 0.09 -3.45 0.00 0.00 179.45 177.03 2ken n ASN 55 N -4.40 0.32 0.05 4.20 3.02 -1.26 -0.38 115.26 116.79 2ken n ASN 55 Ca -0.00 0.64 -0.03 0.00 -0.03 0.00 0.00 54.58 55.16 2ken n ASN 55 Cb 0.16 -0.68 -0.08 0.00 -0.61 0.00 0.00 39.78 38.57 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 1.95 0.64 -6.39 5.41 0.00 -1.48 -3.41 119.26 115.97 2ken h ALA 56 Ca 0.00 -0.92 -0.48 0.00 0.00 0.00 0.00 54.91 53.51 2ken h ALA 56 Cb 0.03 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2ken h ALA 56 CO 0.00 1.06 -0.90 0.39 0.00 0.00 0.00 179.25 179.80 2ken n GLU 57 N -3.06 -2.83 -4.00 0.00 1.02 0.48 -4.82 120.64 107.43 2ken n GLU 57 Ca -0.07 0.43 -0.27 0.00 -0.02 0.00 0.00 57.16 57.22 2ken n GLU 57 Cb 0.88 -4.44 -0.04 0.00 -0.02 0.00 0.00 31.44 27.82 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 -6.81 4.12 0.59 -4.62 1.43 -1.26 -5.08 118.68 107.04 2ken s LEU 58 Ca 0.14 0.07 -0.19 0.00 -1.03 0.00 0.00 54.13 53.12 2ken s LEU 58 Cb -0.05 -2.72 -0.05 0.00 0.03 0.00 0.00 46.19 43.40 2ken s LEU 58 CO 0.87 0.09 0.98 -2.65 0.23 0.00 0.00 176.35 175.88 2ken n PRO 59 N -0.25 0.97 -2.29 1.29 -0.02 -1.26 -4.93 135.00 128.50 2ken n PRO 59 Ca -0.07 0.37 -0.40 0.00 -2.02 0.00 0.00 63.50 61.38 2ken n PRO 59 Cb 0.53 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.81 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 -1.96 4.43 0.28 2.45 1.43 -1.26 -5.01 118.68 119.04 2ken s LEU 60 Ca 0.75 2.45 -0.22 0.00 -1.03 0.00 0.00 54.13 56.08 2ken s LEU 60 Cb -0.43 -3.72 -0.09 0.00 0.03 0.00 0.00 46.19 41.98 2ken s LEU 60 CO 0.48 -0.41 0.83 -0.76 0.23 0.00 0.00 176.35 176.72 2ken s LEU 61 N -1.81 4.30 -0.12 1.79 1.02 -1.26 -5.06 118.68 117.54 2ken s LEU 61 Ca 0.49 1.60 -0.06 0.00 0.02 0.00 0.00 54.13 56.18 2ken s LEU 61 Cb -0.35 -3.85 -0.04 0.00 0.02 0.00 0.00 46.19 41.98 2ken s LEU 61 CO 0.45 -0.04 0.12 -1.61 0.02 0.00 0.00 176.35 175.28 2ken s GLU 62 N -2.13 3.42 0.22 1.70 2.02 -1.26 -5.06 118.70 117.62 2ken s GLU 62 Ca 0.48 -0.18 -0.30 0.00 0.02 0.00 0.00 54.97 54.99 2ken s GLU 62 Cb -0.17 -3.14 -0.09 0.00 0.10 0.00 0.00 34.13 30.84 2ken s GLU 62 CO 0.21 0.73 1.05 -1.14 0.02 0.00 0.00 175.26 176.13 2ken s GLN 63 N -0.90 4.69 0.00 1.61 0.74 -1.26 -3.21 119.66 121.32 2ken s GLN 63 Ca 0.14 1.67 0.00 0.00 0.05 0.00 0.00 55.36 57.22 2ken s GLN 63 Cb -0.12 -3.25 0.00 0.00 1.10 0.00 0.00 33.01 30.74 2ken s GLN 63 CO 0.03 0.25 0.00 0.41 -0.55 0.00 0.00 175.29 175.43 2ken n GLY 64 N 1.62 3.02 3.95 2.59 0.00 0.05 -5.01 105.19 111.41 2ken n GLY 64 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.75 3.46 0.23 1.61 2.02 -1.20 -4.86 118.70 119.21 2ken s GLU 65 Ca 0.00 -0.53 -0.12 0.00 0.02 0.00 0.00 54.97 54.34 2ken s GLU 65 Cb 0.00 -2.77 -0.08 0.00 0.10 0.00 0.00 34.13 31.39 2ken s GLU 65 CO 0.00 0.28 0.59 -1.12 0.02 0.00 0.00 175.26 175.03 2ken s SER 66 N -4.00 6.72 -0.01 -0.19 0.01 -1.26 -2.80 113.70 112.16 2ken s SER 66 Ca 0.37 1.04 -0.02 0.00 1.31 0.00 0.00 55.95 58.66 2ken s SER 66 Cb -0.09 -2.28 -0.00 0.00 0.21 0.00 0.00 66.02 63.86 2ken s SER 66 CO 0.33 -0.05 0.04 -0.31 0.41 0.00 0.00 173.24 173.65 2ken s TYR 67 N -1.75 0.04 -0.15 2.43 2.02 -0.93 -2.69 117.35 116.32 2ken s TYR 67 Ca 0.46 -0.08 -0.03 0.00 -0.37 0.00 0.00 57.07 57.05 2ken s TYR 67 Cb -0.12 -0.05 -0.03 0.00 -0.40 0.00 0.00 41.96 41.37 2ken s TYR 67 CO 0.20 -0.10 -0.05 -1.17 -1.57 0.00 0.00 175.55 172.86 2ken s LEU 68 N -0.55 3.21 -0.20 -1.29 2.96 -0.38 -2.66 118.68 119.78 2ken s LEU 68 Ca -0.06 -0.14 -0.02 0.00 -0.22 0.00 0.00 54.13 53.69 2ken s LEU 68 Cb -0.04 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.88 2ken s LEU 68 CO -0.00 0.18 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.37 2ken s LEU 69 N 0.30 2.77 0.09 -0.68 1.43 -0.57 -2.44 118.68 119.58 2ken s LEU 69 Ca -0.04 -0.41 0.10 0.00 -1.03 0.00 0.00 54.13 52.75 2ken s LEU 69 Cb -0.14 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 2ken s LEU 69 CO 0.03 0.02 -0.26 -0.13 0.23 0.00 0.00 176.35 176.24 2ken s ARG 70 N 1.21 1.59 -1.13 1.70 0.52 -1.04 -1.80 118.95 120.01 2ken s ARG 70 Ca 0.02 -1.22 -0.07 0.00 -0.52 0.00 0.00 55.73 53.94 2ken s ARG 70 Cb -0.14 -1.92 -0.04 0.00 0.52 0.00 0.00 34.95 33.37 2ken s ARG 70 CO -0.03 0.48 0.88 0.45 0.02 0.00 0.00 175.30 177.10 2ken n SER 71 N 1.36 -4.82 -4.70 0.23 2.88 -1.25 -2.33 113.62 104.98 2ken n SER 71 Ca -0.17 -0.77 -0.24 0.00 -1.33 0.00 0.00 58.87 56.35 2ken n SER 71 Cb 0.52 -4.67 -0.07 0.00 -0.75 0.00 0.00 64.21 59.24 2ken n SER 71 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2ken s VAL 72 N -3.44 2.74 0.03 2.46 -7.23 -1.03 -4.10 120.40 109.82 2ken s VAL 72 Ca 0.32 -1.79 0.08 0.00 -1.81 0.00 0.00 61.98 58.78 2ken s VAL 72 Cb -0.06 -2.92 -0.02 0.00 0.56 0.00 0.00 36.38 33.93 2ken s VAL 72 CO 0.77 -0.15 -0.23 0.54 -0.31 0.00 0.00 175.10 175.73 2ken s VAL 73 N -2.49 1.83 -0.05 1.32 0.11 -1.21 -2.57 120.40 117.33 2ken s VAL 73 Ca 0.37 -1.18 -0.21 0.00 -2.93 0.00 0.00 61.98 58.04 2ken s VAL 73 Cb -0.00 -1.56 -0.04 0.00 -1.53 0.00 0.00 36.38 33.24 2ken s VAL 73 CO 0.22 0.34 0.60 -0.69 -3.33 0.00 0.00 175.10 172.23 2ken s VAL 74 N -0.72 5.03 0.16 2.04 1.01 -1.01 -1.88 120.40 125.03 2ken s VAL 74 Ca 0.09 1.24 0.08 0.00 0.00 0.00 0.00 61.98 63.39 2ken s VAL 74 Cb -0.09 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2ken s VAL 74 CO 0.01 0.34 -0.08 -0.83 0.00 0.00 0.00 175.10 174.54 2ken s GLY 75 N 0.35 1.75 -0.42 4.51 0.00 0.17 0.35 107.32 114.03 2ken s GLY 75 Ca 0.32 -1.38 -0.18 0.00 0.00 0.00 0.00 44.72 43.48 2ken s GLY 75 CO 0.16 -1.39 0.48 1.85 0.00 0.00 0.00 173.10 174.19 2ken s GLU 76 N -2.66 3.17 -0.38 2.90 2.12 -1.26 -1.11 118.70 121.47 2ken s GLU 76 Ca 0.24 -0.65 -0.12 0.00 0.36 0.00 0.00 54.97 54.81 2ken s GLU 76 Cb -0.10 -3.95 0.03 0.00 0.26 0.00 0.00 34.13 30.37 2ken s GLU 76 CO 0.15 -0.86 0.23 -0.47 -0.54 0.00 0.00 175.26 173.77 2ken s TYR 77 N 2.27 3.25 0.00 5.30 5.04 -0.74 -4.91 117.35 127.55 2ken s TYR 77 Ca 0.14 -0.94 0.00 0.00 -2.44 0.00 0.00 57.07 53.83 2ken s TYR 77 Cb -0.16 -2.50 0.00 0.00 0.35 0.00 0.00 41.96 39.65 2ken s TYR 77 CO 0.15 -0.66 0.00 0.09 -1.34 0.00 0.00 175.55 173.79 2ken n ASN 78 N 5.02 0.00 0.04 4.32 3.02 -1.26 -0.44 115.26 125.96 2ken n ASN 78 Ca -0.12 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.55 2ken n ASN 78 Cb 0.46 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.61 2ken n ASN 78 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2ken n ASP 79 N 3.37 0.57 -4.83 6.41 8.00 -1.26 -4.90 116.55 123.91 2ken n ASP 79 Ca 0.00 -0.02 -0.34 0.00 0.71 0.00 0.00 54.79 55.14 2ken n ASP 79 Cb 0.00 0.91 -0.06 0.00 -0.02 0.00 0.00 41.12 41.95 2ken n ASP 79 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2ken s ARG 80 N -3.30 3.23 0.55 -1.24 3.52 0.41 -5.09 118.95 117.03 2ken s ARG 80 Ca 0.00 -0.37 -0.17 0.00 -0.13 0.00 0.00 55.73 55.07 2ken s ARG 80 Cb 0.13 -2.98 -0.06 0.00 -1.56 0.00 0.00 34.95 30.48 2ken s ARG 80 CO 0.82 0.68 1.04 -0.06 -0.81 0.00 0.00 175.30 176.97 2ken s PHE 81 N -1.17 3.06 0.02 5.12 0.08 -1.26 -1.80 117.98 122.03 2ken s PHE 81 Ca 0.22 1.52 -0.06 0.00 0.12 0.00 0.00 56.93 58.73 2ken s PHE 81 Cb -0.12 -2.99 -0.01 0.00 -0.57 0.00 0.00 43.02 39.33 2ken s PHE 81 CO 0.12 -0.91 0.10 -1.14 -0.10 0.00 0.00 175.22 173.30 2ken s GLN 82 N -3.82 0.51 -0.24 0.44 0.74 -0.27 -4.61 119.66 112.42 2ken s GLN 82 Ca 0.64 -0.57 -0.08 0.00 0.05 0.00 0.00 55.36 55.40 2ken s GLN 82 Cb -0.15 0.20 -0.03 0.00 1.10 0.00 0.00 33.01 34.13 2ken s GLN 82 CO 0.31 -0.12 0.08 0.08 -0.55 0.00 0.00 175.29 175.09 2ken s VAL 83 N -1.92 4.53 -0.18 1.34 1.01 -1.08 0.43 120.40 124.53 2ken s VAL 83 Ca -0.11 -0.10 -0.06 0.00 0.00 0.00 0.00 61.98 61.71 2ken s VAL 83 Cb -0.05 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 2ken s VAL 83 CO -0.01 0.35 0.03 -1.10 0.00 0.00 0.00 175.10 174.37 2ken s GLN 84 N 1.35 3.83 -0.16 2.72 -0.21 -0.79 -1.58 119.66 124.83 2ken s GLN 84 Ca 0.05 -0.42 -0.07 0.00 0.02 0.00 0.00 55.36 54.94 2ken s GLN 84 Cb -0.15 -3.12 -0.04 0.00 1.00 0.00 0.00 33.01 30.70 2ken s GLN 84 CO 0.04 0.20 0.07 0.08 -2.12 0.00 0.00 175.29 173.57 2ken s VAL 85 N 0.52 4.91 0.00 1.09 1.01 -0.76 -3.31 120.40 123.86 2ken s VAL 85 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.99 2ken s VAL 85 Cb -0.13 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.06 2ken s VAL 85 CO 0.02 0.51 0.00 0.59 0.00 0.00 0.00 175.10 176.21 2ken n ASN 86 N 3.06 0.31 -4.40 3.32 3.02 -1.26 -2.59 115.26 116.73 2ken n ASN 86 Ca -0.17 -0.63 -0.31 0.00 -0.03 0.00 0.00 54.58 53.43 2ken n ASN 86 Cb 0.53 0.00 0.19 0.00 -0.61 0.00 0.00 39.78 39.89 2ken n ASN 86 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ken n LYS 87 N 0.00 -1.59 0.00 3.52 5.02 -1.26 -2.23 118.16 121.62 2ken n LYS 87 Ca 0.00 -0.43 0.00 0.00 -2.02 0.00 0.00 58.31 55.86 2ken n LYS 87 Cb 0.00 -1.94 0.00 0.00 -0.02 0.00 0.00 35.03 33.07 2ken n LYS 87 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2ken n ASN 88 N -2.94 0.00 -4.79 4.39 4.05 -1.26 -4.95 115.26 109.76 2ken n ASN 88 Ca 0.03 0.00 -0.31 0.00 0.45 0.00 0.00 54.58 54.75 2ken n ASN 88 Cb 0.57 -0.12 0.06 0.00 1.23 0.00 0.00 39.78 41.53 2ken n ASN 88 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 177.26 173.77 2ken s SER 89 N -0.70 5.02 0.08 1.20 0.01 -0.95 -4.86 113.70 113.50 2ken s SER 89 Ca 0.00 1.75 0.02 0.00 1.31 0.00 0.00 55.95 59.03 2ken s SER 89 Cb 0.00 -2.51 -0.03 0.00 0.21 0.00 0.00 66.02 63.68 2ken s SER 89 CO 0.00 -1.68 -0.08 -0.44 0.41 0.00 0.00 173.24 171.45 2ken s SER 90 N -3.45 1.13 -0.02 2.44 0.01 -0.99 -5.02 113.70 107.81 2ken s SER 90 Ca 0.60 -0.79 0.00 0.00 1.31 0.00 0.00 55.95 57.08 2ken s SER 90 Cb -0.16 0.05 0.03 0.00 0.21 0.00 0.00 66.02 66.14 2ken s SER 90 CO 0.53 -0.31 0.02 -0.63 0.41 0.00 0.00 173.24 173.25 2ken s ILE 91 N -2.49 0.02 -0.02 1.44 1.01 -1.26 -2.49 121.20 117.41 2ken s ILE 91 Ca 0.02 0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.85 2ken s ILE 91 Cb -0.02 -0.13 -0.00 0.00 0.01 0.00 0.00 42.46 42.31 2ken s ILE 91 CO -0.02 0.10 -0.10 -0.70 0.00 0.00 0.00 174.94 174.22 2ken s GLU 92 N 0.93 1.00 0.30 2.79 2.56 -1.02 -4.96 118.70 120.30 2ken s GLU 92 Ca -0.08 -0.35 -0.29 0.00 0.00 0.00 0.00 54.97 54.25 2ken s GLU 92 Cb -0.12 -0.94 -0.10 0.00 2.00 0.00 0.00 34.13 34.98 2ken s GLU 92 CO -0.02 0.16 1.15 0.15 -0.56 0.00 0.00 175.26 176.13 2ken s LYS 93 N 0.06 4.52 -0.16 4.30 1.02 -1.26 -1.25 119.74 126.97 2ken s LYS 93 Ca -0.01 1.89 -0.11 0.00 0.02 0.00 0.00 55.97 57.75 2ken s LYS 93 Cb -0.08 -3.10 -0.05 0.00 -0.52 0.00 0.00 37.83 34.09 2ken s LYS 93 CO 0.00 0.07 0.20 -1.17 -0.92 0.00 0.00 175.35 173.54 2ken s LEU 94 N -1.65 4.26 0.00 3.17 2.96 -1.10 -4.89 118.68 121.45 2ken s LEU 94 Ca 0.47 0.40 0.29 0.00 -0.22 0.00 0.00 54.13 55.07 2ken s LEU 94 Cb -0.33 -2.21 1.34 0.00 0.50 0.00 0.00 46.19 45.49 2ken s LEU 94 CO 0.43 0.20 1.93 -1.54 -1.32 0.00 0.00 176.35 176.05 2ken n SER 95 N 3.21 0.32 -4.05 3.68 3.41 -1.26 -4.51 113.62 114.41 2ken n SER 95 Ca -0.15 -0.48 -0.34 0.00 -0.26 0.00 0.00 58.87 57.64 2ken n SER 95 Cb 0.52 -0.13 -0.12 0.00 -0.26 0.00 0.00 64.21 64.23 2ken n SER 95 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2ken s GLU 96 N -2.48 2.15 0.84 4.33 2.56 -1.26 -5.10 118.70 119.74 2ken s GLU 96 Ca 0.30 -2.32 -0.14 0.00 0.00 0.00 0.00 54.97 52.80 2ken s GLU 96 Cb 0.20 -3.53 -0.00 0.00 2.00 0.00 0.00 34.13 32.80 2ken s GLU 96 CO 0.47 -1.11 0.48 -2.30 -0.56 0.00 0.00 175.26 172.24 2ken n PRO 97 N 3.73 0.03 -3.94 4.30 -0.02 -1.26 -4.97 135.00 132.87 2ken n PRO 97 Ca 0.04 0.06 -0.32 0.00 -2.02 0.00 0.00 63.50 61.26 2ken n PRO 97 Cb 0.38 -1.85 -0.05 0.00 -0.02 0.00 0.00 33.50 31.95 2ken n PRO 97 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2ken s ILE 98 N -2.14 5.30 0.00 4.25 1.01 -1.26 -5.05 121.20 123.31 2ken s ILE 98 Ca 0.61 -0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.96 2ken s ILE 98 Cb -0.28 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.67 2ken s ILE 98 CO 0.62 0.24 0.38 -0.62 0.00 0.00 0.00 174.94 175.57 2ken n GLU 99 N 0.67 0.00 -3.14 2.79 1.02 -1.26 -4.89 120.64 115.84 2ken n GLU 99 Ca -0.09 0.25 -0.13 0.00 -0.02 0.00 0.00 57.16 57.17 2ken n GLU 99 Cb 0.52 -0.88 0.06 0.00 -0.02 0.00 0.00 31.44 31.12 2ken n GLU 99 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2ken n VAL 100 N -0.63 -8.86 -1.85 2.62 0.31 -1.26 -3.54 118.33 105.12 2ken n VAL 100 Ca 0.00 -1.20 0.00 0.00 -0.01 0.00 0.00 64.34 63.13 2ken n VAL 100 Cb 0.00 -6.39 0.00 0.00 -0.91 0.00 0.00 33.84 26.54 2ken n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ken n GLY 101 N -1.29 0.67 3.44 2.92 0.00 -1.26 -5.02 105.19 104.65 2ken n GLY 101 Ca -0.06 -0.73 -0.44 0.00 0.00 0.00 0.00 46.02 44.79 2ken n GLY 101 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ken s LEU 102 N -0.21 5.26 0.00 0.99 2.96 -1.23 -4.72 118.68 121.73 2ken s LEU 102 Ca 0.00 -1.03 0.00 0.00 -0.22 0.00 0.00 54.13 52.88 2ken s LEU 102 Cb 0.00 -2.21 0.00 0.00 0.50 0.00 0.00 46.19 44.48 2ken s LEU 102 CO 0.00 -0.56 0.02 1.21 -1.32 0.00 0.00 176.35 175.70 2ken n GLU 103 N 5.29 0.00 -2.79 1.98 2.13 -1.26 -5.00 120.64 120.99 2ken n GLU 103 Ca -0.11 -0.02 -0.03 0.00 0.66 0.00 0.00 57.16 57.66 2ken n GLU 103 Cb 0.46 -0.15 -0.03 0.00 0.27 0.00 0.00 31.44 31.99 2ken n GLU 103 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 2ken n HIS 104 N 0.00 -2.94 -4.11 4.31 8.25 -1.26 -5.02 115.22 114.45 2ken n HIS 104 Ca 0.00 1.65 -0.17 0.00 -0.26 0.00 0.00 57.72 58.94 2ken n HIS 104 Cb 0.29 -2.95 -0.15 0.00 1.12 0.00 0.00 29.99 28.30 2ken n HIS 104 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2ken s HIS 105 N -0.61 0.49 0.38 4.41 2.46 -1.26 -5.14 115.29 116.02 2ken s HIS 105 Ca -0.16 -0.09 -0.24 0.00 0.47 0.00 0.00 55.06 55.04 2ken s HIS 105 Cb 0.01 -0.39 -0.10 0.00 -0.13 0.00 0.00 32.58 31.97 2ken s HIS 105 CO 0.53 -0.07 0.99 -3.38 -2.47 0.00 0.00 174.74 170.34 2ken s HIS 106 N 0.31 3.41 0.37 3.88 -3.43 -1.26 -5.01 115.29 113.56 2ken s HIS 106 Ca -0.03 1.68 -0.25 0.00 -0.80 0.00 0.00 55.06 55.66 2ken s HIS 106 Cb -0.07 -3.00 -0.09 0.00 -1.43 0.00 0.00 32.58 27.99 2ken s HIS 106 CO -0.00 -0.25 1.04 -1.01 -2.00 0.00 0.00 174.74 172.52 2ken s HIS 107 N -1.76 3.38 0.12 0.38 0.09 -1.26 -4.85 115.29 111.39 2ken s HIS 107 Ca 0.56 1.67 0.00 0.00 -0.00 0.00 0.00 55.06 57.30 2ken s HIS 107 Cb -0.18 -3.13 0.00 0.00 -0.00 0.00 0.00 32.58 29.27 2ken s HIS 107 CO 0.23 -0.50 0.00 0.72 -0.00 0.00 0.00 174.74 175.19 2ken n HIS 108 N 0.23 -2.44 1.39 1.40 8.25 -1.26 -5.36 115.22 117.43 2ken n HIS 108 Ca 0.04 0.63 0.11 0.00 -0.26 0.00 0.00 57.72 58.24 2ken n HIS 108 Cb 0.49 -1.13 0.66 0.00 1.12 0.00 0.00 29.99 31.12 2ken n HIS 108 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70