#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 0.00 -1.68 2.12 4.71 -1.26 -4.76 120.64 119.77 2ken n GLU 2 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.16 56.73 2ken n GLU 2 Cb 0.00 -0.79 -0.00 0.00 -1.01 0.00 0.00 31.44 29.64 2ken n GLU 2 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 2ken n PRO 3 N 4.43 1.93 -2.64 3.49 -0.02 -1.26 -4.92 135.00 136.02 2ken n PRO 3 Ca 0.40 0.68 -0.43 0.00 -2.02 0.00 0.00 63.50 62.14 2ken n PRO 3 Cb 0.04 -2.28 -0.02 0.00 -0.02 0.00 0.00 33.50 31.23 2ken n PRO 3 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2ken s GLN 4 N -1.96 4.18 -0.16 -0.52 -0.21 -1.26 -4.99 119.66 114.74 2ken s GLN 4 Ca 0.58 1.27 -0.16 0.00 0.02 0.00 0.00 55.36 57.06 2ken s GLN 4 Cb -0.56 -3.68 -0.04 0.00 1.00 0.00 0.00 33.01 29.72 2ken s GLN 4 CO 0.60 -0.74 0.41 -0.51 -2.12 0.00 0.00 175.29 172.93 2ken s LEU 5 N 3.40 4.22 0.10 2.90 1.43 -1.25 -1.87 118.68 127.60 2ken s LEU 5 Ca 0.45 0.63 0.06 0.00 -1.03 0.00 0.00 54.13 54.24 2ken s LEU 5 Cb -0.14 -2.56 -0.03 0.00 0.03 0.00 0.00 46.19 43.49 2ken s LEU 5 CO 0.10 -0.01 -0.15 0.28 0.23 0.00 0.00 176.35 176.80 2ken s THR 6 N 0.88 1.27 -0.04 5.49 -1.32 -1.08 -4.98 115.64 115.87 2ken s THR 6 Ca 0.21 -1.56 -0.18 0.00 -1.21 0.00 0.00 61.69 58.95 2ken s THR 6 Cb -0.14 -1.37 -0.05 0.00 -1.51 0.00 0.00 72.50 69.42 2ken s THR 6 CO 0.08 -0.33 0.50 -0.54 -2.21 0.00 0.00 174.62 172.12 2ken s LYS 7 N -2.29 4.21 0.44 7.08 1.02 -1.26 -4.81 119.74 124.12 2ken s LYS 7 Ca 0.05 0.54 0.21 0.00 0.02 0.00 0.00 55.97 56.79 2ken s LYS 7 Cb -0.07 -3.33 1.17 0.00 -0.52 0.00 0.00 37.83 35.07 2ken s LYS 7 CO 0.03 0.41 1.84 -0.84 -0.92 0.00 0.00 175.35 175.87 2ken h ILE 8 N 4.16 0.61 0.00 2.17 3.07 -1.97 0.84 117.51 126.39 2ken h ILE 8 Ca -0.46 -0.11 0.00 0.00 1.55 0.00 0.00 64.86 65.84 2ken h ILE 8 Cb 1.20 0.25 0.00 0.00 -0.27 0.00 0.00 36.82 38.00 2ken h ILE 8 CO 0.69 0.06 0.00 0.55 -1.05 0.00 0.00 178.15 178.40 2ken n VAL 9 N -4.49 0.00 -0.12 0.16 3.14 -1.26 -2.10 118.33 113.66 2ken n VAL 9 Ca 0.21 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.59 2ken n VAL 9 Cb 0.80 -0.63 0.00 0.00 -1.06 0.00 0.00 33.84 32.95 2ken n VAL 9 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 2ken n ASP 10 N -0.93 1.45 0.11 6.55 8.00 0.29 -4.76 116.55 127.27 2ken n ASP 10 Ca 0.12 -1.58 -0.13 0.00 0.71 0.00 0.00 54.79 53.91 2ken n ASP 10 Cb 0.06 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.07 2ken n ASP 10 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2ken h ILE 11 N 0.29 0.89 -1.38 0.53 2.04 -1.26 -3.44 117.51 115.17 2ken h ILE 11 Ca 0.00 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.44 2ken h ILE 11 Cb 0.39 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2ken h ILE 11 CO 0.00 0.10 0.00 1.33 0.00 0.00 0.00 178.15 179.58 2ken n VAL 12 N -5.11 0.00 -3.15 1.67 0.24 -1.26 -4.69 118.33 106.02 2ken n VAL 12 Ca -0.09 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.26 2ken n VAL 12 Cb 0.20 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.55 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 -0.81 0.17 0.20 7.34 2.56 -1.26 -5.14 118.70 121.76 2ken s GLU 13 Ca 0.00 0.29 -0.27 0.00 0.00 0.00 0.00 54.97 55.00 2ken s GLU 13 Cb 0.00 0.16 -0.08 0.00 2.00 0.00 0.00 34.13 36.21 2ken s GLU 13 CO 0.00 -0.19 0.84 0.54 -0.56 0.00 0.00 175.26 175.89 2ken s ASN 14 N 2.96 7.46 -0.13 -1.70 4.22 -1.26 -3.49 114.94 122.98 2ken s ASN 14 Ca -0.01 1.75 0.00 0.00 -2.14 0.00 0.00 52.86 52.45 2ken s ASN 14 Cb -0.10 -2.54 0.00 0.00 1.28 0.00 0.00 41.25 39.90 2ken s ASN 14 CO -0.11 0.17 0.00 0.61 -2.04 0.00 0.00 177.10 175.73 2ken n GLY 15 N 1.45 0.50 3.79 0.45 0.00 0.10 -4.95 105.19 106.53 2ken n GLY 15 Ca -0.04 -0.76 -0.38 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.65 4.15 -0.20 1.61 0.74 -1.23 -4.76 119.66 118.32 2ken s GLN 16 Ca 0.00 0.57 -0.10 0.00 0.05 0.00 0.00 55.36 55.88 2ken s GLN 16 Cb 0.00 -3.29 -0.05 0.00 1.10 0.00 0.00 33.01 30.77 2ken s GLN 16 CO 0.00 0.52 0.13 -1.58 -0.55 0.00 0.00 175.29 173.81 2ken s TRP 17 N -0.62 3.40 0.20 1.67 0.52 -1.26 -1.85 118.94 121.00 2ken s TRP 17 Ca 0.27 0.32 -0.08 0.00 0.02 0.00 0.00 56.10 56.64 2ken s TRP 17 Cb -0.18 -2.17 0.03 0.00 -1.15 0.00 0.00 33.47 30.01 2ken s TRP 17 CO 0.15 0.28 0.40 0.00 0.02 0.00 0.00 176.95 177.80 2ken n ALA 18 N 3.56 -0.91 -2.86 0.98 0.00 -1.06 -4.99 120.51 115.22 2ken n ALA 18 Ca -0.16 -0.65 -0.13 0.00 0.00 0.00 0.00 53.44 52.51 2ken n ALA 18 Cb 0.52 0.52 -0.13 0.00 0.00 0.00 0.00 19.45 20.35 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 -2.06 0.33 -0.13 0.00 0.01 -0.78 -2.82 114.94 109.49 2ken s ASN 19 Ca 0.08 -0.20 -0.27 0.00 -0.71 0.00 0.00 52.86 51.76 2ken s ASN 19 Cb -0.03 0.01 0.07 0.00 0.41 0.00 0.00 41.25 41.71 2ken s ASN 19 CO 0.06 -0.07 0.66 -0.22 -1.51 0.00 0.00 177.10 176.02 2ken s LEU 20 N -0.55 -0.56 -0.09 0.60 2.96 -0.91 -2.63 118.68 117.49 2ken s LEU 20 Ca -0.04 0.96 -0.06 0.00 -0.22 0.00 0.00 54.13 54.78 2ken s LEU 20 Cb -0.04 2.40 -0.04 0.00 0.50 0.00 0.00 46.19 49.01 2ken s LEU 20 CO -0.00 -0.45 0.15 -1.59 -1.32 0.00 0.00 176.35 173.14 2ken s LYS 21 N -0.55 3.44 0.12 1.98 -2.85 -1.26 -1.98 119.74 118.64 2ken s LYS 21 Ca -0.07 -0.19 -0.18 0.00 -1.00 0.00 0.00 55.97 54.54 2ken s LYS 21 Cb -0.02 -3.16 0.04 0.00 -2.06 0.00 0.00 37.83 32.63 2ken s LYS 21 CO 0.06 0.75 0.44 0.00 0.10 0.00 0.00 175.35 176.70 2ken s ALA 22 N -1.12 -1.07 0.11 0.59 0.00 -0.95 -4.92 121.76 114.41 2ken s ALA 22 Ca 0.19 0.11 -0.02 0.00 0.00 0.00 0.00 51.96 52.24 2ken s ALA 22 Cb -0.12 0.66 -0.05 0.00 0.00 0.00 0.00 23.12 23.61 2ken s ALA 22 CO 0.08 -0.63 0.30 -1.59 0.00 0.00 0.00 175.76 173.92 2ken s LYS 23 N -3.56 3.52 -0.61 0.00 -2.85 -1.14 -2.19 119.74 112.92 2ken s LYS 23 Ca 0.01 -0.28 -0.22 0.00 -1.00 0.00 0.00 55.97 54.48 2ken s LYS 23 Cb 0.01 -2.94 0.07 0.00 -2.06 0.00 0.00 37.83 32.91 2ken s LYS 23 CO -0.10 0.53 0.88 0.08 0.10 0.00 0.00 175.35 176.84 2ken s VAL 24 N -1.61 4.47 0.11 1.79 1.01 -1.10 0.35 120.40 125.41 2ken s VAL 24 Ca 0.38 -0.32 0.19 0.00 0.00 0.00 0.00 61.98 62.22 2ken s VAL 24 Cb -0.12 -4.58 0.14 0.00 0.00 0.00 0.00 36.38 31.81 2ken s VAL 24 CO 0.27 -1.26 1.70 0.40 0.00 0.00 0.00 175.10 176.20 2ken h ILE 25 N 5.96 0.83 -1.94 2.22 2.04 -1.80 -1.16 117.51 123.66 2ken h ILE 25 Ca -0.28 -1.59 0.19 0.00 1.00 0.00 0.00 64.86 64.18 2ken h ILE 25 Cb 1.08 1.99 -0.15 0.00 -0.74 0.00 0.00 36.82 39.00 2ken h ILE 25 CO 1.13 0.37 0.63 -1.58 0.00 0.00 0.00 178.15 178.70 2ken s GLN 26 N -3.50 0.66 0.11 2.37 0.74 -1.24 -4.83 119.66 113.97 2ken s GLN 26 Ca 0.01 -0.28 0.03 0.00 0.05 0.00 0.00 55.36 55.17 2ken s GLN 26 Cb 0.10 0.28 -0.04 0.00 1.10 0.00 0.00 33.01 34.45 2ken s GLN 26 CO 0.69 -0.29 -0.09 -0.51 -0.55 0.00 0.00 175.29 174.54 2ken s LEU 27 N -2.50 2.48 -0.14 3.68 1.43 -1.26 -2.50 118.68 119.87 2ken s LEU 27 Ca 0.08 -0.94 -0.07 0.00 -1.03 0.00 0.00 54.13 52.18 2ken s LEU 27 Cb -0.00 -0.25 0.06 0.00 0.03 0.00 0.00 46.19 46.03 2ken s LEU 27 CO -0.06 -0.35 0.31 0.86 0.23 0.00 0.00 176.35 177.35 2ken s TRP 28 N -3.10 -0.46 -0.14 0.29 -0.00 0.58 -4.92 118.94 111.20 2ken s TRP 28 Ca 0.11 1.03 -0.15 0.00 -0.00 0.00 0.00 56.10 57.09 2ken s TRP 28 Cb 0.01 0.13 -0.05 0.00 -0.00 0.00 0.00 33.47 33.56 2ken s TRP 28 CO -0.01 -0.30 0.34 -1.83 -0.00 0.00 0.00 176.95 175.14 2ken s GLU 29 N 1.56 4.21 0.40 5.86 1.03 -1.26 -0.89 118.70 129.61 2ken s GLU 29 Ca -0.07 0.19 0.02 0.00 0.03 0.00 0.00 54.97 55.13 2ken s GLU 29 Cb -0.10 -3.40 -0.01 0.00 -0.80 0.00 0.00 34.13 29.82 2ken s GLU 29 CO -0.10 0.29 0.59 0.54 -1.33 0.00 0.00 175.26 175.24 2ken s ASN 30 N 0.30 5.96 0.00 0.83 4.22 -1.20 -4.97 114.94 120.08 2ken s ASN 30 Ca 0.19 0.19 0.16 0.00 -2.14 0.00 0.00 52.86 51.26 2ken s ASN 30 Cb -0.14 -1.56 0.29 0.00 1.28 0.00 0.00 41.25 41.13 2ken s ASN 30 CO 0.06 -0.54 1.20 1.07 -2.04 0.00 0.00 177.10 176.85 2ken n THR 31 N -1.90 0.51 -3.66 0.54 5.66 -1.26 -4.93 114.28 109.24 2ken n THR 31 Ca -0.01 -0.75 -0.37 0.00 -3.05 0.00 0.00 64.05 59.87 2ken n THR 31 Cb 0.57 0.91 -0.06 0.00 -1.55 0.00 0.00 70.33 70.21 2ken n THR 31 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 2ken s HIS 32 N -1.18 3.66 0.27 1.09 3.76 -1.26 -4.98 115.29 116.65 2ken s HIS 32 Ca 0.27 0.78 0.17 0.00 -0.15 0.00 0.00 55.06 56.13 2ken s HIS 32 Cb 0.16 -2.15 0.77 0.00 1.11 0.00 0.00 32.58 32.47 2ken s HIS 32 CO 0.22 0.66 1.79 0.93 -0.85 0.00 0.00 174.74 177.49 2ken h GLU 33 N 4.94 0.00 -0.38 1.40 5.08 -1.99 -3.05 114.58 120.58 2ken h GLU 33 Ca -0.52 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 2ken h GLU 33 Cb 1.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 2ken h GLU 33 CO 0.61 0.36 0.25 1.03 -1.00 0.00 0.00 179.01 180.26 2ken h SER 34 N 0.00 0.44 -3.58 1.42 0.87 -2.00 -3.41 113.55 107.29 2ken h SER 34 Ca -0.00 -0.01 -0.68 0.00 -1.23 0.00 0.00 61.79 59.86 2ken h SER 34 Cb 0.77 -0.11 -0.17 0.00 -0.44 0.00 0.00 62.40 62.45 2ken h SER 34 CO 0.05 0.32 -0.68 -0.63 -0.53 0.00 0.00 176.83 175.35 2ken s ILE 35 N -6.15 3.79 -0.18 2.23 1.01 -1.15 -4.23 121.20 116.52 2ken s ILE 35 Ca -0.13 -0.56 -0.14 0.00 0.00 0.00 0.00 60.65 59.81 2ken s ILE 35 Cb 0.11 -2.60 -0.08 0.00 0.01 0.00 0.00 42.46 39.89 2ken s ILE 35 CO 0.72 0.51 -0.14 -1.54 0.00 0.00 0.00 174.94 174.49 2ken n SER 36 N 1.91 1.86 -3.75 3.58 3.41 0.14 -4.43 113.62 116.34 2ken n SER 36 Ca -0.17 0.49 -0.10 0.00 -0.26 0.00 0.00 58.87 58.83 2ken n SER 36 Cb 0.53 -0.86 -0.06 0.00 -0.26 0.00 0.00 64.21 63.55 2ken n SER 36 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2ken s GLN 37 N -2.44 0.91 -0.08 4.33 -0.21 -1.01 -3.22 119.66 117.94 2ken s GLN 37 Ca -0.24 -0.75 -0.09 0.00 0.02 0.00 0.00 55.36 54.31 2ken s GLN 37 Cb 0.05 0.39 0.02 0.00 1.00 0.00 0.00 33.01 34.47 2ken s GLN 37 CO 0.38 -0.32 0.24 0.54 -2.12 0.00 0.00 175.29 174.01 2ken s VAL 38 N -3.49 0.01 0.00 1.09 0.11 -0.06 -0.62 120.40 117.44 2ken s VAL 38 Ca 0.02 -0.08 0.00 0.00 -2.93 0.00 0.00 61.98 58.99 2ken s VAL 38 Cb 0.02 -0.36 0.00 0.00 -1.53 0.00 0.00 36.38 34.51 2ken s VAL 38 CO -0.09 -0.04 0.00 0.61 -3.33 0.00 0.00 175.10 172.24 2ken n GLY 39 N 2.74 2.88 3.35 6.54 0.00 -1.08 -0.30 105.19 119.31 2ken n GLY 39 Ca -0.14 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.60 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 2.18 -0.14 0.99 2.96 -1.04 -2.70 118.68 120.93 2ken s LEU 40 Ca 0.00 -0.57 -0.01 0.00 -0.22 0.00 0.00 54.13 53.33 2ken s LEU 40 Cb 0.00 -1.31 -0.02 0.00 0.50 0.00 0.00 46.19 45.37 2ken s LEU 40 CO 0.00 0.27 -0.10 -0.76 -1.32 0.00 0.00 176.35 174.43 2ken s LEU 41 N -1.17 2.84 -0.65 -0.68 1.43 0.66 -2.30 118.68 118.81 2ken s LEU 41 Ca 0.12 -0.29 -0.20 0.00 -1.03 0.00 0.00 54.13 52.72 2ken s LEU 41 Cb -0.10 -1.66 0.10 0.00 0.03 0.00 0.00 46.19 44.56 2ken s LEU 41 CO 0.02 0.15 0.83 -0.83 0.23 0.00 0.00 176.35 176.75 2ken s GLY 42 N 0.47 1.66 0.19 -3.19 0.00 0.15 -2.40 107.32 104.20 2ken s GLY 42 Ca -0.08 -2.15 0.03 0.00 0.00 0.00 0.00 44.72 42.52 2ken s GLY 42 CO 0.04 1.78 0.33 0.99 0.00 0.00 0.00 173.10 176.24 2ken s ASP 43 N 3.62 6.34 0.42 1.64 1.01 0.44 -2.89 116.67 127.25 2ken s ASP 43 Ca 0.17 0.19 0.29 0.00 0.71 0.00 0.00 52.55 53.92 2ken s ASP 43 Cb -0.20 -1.92 1.26 0.00 1.01 0.00 0.00 42.92 43.07 2ken s ASP 43 CO 0.06 -0.01 1.87 1.05 0.21 0.00 0.00 175.17 178.36 2ken h GLU 44 N 1.82 0.00 0.00 8.23 4.11 -1.91 -2.12 114.58 124.70 2ken h GLU 44 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2ken h GLU 44 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2ken h GLU 44 CO 0.66 0.00 -0.98 0.25 0.07 0.00 0.00 179.01 179.01 2ken n THR 45 N -2.68 0.04 0.00 -1.06 -2.24 -1.26 -5.03 114.28 102.05 2ken n THR 45 Ca 0.01 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2ken n THR 45 Cb 0.24 0.61 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 -0.42 3.23 3.38 0.00 -0.80 -4.82 105.19 107.21 2ken n GLY 46 Ca 0.03 -0.71 -0.13 0.00 0.00 0.00 0.00 46.02 45.21 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 0.88 -0.20 -0.61 -5.25 -1.26 -0.42 121.20 110.34 2ken s ILE 47 Ca 0.00 -2.00 -0.27 0.00 -0.99 0.00 0.00 60.65 57.39 2ken s ILE 47 Cb 0.00 -1.90 0.08 0.00 2.95 0.00 0.00 42.46 43.60 2ken s ILE 47 CO 0.00 -0.69 0.78 -0.51 -1.79 0.00 0.00 174.94 172.73 2ken s ILE 48 N -3.52 0.00 0.09 8.37 2.07 -1.01 -4.95 121.20 122.25 2ken s ILE 48 Ca 0.18 0.00 -0.04 0.00 -1.41 0.00 0.00 60.65 59.38 2ken s ILE 48 Cb 0.05 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.59 2ken s ILE 48 CO 0.00 0.00 0.30 -0.54 -1.91 0.00 0.00 174.94 172.79 2ken s LYS 49 N -0.25 3.55 0.07 3.50 1.02 -1.26 -0.25 119.74 126.13 2ken s LYS 49 Ca -0.03 -0.20 -0.00 0.00 0.02 0.00 0.00 55.97 55.76 2ken s LYS 49 Cb -0.03 -2.96 -0.04 0.00 -0.52 0.00 0.00 37.83 34.28 2ken s LYS 49 CO 0.03 0.55 -0.04 -0.59 -0.92 0.00 0.00 175.35 174.38 2ken s PHE 50 N -1.53 0.65 -0.03 3.18 -0.71 -1.10 -2.73 117.98 115.71 2ken s PHE 50 Ca 0.36 -1.02 0.02 0.00 -1.04 0.00 0.00 56.93 55.25 2ken s PHE 50 Cb -0.13 -0.43 0.01 0.00 -1.21 0.00 0.00 43.02 41.26 2ken s PHE 50 CO 0.24 -0.30 -0.06 -0.08 -1.34 0.00 0.00 175.22 173.68 2ken s THR 51 N -3.82 0.57 -0.19 -4.49 -1.32 -0.47 -2.65 115.64 103.26 2ken s THR 51 Ca 0.09 -0.20 -0.08 0.00 -1.21 0.00 0.00 61.69 60.29 2ken s THR 51 Cb 0.07 -0.55 -0.04 0.00 -1.51 0.00 0.00 72.50 70.47 2ken s THR 51 CO -0.08 0.21 0.08 -0.63 -2.21 0.00 0.00 174.62 171.99 2ken s ILE 52 N 0.53 4.95 0.13 5.08 1.01 0.21 -1.86 121.20 131.26 2ken s ILE 52 Ca -0.07 0.03 -0.21 0.00 0.00 0.00 0.00 60.65 60.39 2ken s ILE 52 Cb -0.11 -3.25 -0.07 0.00 0.01 0.00 0.00 42.46 39.04 2ken s ILE 52 CO 0.00 0.45 0.66 0.26 0.00 0.00 0.00 174.94 176.31 2ken s TRP 53 N 0.43 3.82 0.62 3.97 0.52 -1.09 0.23 118.94 127.43 2ken s TRP 53 Ca 0.04 1.40 0.30 0.00 0.02 0.00 0.00 56.10 57.87 2ken s TRP 53 Cb -0.12 -2.60 1.67 0.00 -1.15 0.00 0.00 33.47 31.27 2ken s TRP 53 CO -0.00 0.53 2.02 0.87 0.02 0.00 0.00 176.95 180.39 2ken h LYS 54 N 4.29 0.00 0.00 4.98 1.79 -1.78 0.44 116.57 126.28 2ken h LYS 54 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 2ken h LYS 54 Cb 1.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.86 2ken h LYS 54 CO 0.65 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 179.11 2ken n ASN 55 N -3.46 0.00 0.03 0.86 3.02 -1.26 -2.60 115.26 111.85 2ken n ASN 55 Ca 0.02 0.16 -0.14 0.00 -0.03 0.00 0.00 54.58 54.59 2ken n ASN 55 Cb 0.41 -0.35 -0.14 0.00 -0.61 0.00 0.00 39.78 39.09 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 2.80 0.47 -5.99 5.41 0.00 -0.40 -3.36 119.26 118.19 2ken h ALA 56 Ca 0.00 -1.26 -0.39 0.00 0.00 0.00 0.00 54.91 53.26 2ken h ALA 56 Cb 0.21 0.39 0.09 0.00 0.00 0.00 0.00 17.79 18.49 2ken h ALA 56 CO 0.00 1.32 -0.85 0.39 0.00 0.00 0.00 179.25 180.12 2ken n GLU 57 N -3.32 -4.05 -4.07 0.00 1.02 -1.07 -4.61 120.64 104.53 2ken n GLU 57 Ca -0.18 0.64 -0.26 0.00 -0.02 0.00 0.00 57.16 57.34 2ken n GLU 57 Cb 1.04 -5.14 -0.05 0.00 -0.02 0.00 0.00 31.44 27.27 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 -6.44 3.85 0.74 -4.62 1.02 -1.26 -5.10 118.68 106.88 2ken s LEU 58 Ca 0.14 -0.12 -0.14 0.00 0.02 0.00 0.00 54.13 54.04 2ken s LEU 58 Cb -0.04 -2.45 0.05 0.00 0.02 0.00 0.00 46.19 43.77 2ken s LEU 58 CO 0.80 0.06 1.16 -2.16 0.02 0.00 0.00 176.35 176.23 2ken s PRO 59 N -3.19 2.16 0.31 1.29 0.04 -1.26 -4.97 135.00 129.38 2ken s PRO 59 Ca 0.31 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.62 2ken s PRO 59 Cb -0.10 -1.86 -0.10 0.00 0.04 0.00 0.00 34.50 32.48 2ken s PRO 59 CO 0.24 -1.78 1.24 -0.51 0.04 0.00 0.00 177.00 176.24 2ken s LEU 60 N -5.40 4.47 0.42 -3.56 1.43 -1.26 -5.01 118.68 109.77 2ken s LEU 60 Ca 0.69 2.55 -0.16 0.00 -1.03 0.00 0.00 54.13 56.19 2ken s LEU 60 Cb -0.24 -3.64 -0.08 0.00 0.03 0.00 0.00 46.19 42.25 2ken s LEU 60 CO 0.48 -0.41 0.86 -0.76 0.23 0.00 0.00 176.35 176.75 2ken s LEU 61 N -1.62 3.84 -0.15 1.79 1.02 -1.26 -5.06 118.68 117.24 2ken s LEU 61 Ca 0.48 1.41 -0.06 0.00 0.02 0.00 0.00 54.13 55.98 2ken s LEU 61 Cb -0.37 -4.29 -0.04 0.00 0.02 0.00 0.00 46.19 41.51 2ken s LEU 61 CO 0.49 -0.40 0.05 -0.70 0.02 0.00 0.00 176.35 175.80 2ken s GLU 62 N -3.58 3.68 0.30 1.70 2.12 -1.26 -5.05 118.70 116.61 2ken s GLU 62 Ca 0.56 -0.34 -0.29 0.00 0.36 0.00 0.00 54.97 55.26 2ken s GLU 62 Cb -0.10 -3.10 -0.10 0.00 0.26 0.00 0.00 34.13 31.09 2ken s GLU 62 CO 0.24 0.43 1.30 -0.65 -0.54 0.00 0.00 175.26 176.03 2ken s GLN 63 N -0.07 4.38 0.00 4.30 -0.21 -1.26 -2.27 119.66 124.53 2ken s GLN 63 Ca 0.06 2.16 0.00 0.00 0.02 0.00 0.00 55.36 57.60 2ken s GLN 63 Cb -0.12 -3.10 0.00 0.00 1.00 0.00 0.00 33.01 30.79 2ken s GLN 63 CO 0.01 -0.17 0.00 0.41 -2.12 0.00 0.00 175.29 173.42 2ken n GLY 64 N 1.14 2.24 3.89 3.09 0.00 -0.44 -4.99 105.19 110.11 2ken n GLY 64 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 2ken n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ken s GLU 65 N -0.24 3.68 0.21 1.61 2.56 -0.96 -4.84 118.70 120.72 2ken s GLU 65 Ca 0.00 0.02 -0.13 0.00 0.00 0.00 0.00 54.97 54.86 2ken s GLU 65 Cb 0.00 -2.79 -0.08 0.00 2.00 0.00 0.00 34.13 33.27 2ken s GLU 65 CO 0.00 0.42 0.60 -1.54 -0.56 0.00 0.00 175.26 174.18 2ken s SER 66 N -2.40 6.77 0.03 -1.70 1.04 -1.26 -2.71 113.70 113.47 2ken s SER 66 Ca 0.43 1.09 -0.03 0.00 0.48 0.00 0.00 55.95 57.92 2ken s SER 66 Cb -0.12 -2.29 -0.02 0.00 0.10 0.00 0.00 66.02 63.69 2ken s SER 66 CO 0.23 -0.02 0.03 -0.31 0.98 0.00 0.00 173.24 174.16 2ken s TYR 67 N -1.69 0.24 -0.14 5.02 2.02 -0.93 -2.74 117.35 119.13 2ken s TYR 67 Ca 0.45 -0.53 -0.04 0.00 -0.37 0.00 0.00 57.07 56.57 2ken s TYR 67 Cb -0.13 -0.18 -0.03 0.00 -0.40 0.00 0.00 41.96 41.22 2ken s TYR 67 CO 0.20 -0.28 0.02 -1.17 -1.57 0.00 0.00 175.55 172.75 2ken s LEU 68 N -1.82 3.61 -0.34 -1.29 2.96 0.95 -2.24 118.68 120.52 2ken s LEU 68 Ca -0.10 0.06 -0.06 0.00 -0.22 0.00 0.00 54.13 53.82 2ken s LEU 68 Cb -0.05 -1.87 0.04 0.00 0.50 0.00 0.00 46.19 44.82 2ken s LEU 68 CO -0.03 0.25 0.09 -0.76 -1.32 0.00 0.00 176.35 174.59 2ken s LEU 69 N -0.12 4.29 -0.01 -0.68 1.43 -0.84 -2.40 118.68 120.35 2ken s LEU 69 Ca 0.05 -1.19 0.04 0.00 -1.03 0.00 0.00 54.13 52.01 2ken s LEU 69 Cb -0.12 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 2ken s LEU 69 CO 0.02 -0.33 -0.13 -0.13 0.23 0.00 0.00 176.35 176.01 2ken s ARG 70 N 1.37 2.40 -1.11 1.70 0.52 -1.10 -2.15 118.95 120.59 2ken s ARG 70 Ca -0.02 -0.78 -0.08 0.00 -0.52 0.00 0.00 55.73 54.33 2ken s ARG 70 Cb -0.20 -2.37 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 2ken s ARG 70 CO 0.02 0.60 0.88 0.45 0.02 0.00 0.00 175.30 177.26 2ken n SER 71 N 1.87 -5.37 -4.68 0.23 2.88 -1.25 -2.00 113.62 105.30 2ken n SER 71 Ca -0.16 -0.78 -0.24 0.00 -1.33 0.00 0.00 58.87 56.36 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 -3.43 3.00 0.15 2.46 -7.23 -1.13 -3.75 120.40 110.47 2ken s VAL 72 Ca 0.37 -1.84 0.08 0.00 -1.81 0.00 0.00 61.98 58.78 2ken s VAL 72 Cb -0.07 -2.89 -0.04 0.00 0.56 0.00 0.00 36.38 33.94 2ken s VAL 72 CO 0.77 -0.24 -0.17 0.54 -0.31 0.00 0.00 175.10 175.70 2ken s VAL 73 N -2.43 1.68 -0.15 1.32 0.11 -1.25 -2.58 120.40 117.11 2ken s VAL 73 Ca 0.35 -1.85 -0.15 0.00 -2.93 0.00 0.00 61.98 57.41 2ken s VAL 73 Cb -0.03 -1.75 -0.05 0.00 -1.53 0.00 0.00 36.38 33.03 2ken s VAL 73 CO 0.21 -0.33 0.33 -0.69 -3.33 0.00 0.00 175.10 171.29 2ken s VAL 74 N -2.04 5.28 0.08 2.04 1.01 -0.77 -2.37 120.40 123.63 2ken s VAL 74 Ca 0.14 0.63 0.01 0.00 0.00 0.00 0.00 61.98 62.75 2ken s VAL 74 Cb -0.06 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 2ken s VAL 74 CO 0.05 0.38 0.21 -0.83 0.00 0.00 0.00 175.10 174.91 2ken s GLY 75 N 0.50 2.07 -0.74 4.51 0.00 0.22 0.03 107.32 113.91 2ken s GLY 75 Ca 0.18 -0.90 -0.20 0.00 0.00 0.00 0.00 44.72 43.81 2ken s GLY 75 CO 0.05 -0.88 0.93 1.85 0.00 0.00 0.00 173.10 175.04 2ken s GLU 76 N -2.65 3.28 -0.59 2.90 2.12 -1.26 -2.48 118.70 120.02 2ken s GLU 76 Ca 0.34 -1.38 -0.19 0.00 0.36 0.00 0.00 54.97 54.10 2ken s GLU 76 Cb -0.12 -4.47 0.10 0.00 0.26 0.00 0.00 34.13 29.90 2ken s GLU 76 CO 0.28 -1.69 0.69 -0.47 -0.54 0.00 0.00 175.26 173.52 2ken s TYR 77 N 2.96 3.02 0.00 5.30 5.04 -0.73 -4.96 117.35 127.98 2ken s TYR 77 Ca 0.22 -0.98 0.00 0.00 -2.44 0.00 0.00 57.07 53.87 2ken s TYR 77 Cb -0.15 -3.98 0.00 0.00 0.35 0.00 0.00 41.96 38.18 2ken s TYR 77 CO 0.01 -1.27 0.00 0.27 -1.34 0.00 0.00 175.55 173.23 2ken n ASN 78 N 6.24 0.00 0.04 4.32 6.94 -1.26 0.76 115.26 132.29 2ken n ASN 78 Ca -0.10 0.00 0.09 0.00 -0.02 0.00 0.00 54.58 54.56 2ken n ASN 78 Cb 0.42 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 37.75 2ken n ASN 78 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2ken n ASP 79 N 3.41 0.42 -4.97 0.53 8.00 -1.26 -4.94 116.55 117.73 2ken n ASP 79 Ca 0.00 0.16 -0.21 0.00 0.71 0.00 0.00 54.79 55.46 2ken n ASP 79 Cb 0.00 1.17 -0.01 0.00 -0.02 0.00 0.00 41.12 42.26 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 -3.36 3.27 0.07 -1.24 3.52 0.23 -5.11 118.95 116.33 2ken s ARG 80 Ca -0.05 -0.78 0.01 0.00 -0.13 0.00 0.00 55.73 54.78 2ken s ARG 80 Cb 0.11 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.67 2ken s ARG 80 CO 0.85 0.16 0.19 -0.06 -0.81 0.00 0.00 175.30 175.63 2ken s PHE 81 N -2.17 3.46 -0.00 5.12 0.08 -1.26 -1.77 117.98 121.44 2ken s PHE 81 Ca 0.41 0.21 -0.05 0.00 0.12 0.00 0.00 56.93 57.61 2ken s PHE 81 Cb -0.09 -1.73 -0.00 0.00 -0.57 0.00 0.00 43.02 40.63 2ken s PHE 81 CO 0.32 0.57 0.10 -1.14 -0.10 0.00 0.00 175.22 174.97 2ken s GLN 82 N -2.54 0.39 -0.22 0.44 0.74 -1.03 -4.66 119.66 112.77 2ken s GLN 82 Ca 0.34 -0.33 -0.13 0.00 0.05 0.00 0.00 55.36 55.29 2ken s GLN 82 Cb -0.13 0.16 -0.05 0.00 1.10 0.00 0.00 33.01 34.10 2ken s GLN 82 CO 0.27 -0.08 0.27 0.08 -0.55 0.00 0.00 175.29 175.27 2ken s VAL 83 N -1.13 5.29 -0.22 1.34 1.01 -1.10 0.71 120.40 126.30 2ken s VAL 83 Ca -0.12 0.42 -0.07 0.00 0.00 0.00 0.00 61.98 62.21 2ken s VAL 83 Cb -0.07 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 2ken s VAL 83 CO 0.01 0.30 0.06 -1.10 0.00 0.00 0.00 175.10 174.37 2ken s GLN 84 N 1.16 3.77 -0.16 2.72 -0.21 -1.00 -1.37 119.66 124.57 2ken s GLN 84 Ca 0.13 -0.44 -0.09 0.00 0.02 0.00 0.00 55.36 54.98 2ken s GLN 84 Cb -0.14 -3.25 -0.05 0.00 1.00 0.00 0.00 33.01 30.58 2ken s GLN 84 CO 0.06 0.01 0.14 0.08 -2.12 0.00 0.00 175.29 173.47 2ken s VAL 85 N 1.07 5.45 0.00 1.09 1.01 -0.78 -3.83 120.40 124.41 2ken s VAL 85 Ca 0.04 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.24 2ken s VAL 85 Cb -0.14 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2ken s VAL 85 CO 0.03 0.52 0.00 0.59 0.00 0.00 0.00 175.10 176.24 2ken n ASN 86 N 2.81 0.79 -0.23 3.32 3.02 -1.26 -2.69 115.26 121.01 2ken n ASN 86 Ca -0.18 -0.72 -0.07 0.00 -0.03 0.00 0.00 54.58 53.58 2ken n ASN 86 Cb 0.53 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.74 2ken n ASN 86 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2ken h LYS 87 N 0.00 0.99 0.00 3.52 3.64 -1.82 -2.04 116.57 120.85 2ken h LYS 87 Ca 0.00 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.17 2ken h LYS 87 Cb 0.00 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.67 2ken h LYS 87 CO 0.00 0.85 -0.07 -0.97 -2.27 0.00 0.00 179.45 176.99 2ken h ASN 88 N 0.92 0.00 -4.43 4.20 -1.24 -1.93 -3.43 115.58 109.67 2ken h ASN 88 Ca 0.21 0.00 -0.49 0.00 0.71 0.00 0.00 56.30 56.73 2ken h ASN 88 Cb 0.26 0.00 0.08 0.00 0.73 0.00 0.00 38.32 39.38 2ken h ASN 88 CO -0.01 0.07 0.41 -0.44 -1.29 0.00 0.00 177.43 176.16 2ken s SER 89 N -5.84 5.55 0.09 1.15 0.01 -0.77 -4.85 113.70 109.03 2ken s SER 89 Ca -0.02 1.15 -0.04 0.00 1.31 0.00 0.00 55.95 58.35 2ken s SER 89 Cb 0.12 -1.98 -0.03 0.00 0.21 0.00 0.00 66.02 64.34 2ken s SER 89 CO 0.54 -1.27 0.08 -0.94 0.41 0.00 0.00 173.24 172.06 2ken s SER 90 N -4.34 0.30 -0.03 2.44 1.04 -0.85 -4.82 113.70 107.44 2ken s SER 90 Ca 0.58 -0.96 -0.02 0.00 0.48 0.00 0.00 55.95 56.03 2ken s SER 90 Cb -0.11 0.29 0.02 0.00 0.10 0.00 0.00 66.02 66.32 2ken s SER 90 CO 0.52 -0.70 0.07 -0.63 0.98 0.00 0.00 173.24 173.48 2ken s ILE 91 N -3.95 -0.03 -0.03 -1.02 1.01 -1.26 -2.69 121.20 113.23 2ken s ILE 91 Ca 0.12 0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.92 2ken s ILE 91 Cb 0.07 -0.13 0.00 0.00 0.01 0.00 0.00 42.46 42.41 2ken s ILE 91 CO -0.06 0.05 -0.11 -1.61 0.00 0.00 0.00 174.94 173.21 2ken s GLU 92 N 0.67 1.18 0.23 2.79 0.41 -1.01 -4.94 118.70 118.04 2ken s GLU 92 Ca -0.05 -0.37 -0.30 0.00 -0.41 0.00 0.00 54.97 53.84 2ken s GLU 92 Cb -0.07 -1.07 -0.09 0.00 -1.78 0.00 0.00 34.13 31.12 2ken s GLU 92 CO -0.03 0.13 1.23 0.21 -0.49 0.00 0.00 175.26 176.32 2ken s LYS 93 N 0.20 4.47 -0.04 1.61 2.20 -1.26 -0.03 119.74 126.89 2ken s LYS 93 Ca -0.04 1.96 -0.16 0.00 -0.36 0.00 0.00 55.97 57.37 2ken s LYS 93 Cb -0.10 -3.19 -0.05 0.00 -1.51 0.00 0.00 37.83 32.98 2ken s LYS 93 CO 0.01 -0.10 0.44 -0.51 -0.36 0.00 0.00 175.35 174.83 2ken s LEU 94 N -0.64 4.41 0.00 5.43 1.43 -1.11 -4.86 118.68 123.34 2ken s LEU 94 Ca 0.52 0.93 0.22 0.00 -1.03 0.00 0.00 54.13 54.77 2ken s LEU 94 Cb -0.35 -2.64 0.98 0.00 0.03 0.00 0.00 46.19 44.21 2ken s LEU 94 CO 0.40 0.21 1.71 -0.24 0.23 0.00 0.00 176.35 178.66 2ken n SER 95 N 2.46 0.00 -4.32 2.29 2.88 -1.26 -4.69 113.62 110.98 2ken n SER 95 Ca -0.11 0.38 -0.32 0.00 -1.33 0.00 0.00 58.87 57.49 2ken n SER 95 Cb 0.52 -0.45 -0.16 0.00 -0.75 0.00 0.00 64.21 63.37 2ken n SER 95 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2ken s GLU 96 N -2.90 2.44 0.66 -1.46 4.04 -1.26 -5.13 118.70 115.09 2ken s GLU 96 Ca 0.13 -0.88 -0.12 0.00 0.04 0.00 0.00 54.97 54.15 2ken s GLU 96 Cb 0.14 -2.17 -0.01 0.00 0.02 0.00 0.00 34.13 32.11 2ken s GLU 96 CO 0.39 0.47 1.05 -1.25 -1.84 0.00 0.00 175.26 174.07 2ken s PRO 97 N -0.37 3.13 -0.14 -4.83 0.04 -1.26 -4.79 135.00 126.79 2ken s PRO 97 Ca 0.03 0.95 -0.02 0.00 0.04 0.00 0.00 61.00 61.99 2ken s PRO 97 Cb -0.12 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2ken s PRO 97 CO 0.02 -0.95 -0.06 0.42 0.04 0.00 0.00 177.00 176.47 2ken s ILE 98 N -2.98 3.72 -0.25 0.56 1.01 -1.26 -5.07 121.20 116.93 2ken s ILE 98 Ca 0.58 -0.43 -0.10 0.00 0.00 0.00 0.00 60.65 60.71 2ken s ILE 98 Cb -0.14 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.68 2ken s ILE 98 CO 0.52 0.52 0.15 -1.61 0.00 0.00 0.00 174.94 174.51 2ken s GLU 99 N 0.17 3.98 -0.01 2.79 2.02 -1.26 -4.92 118.70 121.47 2ken s GLU 99 Ca -0.03 -0.32 0.14 0.00 0.02 0.00 0.00 54.97 54.79 2ken s GLU 99 Cb -0.14 -3.51 -0.19 0.00 0.10 0.00 0.00 34.13 30.38 2ken s GLU 99 CO 0.03 -0.01 0.45 0.28 0.02 0.00 0.00 175.26 176.03 2ken n VAL 100 N 4.49 0.00 0.00 2.63 0.31 -1.26 -4.75 118.33 119.76 2ken n VAL 100 Ca -0.15 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 2ken n VAL 100 Cb 0.52 0.54 0.00 0.00 -0.91 0.00 0.00 33.84 33.99 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 1.52 -0.43 0.25 2.92 0.00 -1.26 -4.94 105.19 103.25 2ken n GLY 101 Ca -0.00 0.21 -0.08 0.00 0.00 0.00 0.00 46.02 46.15 2ken n GLY 101 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ken h LEU 102 N 0.00 0.78 -3.21 0.99 5.85 -1.98 -3.47 115.31 114.27 2ken h LEU 102 Ca 0.00 -0.17 -0.35 0.00 0.84 0.00 0.00 57.88 58.20 2ken h LEU 102 Cb 0.00 -0.20 0.03 0.00 0.37 0.00 0.00 40.66 40.86 2ken h LEU 102 CO 0.00 0.74 -0.76 1.21 -0.34 0.00 0.00 178.44 179.29 2ken n GLU 103 N -4.49 -1.30 0.49 1.25 4.07 -1.26 -4.90 120.64 114.50 2ken n GLU 103 Ca 0.03 0.80 -0.20 0.00 -0.06 0.00 0.00 57.16 57.74 2ken n GLU 103 Cb 0.16 -3.85 -0.09 0.00 -0.06 0.00 0.00 31.44 27.60 2ken n GLU 103 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2ken h HIS 104 N -0.80 -1.16 -0.21 4.31 -0.00 -2.06 -3.44 115.15 111.80 2ken h HIS 104 Ca -0.49 -0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 59.81 2ken h HIS 104 Cb 1.28 0.38 -0.15 0.00 -0.00 0.00 0.00 27.41 28.93 2ken h HIS 104 CO 0.27 -0.72 -0.17 1.58 -0.00 0.00 0.00 177.93 178.89 2ken n HIS 105 N -5.61 -1.23 -3.62 5.26 -0.00 -1.26 -5.14 115.22 103.63 2ken n HIS 105 Ca -0.16 -0.83 -0.03 0.00 0.46 0.00 0.00 57.72 57.15 2ken n HIS 105 Cb 0.49 1.17 -0.06 0.00 -0.12 0.00 0.00 29.99 31.48 2ken n HIS 105 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2ken s HIS 106 N 0.69 -1.17 -0.93 1.57 0.00 -1.26 -5.01 115.29 109.18 2ken s HIS 106 Ca 0.26 2.00 0.24 0.00 -3.00 0.00 0.00 55.06 54.55 2ken s HIS 106 Cb 0.14 0.61 0.24 0.00 -4.00 0.00 0.00 32.58 29.57 2ken s HIS 106 CO -0.10 -0.62 1.22 0.72 -1.00 0.00 0.00 174.74 174.95 2ken n HIS 107 N 5.43 0.06 -0.23 0.38 -0.00 -1.26 -4.13 115.22 115.47 2ken n HIS 107 Ca -0.10 0.02 -0.08 0.00 -0.00 0.00 0.00 57.72 57.55 2ken n HIS 107 Cb 0.49 -0.23 0.03 0.00 -0.00 0.00 0.00 29.99 30.29 2ken n HIS 107 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2ken h HIS 108 N 0.00 1.14 -0.01 4.41 3.86 -2.07 -3.56 115.15 118.91 2ken h HIS 108 Ca 0.00 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 59.05 2ken h HIS 108 Cb 0.54 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.70 2ken h HIS 108 CO 0.00 0.96 0.00 1.58 0.86 0.00 0.00 177.93 181.33