#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kbg n GLU 2 N 0.00 0.00 -0.52 5.56 0.00 -1.26 -3.99 120.64 120.43 2kbg n GLU 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2kbg n GLU 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 2kbg n GLU 2 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 2kbg n PRO 3 N -0.06 1.97 -3.58 3.44 -0.04 -1.26 -4.34 135.00 131.14 2kbg n PRO 3 Ca 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 2kbg n PRO 3 Cb 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 2kbg n PRO 3 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2kbg s SER 4 N -0.99 -0.33 0.99 3.54 1.04 -1.26 -4.83 113.70 111.86 2kbg s SER 4 Ca 0.00 0.31 -0.20 0.00 0.48 0.00 0.00 55.95 56.55 2kbg s SER 4 Cb 0.00 0.28 -0.16 0.00 0.10 0.00 0.00 66.02 66.24 2kbg s SER 4 CO 0.00 -0.34 -0.99 -2.65 0.98 0.00 0.00 173.24 170.24 2kbg n PRO 5 N 0.57 0.00 -0.93 4.02 -0.02 -1.26 -4.84 135.00 132.53 2kbg n PRO 5 Ca -0.09 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.04 2kbg n PRO 5 Cb 0.58 -0.99 0.03 0.00 -0.02 0.00 0.00 33.50 33.10 2kbg n PRO 5 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kbg n PRO 6 N 2.48 0.00 -2.70 0.52 -0.02 -1.26 -4.97 135.00 129.04 2kbg n PRO 6 Ca -0.02 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.44 2kbg n PRO 6 Cb 0.60 -0.93 0.11 0.00 -0.02 0.00 0.00 33.50 33.26 2kbg n PRO 6 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2kbg n SER 7 N 3.27 -0.94 -4.28 2.55 2.88 -1.26 -5.07 113.62 110.76 2kbg n SER 7 Ca -0.02 -2.22 -0.34 0.00 -1.33 0.00 0.00 58.87 54.97 2kbg n SER 7 Cb 0.65 0.50 -0.15 0.00 -0.75 0.00 0.00 64.21 64.46 2kbg n SER 7 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2kbg s ILE 8 N -0.59 2.87 -0.21 2.46 -1.09 -1.26 -0.74 121.20 122.65 2kbg s ILE 8 Ca 0.14 -0.69 -0.01 0.00 -2.23 0.00 0.00 60.65 57.85 2kbg s ILE 8 Cb 0.42 -2.24 0.01 0.00 -1.58 0.00 0.00 42.46 39.08 2kbg s ILE 8 CO -0.11 0.50 -0.12 -1.00 -1.23 0.00 0.00 174.94 172.98 2kbg s HIS 9 N 0.94 2.91 -0.09 3.97 3.76 -1.10 -4.93 115.29 120.75 2kbg s HIS 9 Ca -0.02 -1.38 -0.04 0.00 -0.15 0.00 0.00 55.06 53.46 2kbg s HIS 9 Cb -0.15 -2.01 -0.04 0.00 1.11 0.00 0.00 32.58 31.49 2kbg s HIS 9 CO -0.01 -0.70 0.09 0.20 -0.85 0.00 0.00 174.74 173.47 2kbg s GLY 10 N 1.36 2.05 -0.01 -2.22 0.00 -1.25 -1.15 107.32 106.10 2kbg s GLY 10 Ca 0.04 -0.72 -0.05 0.00 0.00 0.00 0.00 44.72 43.98 2kbg s GLY 10 CO -0.08 -0.49 0.11 1.20 0.00 0.00 0.00 173.10 173.84 2kbg s GLN 11 N -1.11 0.35 -1.27 2.90 -1.52 -1.00 -4.95 119.66 113.05 2kbg s GLN 11 Ca 0.16 -0.23 -0.19 0.00 -1.95 0.00 0.00 55.36 53.15 2kbg s GLN 11 Cb -0.12 0.15 0.04 0.00 -0.22 0.00 0.00 33.01 32.86 2kbg s GLN 11 CO 0.05 -0.07 1.76 -1.25 -0.25 0.00 0.00 175.29 175.53 2kbg s PRO 12 N -0.89 3.71 0.00 2.91 0.04 -1.26 -0.94 135.00 138.57 2kbg s PRO 12 Ca -0.10 -1.82 0.00 0.00 0.04 0.00 0.00 61.00 59.13 2kbg s PRO 12 Cb -0.06 -5.48 0.00 0.00 0.04 0.00 0.00 34.50 29.00 2kbg s PRO 12 CO 0.01 -2.56 0.27 0.45 0.04 0.00 0.00 177.00 175.21 2kbg n SER 13 N 9.47 0.00 -3.85 6.66 2.88 -1.15 -4.81 113.62 122.82 2kbg n SER 13 Ca 0.48 0.27 -0.13 0.00 -1.33 0.00 0.00 58.87 58.15 2kbg n SER 13 Cb 0.46 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.78 2kbg n SER 13 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2kbg s SER 14 N -2.60 0.08 1.69 -3.46 0.01 -1.26 -5.04 113.70 103.13 2kbg s SER 14 Ca 0.00 0.00 0.00 0.00 1.31 0.00 0.00 55.95 57.26 2kbg s SER 14 Cb 0.00 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.20 2kbg s SER 14 CO 0.00 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2kbg n GLY 15 N 3.40 2.82 0.44 3.44 0.00 -1.26 -2.01 105.19 112.01 2kbg n GLY 15 Ca -0.17 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 45.72 2kbg n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kbg n LYS 16 N 13.54 1.20 -2.21 1.61 5.02 -1.26 -4.95 118.16 131.12 2kbg n LYS 16 Ca 0.00 -0.88 -0.38 0.00 -2.02 0.00 0.00 58.31 55.03 2kbg n LYS 16 Cb 0.00 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.52 2kbg n LYS 16 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2kbg s SER 17 N -2.40 6.37 -0.09 4.39 0.15 -0.85 -4.21 113.70 117.06 2kbg s SER 17 Ca 0.23 2.43 0.02 0.00 0.70 0.00 0.00 55.95 59.34 2kbg s SER 17 Cb 0.19 -2.62 0.01 0.00 -1.71 0.00 0.00 66.02 61.89 2kbg s SER 17 CO 0.51 -0.79 -0.16 0.12 1.20 0.00 0.00 173.24 174.12 2kbg s PHE 18 N -1.39 1.90 -0.58 3.44 5.36 -1.21 -2.93 117.98 122.57 2kbg s PHE 18 Ca 0.58 -0.80 -0.23 0.00 -0.96 0.00 0.00 56.93 55.53 2kbg s PHE 18 Cb -0.33 -1.35 0.05 0.00 -0.34 0.00 0.00 43.02 41.06 2kbg s PHE 18 CO 0.41 -0.39 0.91 0.21 -1.46 0.00 0.00 175.22 174.90 2kbg s LYS 19 N 0.72 3.22 -0.78 10.12 2.20 -0.12 -3.46 119.74 131.64 2kbg s LYS 19 Ca -0.12 -0.56 -0.15 0.00 -0.36 0.00 0.00 55.97 54.78 2kbg s LYS 19 Cb -0.16 -4.12 0.20 0.00 -1.51 0.00 0.00 37.83 32.23 2kbg s LYS 19 CO 0.03 -1.57 0.75 -0.51 -0.36 0.00 0.00 175.35 173.69 2kbg s LEU 20 N 3.80 6.52 0.04 5.43 1.43 -1.11 -2.39 118.68 132.41 2kbg s LEU 20 Ca 0.25 -2.46 -0.30 0.00 -1.03 0.00 0.00 54.13 50.58 2kbg s LEU 20 Cb -0.15 -2.23 -0.07 0.00 0.03 0.00 0.00 46.19 43.77 2kbg s LEU 20 CO 0.15 -0.67 1.57 -0.55 0.23 0.00 0.00 176.35 177.08 2kbg s SER 21 N 2.54 6.69 -0.34 2.29 0.15 -0.30 -3.64 113.70 121.09 2kbg s SER 21 Ca 0.16 2.35 -0.23 0.00 0.70 0.00 0.00 55.95 58.93 2kbg s SER 21 Cb -0.13 -2.56 0.01 0.00 -1.71 0.00 0.00 66.02 61.62 2kbg s SER 21 CO -0.07 -0.83 0.79 -0.63 1.20 0.00 0.00 173.24 173.70 2kbg s ILE 22 N 2.64 4.76 -0.28 6.45 -1.09 -0.91 -2.70 121.20 130.08 2kbg s ILE 22 Ca 0.70 1.03 -0.16 0.00 -2.23 0.00 0.00 60.65 60.00 2kbg s ILE 22 Cb -0.37 -4.18 -0.03 0.00 -1.58 0.00 0.00 42.46 36.30 2kbg s ILE 22 CO 0.30 -0.35 0.40 -0.89 -1.23 0.00 0.00 174.94 173.18 2kbg s THR 23 N 3.04 5.15 -0.64 2.92 2.01 0.08 -4.51 115.64 123.69 2kbg s THR 23 Ca 0.32 0.57 -0.35 0.00 0.31 0.00 0.00 61.69 62.53 2kbg s THR 23 Cb -0.14 -3.75 -0.18 0.00 0.01 0.00 0.00 72.50 68.44 2kbg s THR 23 CO 0.15 0.10 2.16 2.29 -0.69 0.00 0.00 174.62 178.63 2kbg n LYS 24 N 5.40 0.00 -3.64 4.92 2.85 -1.26 -4.81 118.16 121.62 2kbg n LYS 24 Ca -0.08 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.86 2kbg n LYS 24 Cb 0.50 -1.37 -0.05 0.00 -0.65 0.00 0.00 35.03 33.46 2kbg n LYS 24 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2kbg s GLN 25 N 6.60 3.66 -0.72 -1.58 -0.21 -1.26 -4.96 119.66 121.19 2kbg s GLN 25 Ca 1.16 -0.01 -0.25 0.00 0.02 0.00 0.00 55.36 56.27 2kbg s GLN 25 Cb -1.28 -2.87 -0.14 0.00 1.00 0.00 0.00 33.01 29.71 2kbg s GLN 25 CO 0.54 0.48 2.43 -0.25 -2.12 0.00 0.00 175.29 176.37 2kbg n ASP 26 N 0.26 1.43 -4.19 5.90 8.00 -1.26 -4.87 116.55 121.82 2kbg n ASP 26 Ca -0.04 -0.71 -0.35 0.00 0.71 0.00 0.00 54.79 54.41 2kbg n ASP 26 Cb 0.52 -1.39 0.12 0.00 -0.02 0.00 0.00 41.12 40.35 2kbg n ASP 26 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2kbg n ASP 27 N 14.84 -2.65 0.04 -2.24 2.03 -1.26 -4.02 116.55 123.30 2kbg n ASP 27 Ca 0.48 -0.06 0.04 0.00 0.52 0.00 0.00 54.79 55.76 2kbg n ASP 27 Cb 0.39 -0.82 0.43 0.00 -0.72 0.00 0.00 41.12 40.40 2kbg n ASP 27 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2kbg h GLY 28 N -1.70 0.47 0.00 0.27 0.00 -1.79 -3.41 103.07 96.91 2kbg h GLY 28 Ca -0.49 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.64 2kbg h GLY 28 CO 0.32 0.19 0.00 0.61 0.00 0.00 0.00 176.54 177.67 2kbg n GLY 29 N -1.32 0.00 3.48 4.60 0.00 -1.26 -4.18 105.19 106.51 2kbg n GLY 29 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 2kbg n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kbg s ALA 30 N 0.00 -1.65 0.35 4.61 0.00 -1.26 -5.01 121.76 118.80 2kbg s ALA 30 Ca 0.00 1.09 -0.28 0.00 0.00 0.00 0.00 51.96 52.77 2kbg s ALA 30 Cb 0.00 0.15 -0.10 0.00 0.00 0.00 0.00 23.12 23.17 2kbg s ALA 30 CO 0.00 -0.42 1.31 -1.25 0.00 0.00 0.00 175.76 175.39 2kbg s PRO 31 N -1.63 4.27 -0.08 0.00 0.04 -1.26 -4.69 135.00 131.65 2kbg s PRO 31 Ca -0.09 2.21 -0.26 0.00 0.04 0.00 0.00 61.00 62.89 2kbg s PRO 31 Cb -0.00 -3.00 -0.03 0.00 0.04 0.00 0.00 34.50 31.51 2kbg s PRO 31 CO 0.06 -0.26 0.85 0.42 0.04 0.00 0.00 177.00 178.10 2kbg s ILE 32 N -1.17 4.92 0.03 0.56 1.01 -1.26 -4.12 121.20 121.17 2kbg s ILE 32 Ca 0.51 1.73 -0.18 0.00 0.00 0.00 0.00 60.65 62.71 2kbg s ILE 32 Cb -0.39 -4.17 -0.22 0.00 0.01 0.00 0.00 42.46 37.69 2kbg s ILE 32 CO 0.52 0.14 1.16 -0.07 0.00 0.00 0.00 174.94 176.68 2kbg h LEU 33 N 7.35 0.64 -7.70 2.97 4.07 -1.42 -3.37 115.31 117.85 2kbg h LEU 33 Ca -0.37 -0.72 -0.05 0.00 0.08 0.00 0.00 57.88 56.82 2kbg h LEU 33 Cb 1.18 -0.19 -0.12 0.00 1.08 0.00 0.00 40.66 42.61 2kbg h LEU 33 CO 0.79 1.27 -0.10 -1.61 -1.08 0.00 0.00 178.44 177.71 2kbg s GLU 34 N -3.36 1.22 -0.20 1.13 2.02 -1.24 -1.50 118.70 116.77 2kbg s GLU 34 Ca -0.12 -0.90 -0.04 0.00 0.02 0.00 0.00 54.97 53.93 2kbg s GLU 34 Cb 0.05 0.47 -0.01 0.00 0.10 0.00 0.00 34.13 34.73 2kbg s GLU 34 CO 0.85 -0.49 -0.05 0.71 0.02 0.00 0.00 175.26 176.30 2kbg s TYR 35 N -3.88 2.96 -0.45 1.61 1.51 0.12 -1.25 117.35 117.97 2kbg s TYR 35 Ca 0.09 -0.77 -0.18 0.00 -1.01 0.00 0.00 57.07 55.21 2kbg s TYR 35 Cb 0.01 -2.06 0.04 0.00 -0.11 0.00 0.00 41.96 39.84 2kbg s TYR 35 CO -0.05 -0.41 0.49 0.42 -1.11 0.00 0.00 175.55 174.88 2kbg s ILE 36 N 1.17 5.05 -0.20 2.71 1.01 0.13 -0.66 121.20 130.41 2kbg s ILE 36 Ca 0.02 -0.50 -0.06 0.00 0.00 0.00 0.00 60.65 60.11 2kbg s ILE 36 Cb -0.14 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.17 2kbg s ILE 36 CO -0.01 -0.56 0.02 -0.69 0.00 0.00 0.00 174.94 173.70 2kbg s VAL 37 N 2.21 4.14 -0.04 2.92 1.01 0.20 -1.18 120.40 129.66 2kbg s VAL 37 Ca 0.12 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 61.91 2kbg s VAL 37 Cb -0.19 -2.88 -0.01 0.00 0.00 0.00 0.00 36.38 33.30 2kbg s VAL 37 CO 0.12 0.42 -0.22 -0.54 0.00 0.00 0.00 175.10 174.88 2kbg s LYS 38 N 0.97 2.12 0.02 2.72 1.02 0.05 0.91 119.74 127.56 2kbg s LYS 38 Ca 0.02 -0.80 -0.05 0.00 0.02 0.00 0.00 55.97 55.16 2kbg s LYS 38 Cb -0.14 -1.88 -0.01 0.00 -0.52 0.00 0.00 37.83 35.28 2kbg s LYS 38 CO 0.02 0.38 0.08 1.52 -0.92 0.00 0.00 175.35 176.43 2kbg s TYR 39 N -0.23 0.17 0.28 3.18 1.13 -1.07 0.70 117.35 121.50 2kbg s TYR 39 Ca 0.00 -0.39 -0.07 0.00 -1.41 0.00 0.00 57.07 55.20 2kbg s TYR 39 Cb -0.12 -0.13 -0.01 0.00 -1.10 0.00 0.00 41.96 40.61 2kbg s TYR 39 CO 0.02 -0.30 0.42 -0.98 -2.51 0.00 0.00 175.55 172.20 2kbg s ARG 40 N -1.95 1.64 0.40 -3.49 1.70 -0.65 -1.64 118.95 114.96 2kbg s ARG 40 Ca -0.11 -1.52 -0.23 0.00 -0.47 0.00 0.00 55.73 53.41 2kbg s ARG 40 Cb -0.05 0.43 -0.10 0.00 -0.57 0.00 0.00 34.95 34.65 2kbg s ARG 40 CO -0.02 -0.66 0.97 -1.12 -1.08 0.00 0.00 175.30 173.39 2kbg s SER 41 N -3.13 7.00 0.30 -2.89 0.01 -1.26 -0.23 113.70 113.49 2kbg s SER 41 Ca 0.28 1.79 0.07 0.00 1.31 0.00 0.00 55.95 59.41 2kbg s SER 41 Cb 0.01 -2.56 0.45 0.00 0.21 0.00 0.00 66.02 64.13 2kbg s SER 41 CO 0.14 -0.32 1.69 0.11 0.41 0.00 0.00 173.24 175.28 2kbg h LYS 42 N 2.34 0.20 -0.01 12.44 1.57 -1.61 -3.18 116.57 128.31 2kbg h LYS 42 Ca -0.48 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.13 2kbg h LYS 42 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2kbg h LYS 42 CO 0.62 0.61 -0.26 -0.44 -0.57 0.00 0.00 179.45 179.41 2kbg h ASP 43 N 0.16 0.25 0.00 0.86 5.19 -1.93 -3.39 116.42 117.56 2kbg h ASP 43 Ca 0.01 -0.74 0.00 0.00 -0.62 0.00 0.00 57.03 55.68 2kbg h ASP 43 Cb 0.85 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.28 2kbg h ASP 43 CO 0.07 0.96 0.00 0.29 -3.12 0.00 0.00 179.24 177.44 2kbg n LYS 44 N -4.50 0.00 -2.98 3.56 4.76 -1.23 -4.97 118.16 112.80 2kbg n LYS 44 Ca -0.09 0.13 -0.08 0.00 -2.87 0.00 0.00 58.31 55.40 2kbg n LYS 44 Cb 0.50 -1.07 0.01 0.00 -1.84 0.00 0.00 35.03 32.62 2kbg n LYS 44 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2kbg n GLU 45 N -0.79 -2.01 0.00 1.97 2.13 -1.20 -4.90 120.64 115.84 2kbg n GLU 45 Ca 0.00 1.85 0.00 0.00 0.66 0.00 0.00 57.16 59.67 2kbg n GLU 45 Cb 0.00 -5.38 0.00 0.00 0.27 0.00 0.00 31.44 26.33 2kbg n GLU 45 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2kbg n ASP 46 N -0.81 0.00 -4.10 4.31 2.03 -1.26 -5.15 116.55 111.57 2kbg n ASP 46 Ca 0.06 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.28 2kbg n ASP 46 Cb 0.49 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.79 2kbg n ASP 46 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2kbg s GLN 47 N -0.04 0.64 -0.02 -0.67 -0.21 -1.26 -5.17 119.66 112.93 2kbg s GLN 47 Ca 0.00 -1.15 0.01 0.00 0.02 0.00 0.00 55.36 54.24 2kbg s GLN 47 Cb 0.00 0.04 0.01 0.00 1.00 0.00 0.00 33.01 34.06 2kbg s GLN 47 CO 0.00 -0.06 -0.03 -1.58 -2.12 0.00 0.00 175.29 171.49 2kbg s TRP 48 N -3.37 0.49 0.54 0.91 0.52 -1.26 -4.71 118.94 112.06 2kbg s TRP 48 Ca 0.05 -0.09 -0.07 0.00 0.02 0.00 0.00 56.10 56.00 2kbg s TRP 48 Cb 0.04 -0.42 -0.03 0.00 -1.15 0.00 0.00 33.47 31.90 2kbg s TRP 48 CO -0.07 -0.09 0.88 -0.51 0.02 0.00 0.00 176.95 177.18 2kbg s LEU 49 N 0.48 3.46 0.11 2.99 1.43 -0.65 -4.90 118.68 121.61 2kbg s LEU 49 Ca -0.05 1.07 0.10 0.00 -1.03 0.00 0.00 54.13 54.22 2kbg s LEU 49 Cb -0.09 -4.05 -0.04 0.00 0.03 0.00 0.00 46.19 42.05 2kbg s LEU 49 CO -0.00 -0.71 -0.22 -1.61 0.23 0.00 0.00 176.35 174.03 2kbg s GLU 50 N -4.91 1.65 -0.24 1.70 2.02 -1.26 -2.61 118.70 115.06 2kbg s GLU 50 Ca 0.50 -1.23 -0.05 0.00 0.02 0.00 0.00 54.97 54.22 2kbg s GLU 50 Cb -0.11 -2.02 0.12 0.00 0.10 0.00 0.00 34.13 32.23 2kbg s GLU 50 CO 0.48 0.48 0.43 0.21 0.02 0.00 0.00 175.26 176.88 2kbg s LYS 51 N -1.97 0.38 -0.02 1.61 2.47 0.26 -4.96 119.74 117.50 2kbg s LYS 51 Ca 0.16 0.83 -0.05 0.00 -1.56 0.00 0.00 55.97 55.35 2kbg s LYS 51 Cb -0.10 0.03 -0.04 0.00 -1.46 0.00 0.00 37.83 36.25 2kbg s LYS 51 CO 0.07 -0.47 0.21 0.15 0.16 0.00 0.00 175.35 175.48 2kbg s LYS 52 N 2.63 3.50 0.07 4.03 -0.14 -1.26 0.59 119.74 129.15 2kbg s LYS 52 Ca 0.07 -0.19 0.01 0.00 -1.36 0.00 0.00 55.97 54.50 2kbg s LYS 52 Cb -0.14 -3.10 -0.04 0.00 -1.68 0.00 0.00 37.83 32.87 2kbg s LYS 52 CO -0.15 0.68 -0.05 0.08 -0.76 0.00 0.00 175.35 175.14 2kbg s VAL 53 N -1.28 0.45 0.52 3.17 1.01 0.17 -4.95 120.40 119.49 2kbg s VAL 53 Ca 0.26 -1.68 -0.20 0.00 0.00 0.00 0.00 61.98 60.36 2kbg s VAL 53 Cb -0.13 -1.35 -0.06 0.00 0.00 0.00 0.00 36.38 34.84 2kbg s VAL 53 CO 0.16 -0.82 1.12 -1.58 0.00 0.00 0.00 175.10 173.97 2kbg s GLN 54 N -3.35 3.48 0.00 2.72 2.00 -1.26 0.14 119.66 123.39 2kbg s GLN 54 Ca 0.05 1.59 0.04 0.00 -2.00 0.00 0.00 55.36 55.04 2kbg s GLN 54 Cb 0.03 -2.07 0.21 0.00 0.80 0.00 0.00 33.01 31.97 2kbg s GLN 54 CO -0.06 -0.74 1.02 0.41 -0.50 0.00 0.00 175.29 175.43 2kbg n GLY 55 N 0.14 -0.50 0.00 2.59 0.00 -0.56 -1.49 105.19 105.36 2kbg n GLY 55 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2kbg n GLY 55 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2kbg n ASN 56 N -1.35 0.94 -0.09 1.61 3.02 -1.26 -4.71 115.26 113.41 2kbg n ASN 56 Ca 0.02 -1.01 -0.10 0.00 -0.03 0.00 0.00 54.58 53.46 2kbg n ASN 56 Cb 0.04 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 2kbg n ASN 56 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2kbg h LYS 57 N 0.00 0.41 -4.10 3.52 1.63 -1.62 -3.46 116.57 112.95 2kbg h LYS 57 Ca 0.00 -0.05 -0.30 0.00 -0.85 0.00 0.00 60.65 59.44 2kbg h LYS 57 Cb 0.04 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.58 2kbg h LYS 57 CO 0.00 0.36 -0.41 -0.25 -3.45 0.00 0.00 179.45 175.70 2kbg n ASP 58 N -4.81 -4.31 -3.65 4.20 8.00 -1.26 -4.90 116.55 109.82 2kbg n ASP 58 Ca -0.02 0.02 -0.02 0.00 0.71 0.00 0.00 54.79 55.48 2kbg n ASP 58 Cb 0.08 -3.61 -0.04 0.00 -0.02 0.00 0.00 41.12 37.53 2kbg n ASP 58 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 2kbg s HIS 59 N -2.78 -0.02 -0.05 1.24 -3.43 -1.26 -2.13 115.29 106.86 2kbg s HIS 59 Ca 0.10 0.03 -0.15 0.00 -0.80 0.00 0.00 55.06 54.25 2kbg s HIS 59 Cb -0.05 0.50 0.03 0.00 -1.43 0.00 0.00 32.58 31.63 2kbg s HIS 59 CO 0.13 -0.02 0.35 0.96 -2.00 0.00 0.00 174.74 174.16 2kbg s ILE 60 N -1.06 0.04 -0.23 -5.38 -4.36 -1.24 -4.91 121.20 104.05 2kbg s ILE 60 Ca 0.09 -0.30 -0.03 0.00 -0.26 0.00 0.00 60.65 60.16 2kbg s ILE 60 Cb -0.01 -0.60 0.01 0.00 1.25 0.00 0.00 42.46 43.11 2kbg s ILE 60 CO -0.08 -0.17 -0.06 -0.63 0.24 0.00 0.00 174.94 174.24 2kbg s ILE 61 N -0.84 3.06 -0.42 8.37 -1.09 -1.26 -2.74 121.20 126.28 2kbg s ILE 61 Ca -0.09 -0.76 -0.10 0.00 -2.23 0.00 0.00 60.65 57.46 2kbg s ILE 61 Cb -0.04 -2.46 0.07 0.00 -1.58 0.00 0.00 42.46 38.45 2kbg s ILE 61 CO 0.03 0.33 0.27 -0.76 -1.23 0.00 0.00 174.94 173.58 2kbg s LEU 62 N 1.40 5.16 -0.28 2.97 1.43 -1.23 -4.99 118.68 123.16 2kbg s LEU 62 Ca 0.03 -1.41 -0.14 0.00 -1.03 0.00 0.00 54.13 51.59 2kbg s LEU 62 Cb -0.15 -2.02 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 2kbg s LEU 62 CO -0.05 -0.53 0.32 -1.61 0.23 0.00 0.00 176.35 174.72 2kbg s GLU 63 N 1.48 3.97 0.00 1.70 2.02 -1.26 -3.29 118.70 123.32 2kbg s GLU 63 Ca 0.03 -0.08 0.00 0.00 0.02 0.00 0.00 54.97 54.94 2kbg s GLU 63 Cb -0.23 -3.67 0.00 0.00 0.10 0.00 0.00 34.13 30.34 2kbg s GLU 63 CO 0.03 -0.27 0.00 0.72 0.02 0.00 0.00 175.26 175.77 2kbg n HIS 64 N 5.26 0.00 -3.78 1.61 8.25 -1.26 -5.02 115.22 120.28 2kbg n HIS 64 Ca -0.10 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 56.99 2kbg n HIS 64 Cb 0.51 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.50 2kbg n HIS 64 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2kbg s LEU 65 N 0.00 4.70 0.30 2.41 1.43 -1.26 -5.07 118.68 121.19 2kbg s LEU 65 Ca 0.00 -1.58 -0.30 0.00 -1.03 0.00 0.00 54.13 51.22 2kbg s LEU 65 Cb 0.00 -1.83 -0.12 0.00 0.03 0.00 0.00 46.19 44.27 2kbg s LEU 65 CO 0.00 -0.43 1.56 0.00 0.23 0.00 0.00 176.35 177.71 2kbg n GLN 66 N 4.69 2.62 0.26 1.70 3.00 -1.26 -4.76 117.38 123.63 2kbg n GLN 66 Ca -0.08 0.93 0.13 0.00 -0.01 0.00 0.00 57.00 57.97 2kbg n GLN 66 Cb 0.43 -2.69 0.71 0.00 0.00 0.00 0.00 30.24 28.69 2kbg n GLN 66 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.06 175.57 2kbg h TRP 67 N 4.43 0.00 -0.46 1.08 4.06 -1.93 -2.77 115.95 120.36 2kbg h TRP 67 Ca -0.47 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.48 2kbg h TRP 67 Cb 1.23 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.39 2kbg h TRP 67 CO 0.57 0.12 0.00 0.25 -3.56 0.00 0.00 178.44 175.82 2kbg n THR 68 N -3.50 2.30 -3.71 1.49 -2.24 -1.26 -3.87 114.28 103.49 2kbg n THR 68 Ca -0.01 -1.51 -0.11 0.00 -2.27 0.00 0.00 64.05 60.15 2kbg n THR 68 Cb 0.27 -0.13 -0.12 0.00 -2.10 0.00 0.00 70.33 68.25 2kbg n THR 68 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2kbg s MET 69 N -2.49 0.33 0.69 -0.78 -1.94 -1.04 -5.05 119.30 109.01 2kbg s MET 69 Ca 0.47 0.70 -0.08 0.00 -1.71 0.00 0.00 55.69 55.07 2kbg s MET 69 Cb 0.35 -0.06 0.04 0.00 2.01 0.00 0.00 34.83 37.17 2kbg s MET 69 CO 0.15 -0.16 1.02 0.20 -0.01 0.00 0.00 175.02 176.23 2kbg s GLY 70 N 1.36 1.64 -0.24 -0.03 0.00 -1.26 -4.28 107.32 104.49 2kbg s GLY 70 Ca -0.09 -0.69 -0.16 0.00 0.00 0.00 0.00 44.72 43.78 2kbg s GLY 70 CO -0.11 -0.32 0.61 -2.52 0.00 0.00 0.00 173.10 170.76 2kbg s TYR 71 N -3.25 -0.88 0.38 1.90 1.13 -1.25 -1.50 117.35 113.88 2kbg s TYR 71 Ca 0.58 1.84 -0.10 0.00 -1.41 0.00 0.00 57.07 57.99 2kbg s TYR 71 Cb -0.11 0.47 -0.06 0.00 -1.10 0.00 0.00 41.96 41.15 2kbg s TYR 71 CO 0.47 -0.44 0.73 -1.21 -2.51 0.00 0.00 175.55 172.58 2kbg s GLU 72 N 1.31 3.77 -0.05 -3.49 2.02 0.68 -4.13 118.70 118.82 2kbg s GLU 72 Ca -0.08 0.40 0.04 0.00 0.02 0.00 0.00 54.97 55.35 2kbg s GLU 72 Cb -0.06 -2.44 0.00 0.00 0.10 0.00 0.00 34.13 31.73 2kbg s GLU 72 CO -0.14 0.03 -0.16 0.08 0.02 0.00 0.00 175.26 175.09 2kbg s VAL 73 N -2.28 1.37 -0.23 2.63 1.01 0.14 -1.64 120.40 121.40 2kbg s VAL 73 Ca 0.50 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.82 2kbg s VAL 73 Cb -0.10 -1.19 0.06 0.00 0.00 0.00 0.00 36.38 35.14 2kbg s VAL 73 CO 0.30 0.40 -0.07 -1.58 0.00 0.00 0.00 175.10 174.15 2kbg s GLN 74 N 0.18 1.76 -0.13 2.72 0.74 0.22 0.03 119.66 125.19 2kbg s GLN 74 Ca -0.07 -1.03 -0.14 0.00 0.05 0.00 0.00 55.36 54.17 2kbg s GLN 74 Cb -0.13 -2.62 -0.05 0.00 1.10 0.00 0.00 33.01 31.32 2kbg s GLN 74 CO 0.03 -0.58 0.31 0.42 -0.55 0.00 0.00 175.29 174.92 2kbg s ILE 75 N 1.35 5.28 -0.08 -2.34 1.09 0.95 -0.77 121.20 126.68 2kbg s ILE 75 Ca -0.06 0.59 -0.02 0.00 -1.10 0.00 0.00 60.65 60.06 2kbg s ILE 75 Cb -0.19 -3.63 0.03 0.00 -1.06 0.00 0.00 42.46 37.61 2kbg s ILE 75 CO -0.06 0.43 0.02 -0.89 -0.10 0.00 0.00 174.94 174.35 2kbg s THR 76 N 0.12 0.25 -0.16 2.92 2.01 -0.32 0.42 115.64 120.88 2kbg s THR 76 Ca 0.18 0.10 -0.20 0.00 0.31 0.00 0.00 61.69 62.09 2kbg s THR 76 Cb -0.14 -0.50 -0.03 0.00 0.01 0.00 0.00 72.50 71.84 2kbg s THR 76 CO 0.06 0.16 0.57 0.00 -0.69 0.00 0.00 174.62 174.71 2kbg s ALA 77 N 2.02 3.50 -0.41 7.40 0.00 -1.17 0.20 121.76 133.30 2kbg s ALA 77 Ca 0.04 -0.23 -0.13 0.00 0.00 0.00 0.00 51.96 51.65 2kbg s ALA 77 Cb -0.13 -2.85 0.04 0.00 0.00 0.00 0.00 23.12 20.19 2kbg s ALA 77 CO -0.05 -0.32 0.28 0.00 0.00 0.00 0.00 175.76 175.67 2kbg s ALA 78 N 1.35 3.39 0.28 0.00 0.00 -0.38 -0.39 121.76 126.01 2kbg s ALA 78 Ca 0.28 -1.86 0.01 0.00 0.00 0.00 0.00 51.96 50.40 2kbg s ALA 78 Cb -0.16 -2.78 0.01 0.00 0.00 0.00 0.00 23.12 20.20 2kbg s ALA 78 CO 0.11 -1.51 0.12 0.27 0.00 0.00 0.00 175.76 174.75 2kbg n ASN 79 N 5.07 2.30 -0.56 0.00 2.04 -1.25 -0.99 115.26 121.87 2kbg n ASN 79 Ca -0.11 -2.08 0.45 0.00 -0.44 0.00 0.00 54.58 52.39 2kbg n ASN 79 Cb 0.45 0.08 0.74 0.00 -2.53 0.00 0.00 39.78 38.52 2kbg n ASN 79 CO 0.00 0.00 0.00 -0.09 -0.44 0.00 0.00 177.26 176.73 2kbg h ARG 80 N 0.00 0.01 -0.55 -3.83 9.65 -1.84 2.33 114.38 120.15 2kbg h ARG 80 Ca -0.20 -0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.63 2kbg h ARG 80 Cb 0.67 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.23 2kbg h ARG 80 CO 0.33 0.00 0.17 -0.07 2.80 0.00 0.00 179.97 183.21 2kbg h LEU 81 N 0.01 0.79 0.00 3.80 -0.00 -1.94 -3.47 115.31 114.50 2kbg h LEU 81 Ca 0.90 -0.20 0.00 0.00 -0.00 0.00 0.00 57.88 58.58 2kbg h LEU 81 Cb 3.19 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 43.64 2kbg h LEU 81 CO -0.29 0.79 0.00 0.61 -0.00 0.00 0.00 178.44 179.55 2kbg n GLY 82 N -0.71 3.64 3.46 0.83 0.00 0.78 -5.03 105.19 108.17 2kbg n GLY 82 Ca 0.02 -0.89 -0.09 0.00 0.00 0.00 0.00 46.02 45.05 2kbg n GLY 82 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2kbg s TYR 83 N 0.00 -0.81 0.08 1.61 1.51 -1.26 -3.90 117.35 114.59 2kbg s TYR 83 Ca 0.00 1.69 -0.26 0.00 -1.01 0.00 0.00 57.07 57.49 2kbg s TYR 83 Cb 0.00 0.42 0.08 0.00 -0.11 0.00 0.00 41.96 42.35 2kbg s TYR 83 CO 0.00 -0.42 0.83 0.45 -1.11 0.00 0.00 175.55 175.30 2kbg s SER 84 N 1.32 -0.37 -1.28 2.29 0.15 0.47 -4.90 113.70 111.38 2kbg s SER 84 Ca -0.08 -0.11 -0.03 0.00 0.70 0.00 0.00 55.95 56.43 2kbg s SER 84 Cb -0.06 0.47 -0.01 0.00 -1.71 0.00 0.00 66.02 64.71 2kbg s SER 84 CO -0.14 -0.79 0.68 -0.62 1.20 0.00 0.00 173.24 173.57 2kbg n GLU 85 N -0.33 -4.03 -2.22 5.44 4.71 -1.26 -3.02 120.64 119.94 2kbg n GLU 85 Ca -0.10 0.58 -0.33 0.00 -0.01 0.00 0.00 57.16 57.30 2kbg n GLU 85 Cb 0.62 -4.97 -0.00 0.00 -1.01 0.00 0.00 31.44 26.07 2kbg n GLU 85 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2kbg s PRO 86 N -5.98 3.46 -0.11 3.49 0.04 -1.26 -4.40 135.00 130.25 2kbg s PRO 86 Ca 0.09 1.29 -0.01 0.00 0.04 0.00 0.00 61.00 62.41 2kbg s PRO 86 Cb -0.03 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.50 2kbg s PRO 86 CO 0.83 -0.70 -0.01 0.99 0.04 0.00 0.00 177.00 178.14 2kbg s THR 87 N -2.24 0.56 -0.73 1.26 2.01 0.17 -4.90 115.64 111.76 2kbg s THR 87 Ca 0.66 -0.13 -0.17 0.00 0.31 0.00 0.00 61.69 62.36 2kbg s THR 87 Cb -0.17 -0.76 0.16 0.00 0.01 0.00 0.00 72.50 71.73 2kbg s THR 87 CO 0.31 0.18 0.77 -0.69 -0.69 0.00 0.00 174.62 174.50 2kbg s VAL 88 N 1.89 5.16 -0.14 3.82 1.01 -1.26 -0.03 120.40 130.84 2kbg s VAL 88 Ca 0.04 -1.73 -0.10 0.00 0.00 0.00 0.00 61.98 60.18 2kbg s VAL 88 Cb -0.13 -4.51 -0.05 0.00 0.00 0.00 0.00 36.38 31.69 2kbg s VAL 88 CO -0.06 -1.12 0.19 -0.47 0.00 0.00 0.00 175.10 173.64 2kbg s TYR 89 N 1.57 3.52 -0.03 5.22 5.04 0.11 -4.98 117.35 127.81 2kbg s TYR 89 Ca 0.16 0.52 0.00 0.00 -2.44 0.00 0.00 57.07 55.32 2kbg s TYR 89 Cb -0.16 -2.12 0.03 0.00 0.35 0.00 0.00 41.96 40.05 2kbg s TYR 89 CO -0.03 0.49 0.00 -1.83 -1.34 0.00 0.00 175.55 172.84 2kbg s GLU 90 N -0.29 0.28 -0.28 4.97 -1.05 -1.26 0.27 118.70 121.34 2kbg s GLU 90 Ca 0.14 0.07 -0.17 0.00 -0.15 0.00 0.00 54.97 54.85 2kbg s GLU 90 Cb -0.12 -0.45 0.11 0.00 -0.44 0.00 0.00 34.13 33.22 2kbg s GLU 90 CO 0.03 -0.12 0.82 -0.59 0.95 0.00 0.00 175.26 176.35 2kbg s PHE 91 N 0.95 -0.83 0.77 4.83 -0.71 -1.26 -5.04 117.98 116.70 2kbg s PHE 91 Ca -0.10 1.69 -0.12 0.00 -1.04 0.00 0.00 56.93 57.37 2kbg s PHE 91 Cb -0.13 0.48 0.06 0.00 -1.21 0.00 0.00 43.02 42.22 2kbg s PHE 91 CO -0.02 -0.41 1.15 -1.54 -1.34 0.00 0.00 175.22 173.06 2kbg s SER 92 N 1.34 4.84 0.13 1.98 1.04 -1.26 -3.85 113.70 117.92 2kbg s SER 92 Ca -0.08 0.92 -0.01 0.00 0.48 0.00 0.00 55.95 57.26 2kbg s SER 92 Cb -0.04 -1.54 -0.04 0.00 0.10 0.00 0.00 66.02 64.50 2kbg s SER 92 CO -0.16 -1.71 0.31 -0.04 0.98 0.00 0.00 173.24 172.63 2kbg s MET 93 N -5.49 3.51 0.69 4.02 -1.94 -1.26 -4.95 119.30 113.89 2kbg s MET 93 Ca 0.61 -0.33 -0.11 0.00 -1.71 0.00 0.00 55.69 54.14 2kbg s MET 93 Cb -0.11 -2.92 0.01 0.00 2.01 0.00 0.00 34.83 33.81 2kbg s MET 93 CO 0.50 0.50 1.09 -1.25 -0.01 0.00 0.00 175.02 175.85 2kbg s PRO 94 N -2.85 2.95 0.75 2.03 0.04 -1.26 -4.75 135.00 131.91 2kbg s PRO 94 Ca 0.38 0.50 -0.13 0.00 0.04 0.00 0.00 61.00 61.78 2kbg s PRO 94 Cb -0.12 -2.03 0.05 0.00 0.04 0.00 0.00 34.50 32.44 2kbg s PRO 94 CO 0.27 -0.98 1.15 -1.25 0.04 0.00 0.00 177.00 176.24 2kbg s PRO 95 N -5.33 2.14 0.00 0.56 0.04 -1.25 -4.49 135.00 126.67 2kbg s PRO 95 Ca 0.58 1.52 -0.37 0.00 0.04 0.00 0.00 61.00 62.77 2kbg s PRO 95 Cb -0.11 -1.86 -0.18 0.00 0.04 0.00 0.00 34.50 32.39 2kbg s PRO 95 CO 0.52 -1.78 0.98 1.17 0.04 0.00 0.00 177.00 177.93 2kbg n LYS 96 N -3.04 0.00 -2.25 4.56 3.00 -1.26 -4.85 118.16 114.32 2kbg n LYS 96 Ca 0.12 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 58.04 2kbg n LYS 96 Cb 0.51 -1.38 -0.02 0.00 0.00 0.00 0.00 35.03 34.15 2kbg n LYS 96 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2kbg s PRO 97 N -0.02 4.15 0.00 1.64 0.04 -1.26 -5.01 135.00 134.54 2kbg s PRO 97 Ca 0.84 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.81 2kbg s PRO 97 Cb -1.17 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 30.57 2kbg s PRO 97 CO 0.53 -0.27 0.00 -1.71 0.04 0.00 0.00 177.00 175.59 2kbg n ASN 98 N 0.31 0.00 0.23 6.66 4.05 -1.26 -4.64 115.26 120.61 2kbg n ASN 98 Ca 0.03 0.00 0.11 0.00 0.45 0.00 0.00 54.58 55.17 2kbg n ASN 98 Cb 0.45 0.00 0.42 0.00 1.23 0.00 0.00 39.78 41.88 2kbg n ASN 98 CO 0.00 0.00 0.00 0.16 -3.05 0.00 0.00 177.26 174.37 2kbg h ILE 99 N 0.00 0.35 -1.61 -1.44 3.07 -2.03 -3.49 117.51 112.36 2kbg h ILE 99 Ca 0.00 -1.07 0.00 0.00 1.55 0.00 0.00 64.86 65.34 2kbg h ILE 99 Cb 0.00 1.82 0.00 0.00 -0.27 0.00 0.00 36.82 38.37 2kbg h ILE 99 CO 0.00 0.16 -0.39 -0.38 -1.05 0.00 0.00 178.15 176.49 2kbg n ILE 100 N -3.24 -2.88 -4.02 0.16 5.41 -1.26 -5.08 119.36 108.43 2kbg n ILE 100 Ca 0.01 1.05 -0.09 0.00 1.00 0.00 0.00 62.75 64.71 2kbg n ILE 100 Cb 0.45 -1.61 -0.11 0.00 -0.71 0.00 0.00 39.64 37.66 2kbg n ILE 100 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2kbg s LYS 101 N -4.47 0.43 0.00 0.38 1.02 -1.26 -5.18 119.74 110.66 2kbg s LYS 101 Ca 0.00 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.20 2kbg s LYS 101 Cb 0.00 0.06 0.00 0.00 -0.52 0.00 0.00 37.83 37.37 2kbg s LYS 101 CO 0.00 -0.05 0.17 -0.40 -0.92 0.00 0.00 175.35 174.15