#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrk n SER 2 N 0.00 1.19 -3.74 1.61 2.88 -1.26 -4.90 113.62 109.40 2yrk n SER 2 Ca 0.00 0.61 -0.15 0.00 -1.33 0.00 0.00 58.87 58.00 2yrk n SER 2 Cb 0.00 -1.01 -0.15 0.00 -0.75 0.00 0.00 64.21 62.29 2yrk n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2yrk s SER 3 N 6.33 0.13 0.17 -3.46 1.04 -1.26 -5.16 113.70 111.49 2yrk s SER 3 Ca 1.16 0.19 0.02 0.00 0.48 0.00 0.00 55.95 57.80 2yrk s SER 3 Cb -1.30 0.07 -0.05 0.00 0.10 0.00 0.00 66.02 64.85 2yrk s SER 3 CO 0.61 -0.16 0.00 -0.83 0.98 0.00 0.00 173.24 173.84 2yrk s GLY 4 N 1.32 1.18 -0.23 7.32 0.00 -1.26 -5.11 107.32 110.53 2yrk s GLY 4 Ca -0.07 -1.57 -0.29 0.00 0.00 0.00 0.00 44.72 42.79 2yrk s GLY 4 CO -0.05 -1.51 1.27 -1.35 0.00 0.00 0.00 173.10 171.47 2yrk s SER 5 N -3.16 6.82 -0.25 1.64 1.04 -1.26 -5.00 113.70 113.53 2yrk s SER 5 Ca 0.23 1.46 -0.09 0.00 0.48 0.00 0.00 55.95 58.03 2yrk s SER 5 Cb 0.06 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.60 2yrk s SER 5 CO 0.03 -0.91 0.14 -0.94 0.98 0.00 0.00 173.24 172.54 2yrk s SER 6 N 2.33 5.74 0.75 7.02 1.04 -1.26 -5.08 113.70 124.25 2yrk s SER 6 Ca 0.55 -0.04 -0.14 0.00 0.48 0.00 0.00 55.95 56.80 2yrk s SER 6 Cb -0.19 -2.04 0.05 0.00 0.10 0.00 0.00 66.02 63.94 2yrk s SER 6 CO 0.18 -0.00 1.19 -0.83 0.98 0.00 0.00 173.24 174.76 2yrk s GLY 7 N 1.46 2.22 0.00 7.32 0.00 -1.26 -4.92 107.32 112.14 2yrk s GLY 7 Ca 0.06 0.80 0.00 0.00 0.00 0.00 0.00 44.72 45.58 2yrk s GLY 7 CO 0.07 1.20 0.00 0.61 0.00 0.00 0.00 173.10 174.98 2yrk n GLY 8 N 0.25 -0.22 3.73 0.20 0.00 -1.26 -5.12 105.19 102.77 2yrk n GLY 8 Ca 0.13 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2yrk n GLY 8 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2yrk n THR 9 N -2.06 2.60 -2.67 2.61 -1.04 -1.26 -4.90 114.28 107.55 2yrk n THR 9 Ca 0.00 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 61.09 2yrk n THR 9 Cb 0.00 -1.71 -0.03 0.00 -1.82 0.00 0.00 70.33 66.77 2yrk n THR 9 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2yrk s ASP 10 N -0.47 6.33 0.31 8.00 -1.08 -1.26 -4.88 116.67 123.62 2yrk s ASP 10 Ca 0.60 -1.10 0.00 0.00 -0.52 0.00 0.00 52.55 51.53 2yrk s ASP 10 Cb -0.48 -2.51 0.00 0.00 -1.46 0.00 0.00 42.92 38.47 2yrk s ASP 10 CO 0.58 -1.54 0.00 0.61 0.52 0.00 0.00 175.17 175.34 2yrk n GLY 11 N 5.84 0.66 3.51 2.66 0.00 -1.26 -4.32 105.19 112.29 2yrk n GLY 11 Ca 0.14 0.78 -0.32 0.00 0.00 0.00 0.00 46.02 46.62 2yrk n GLY 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yrk s THR 12 N 0.00 3.14 0.22 2.61 -4.23 -1.26 -5.11 115.64 111.00 2yrk s THR 12 Ca 0.00 -0.93 -0.27 0.00 -1.18 0.00 0.00 61.69 59.31 2yrk s THR 12 Cb 0.00 -2.31 -0.09 0.00 1.34 0.00 0.00 72.50 71.44 2yrk s THR 12 CO 0.00 0.43 0.87 -0.75 -0.54 0.00 0.00 174.62 174.62 2yrk s LYS 13 N -1.24 4.69 -0.83 3.99 2.20 -1.26 -4.97 119.74 122.33 2yrk s LYS 13 Ca 0.15 1.32 -0.25 0.00 -0.36 0.00 0.00 55.97 56.82 2yrk s LYS 13 Cb -0.11 -3.21 -0.04 0.00 -1.51 0.00 0.00 37.83 32.97 2yrk s LYS 13 CO 0.05 0.51 1.93 -1.25 -0.36 0.00 0.00 175.35 176.22 2yrk s PRO 14 N -1.29 2.57 0.25 4.03 0.04 -1.26 -4.89 135.00 134.45 2yrk s PRO 14 Ca 0.40 -0.06 -0.14 0.00 0.04 0.00 0.00 61.00 61.24 2yrk s PRO 14 Cb -0.24 -4.89 -0.00 0.00 0.04 0.00 0.00 34.50 29.41 2yrk s PRO 14 CO 0.28 -3.22 0.51 -1.83 0.04 0.00 0.00 177.00 172.79 2yrk s GLU 15 N 7.02 1.56 -0.50 4.56 -1.05 -1.26 -1.65 118.70 127.38 2yrk s GLU 15 Ca 0.69 -1.20 0.03 0.00 -0.15 0.00 0.00 54.97 54.34 2yrk s GLU 15 Cb -0.08 0.49 0.14 0.00 -0.44 0.00 0.00 34.13 34.24 2yrk s GLU 15 CO 0.05 -0.66 0.29 0.00 0.95 0.00 0.00 175.26 175.89 2yrk n THR 17 N 3.12 1.21 -0.02 0.00 5.66 -1.26 0.19 114.28 123.18 2yrk n THR 17 Ca 0.11 0.68 -0.19 0.00 -3.05 0.00 0.00 64.05 61.59 2yrk n THR 17 Cb 0.35 -1.68 -0.13 0.00 -1.55 0.00 0.00 70.33 67.32 2yrk n THR 17 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 2yrk h LEU 18 N 0.00 0.23 -2.20 1.09 5.85 -1.97 -3.36 115.31 114.96 2yrk h LEU 18 Ca 0.00 -0.85 0.00 0.00 0.84 0.00 0.00 57.88 57.87 2yrk h LEU 18 Cb 0.09 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2yrk h LEU 18 CO 0.00 1.39 0.00 0.00 -0.34 0.00 0.00 178.44 179.49 2yrk n GLY 20 N 1.37 0.34 3.21 0.00 0.00 0.52 -4.93 105.19 105.69 2yrk n GLY 20 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2yrk n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yrk s VAL 21 N -2.73 4.07 -0.66 1.61 1.01 -1.05 -4.92 120.40 117.74 2yrk s VAL 21 Ca 0.00 -1.74 -0.27 0.00 0.00 0.00 0.00 61.98 59.97 2yrk s VAL 21 Cb 0.00 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.75 2yrk s VAL 21 CO 0.00 -0.70 1.38 -0.75 0.00 0.00 0.00 175.10 175.03 2yrk s LYS 22 N 1.34 3.19 0.89 2.72 2.20 -1.26 -1.68 119.74 127.14 2yrk s LYS 22 Ca 0.05 0.11 -0.14 0.00 -0.36 0.00 0.00 55.97 55.64 2yrk s LYS 22 Cb -0.25 -4.17 0.02 0.00 -1.51 0.00 0.00 37.83 31.92 2yrk s LYS 22 CO -0.01 -2.11 0.45 0.66 -0.36 0.00 0.00 175.35 173.99 2yrk n TYR 23 N 9.74 -1.23 -3.63 4.03 4.01 -0.66 -4.93 117.16 124.49 2yrk n TYR 23 Ca 0.08 0.26 -0.31 0.00 -0.16 0.00 0.00 57.90 57.78 2yrk n TYR 23 Cb 0.49 -1.82 -0.05 0.00 -0.31 0.00 0.00 39.34 37.65 2yrk n TYR 23 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2yrk s SER 24 N -1.89 6.50 0.29 7.72 0.15 -1.26 -4.75 113.70 120.46 2yrk s SER 24 Ca 0.59 0.62 0.20 0.00 0.70 0.00 0.00 55.95 58.06 2yrk s SER 24 Cb -0.25 -2.10 1.02 0.00 -1.71 0.00 0.00 66.02 62.98 2yrk s SER 24 CO 0.65 0.02 1.11 0.00 1.20 0.00 0.00 173.24 176.22 2yrk n ALA 25 N -0.05 0.87 0.03 5.45 0.00 -1.26 0.67 120.51 126.22 2yrk n ALA 25 Ca -0.02 0.66 -0.08 0.00 0.00 0.00 0.00 53.44 54.00 2yrk n ALA 25 Cb 0.52 -0.74 -0.06 0.00 0.00 0.00 0.00 19.45 19.17 2yrk n ALA 25 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2yrk h ARG 26 N 0.00 -0.17 -6.76 0.00 2.43 -2.02 -3.46 114.38 104.40 2yrk h ARG 26 Ca 0.62 0.01 -0.48 0.00 -0.81 0.00 0.00 59.98 59.31 2yrk h ARG 26 Cb 1.84 0.04 0.23 0.00 -0.42 0.00 0.00 29.97 31.66 2yrk h ARG 26 CO -0.42 0.19 -0.80 -0.11 -1.51 0.00 0.00 179.97 177.31 2yrk n LEU 27 N -4.87 -1.39 -3.99 3.80 7.94 0.21 -5.04 117.00 113.67 2yrk n LEU 27 Ca -0.06 0.05 -0.09 0.00 -1.11 0.00 0.00 56.01 54.80 2yrk n LEU 27 Cb 0.22 -1.08 -0.10 0.00 0.53 0.00 0.00 43.42 42.98 2yrk n LEU 27 CO 0.18 -3.28 -0.33 -0.44 -1.11 0.00 0.00 177.39 172.42 2yrk s SER 28 N -1.96 0.27 0.29 1.96 0.01 -1.26 -4.58 113.70 108.43 2yrk s SER 28 Ca 0.57 -0.58 0.03 0.00 1.31 0.00 0.00 55.95 57.28 2yrk s SER 28 Cb -0.16 0.15 0.73 0.00 0.21 0.00 0.00 66.02 66.94 2yrk s SER 28 CO 0.66 -0.40 1.65 -0.29 0.41 0.00 0.00 173.24 175.28 2yrk h ILE 29 N 4.18 0.31 0.71 1.44 6.09 -1.95 -1.62 117.51 126.68 2yrk h ILE 29 Ca -0.32 -0.07 -0.03 0.00 -1.37 0.00 0.00 64.86 63.06 2yrk h ILE 29 Cb 1.19 0.08 0.00 0.00 0.47 0.00 0.00 36.82 38.57 2yrk h ILE 29 CO 0.47 0.04 -0.36 0.03 -3.07 0.00 0.00 178.15 175.26 2yrk h ARG 30 N 0.22 -0.94 -1.18 2.19 2.47 -1.99 -1.62 114.38 113.52 2yrk h ARG 30 Ca 0.56 0.06 0.41 0.00 -1.26 0.00 0.00 59.98 59.75 2yrk h ARG 30 Cb 1.14 0.21 -0.14 0.00 -1.65 0.00 0.00 29.97 29.53 2yrk h ARG 30 CO -0.65 -0.63 0.73 -0.44 0.56 0.00 0.00 179.97 179.53 2yrk h ASP 31 N -0.98 0.32 0.01 7.04 5.19 -1.70 0.85 116.42 127.15 2yrk h ASP 31 Ca -0.10 0.17 -0.00 0.00 -0.62 0.00 0.00 57.03 56.48 2yrk h ASP 31 Cb 0.76 0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.42 2yrk h ASP 31 CO 0.15 -0.22 -0.00 -0.74 -3.12 0.00 0.00 179.24 175.30 2yrk h HIS 32 N 0.12 -0.01 -0.35 4.55 2.76 -1.00 -3.13 115.15 118.10 2yrk h HIS 32 Ca 0.80 -0.00 0.10 0.00 -2.20 0.00 0.00 60.37 59.07 2yrk h HIS 32 Cb 2.30 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 31.25 2yrk h HIS 32 CO -0.01 -0.01 0.72 -0.84 -1.30 0.00 0.00 177.93 176.50 2yrk h ILE 33 N -0.02 0.09 -0.66 6.26 3.07 -0.46 0.63 117.51 126.43 2yrk h ILE 33 Ca -0.00 0.00 -0.37 0.00 1.55 0.00 0.00 64.86 66.03 2yrk h ILE 33 Cb 0.01 0.35 -0.20 0.00 -0.27 0.00 0.00 36.82 36.71 2yrk h ILE 33 CO 0.00 0.00 0.48 0.49 -1.05 0.00 0.00 178.15 178.07 2yrk n PHE 34 N -3.09 2.06 -3.90 0.16 3.72 0.21 -4.49 117.46 112.14 2yrk n PHE 34 Ca 0.07 -1.68 -0.19 0.00 -0.05 0.00 0.00 57.45 55.60 2yrk n PHE 34 Cb 0.86 -0.84 -0.17 0.00 -0.94 0.00 0.00 39.48 38.39 2yrk n PHE 34 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2yrk s SER 35 N -0.52 0.74 0.20 4.37 0.01 0.22 -4.97 113.70 113.76 2yrk s SER 35 Ca 0.39 -0.04 -0.05 0.00 1.31 0.00 0.00 55.95 57.56 2yrk s SER 35 Cb 0.32 -0.27 0.34 0.00 0.21 0.00 0.00 66.02 66.62 2yrk s SER 35 CO 0.05 -0.13 1.12 1.17 0.41 0.00 0.00 173.24 175.87 2yrk n LYS 36 N 4.41 -0.06 -0.39 12.44 0.00 -1.26 0.43 118.16 133.72 2yrk n LYS 36 Ca -0.21 1.12 -0.05 0.00 0.00 0.00 0.00 58.31 59.17 2yrk n LYS 36 Cb 0.50 -1.68 -0.01 0.00 0.00 0.00 0.00 35.03 33.84 2yrk n LYS 36 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.40 177.77 2yrk h GLN 37 N 0.00 -0.00 -0.27 1.64 5.75 -1.96 0.14 115.11 120.41 2yrk h GLN 37 Ca 0.35 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.75 2yrk h GLN 37 Cb 0.55 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.09 2yrk h GLN 37 CO -0.74 -0.00 -0.25 1.25 -2.65 0.00 0.00 178.83 176.44 2yrk h HIS 38 N -0.00 0.76 -0.61 3.99 2.76 -0.25 -3.26 115.15 118.53 2yrk h HIS 38 Ca 0.27 -0.23 0.09 0.00 -2.20 0.00 0.00 60.37 58.31 2yrk h HIS 38 Cb 0.53 -0.16 -0.11 0.00 1.55 0.00 0.00 27.41 29.21 2yrk h HIS 38 CO -0.93 0.94 -0.41 0.82 -1.30 0.00 0.00 177.93 177.05 2yrk h ILE 39 N 0.36 0.10 -0.41 6.26 1.08 0.28 -1.05 117.51 124.13 2yrk h ILE 39 Ca 0.04 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.59 2yrk h ILE 39 Cb 0.81 0.10 -0.09 0.00 -3.07 0.00 0.00 36.82 34.56 2yrk h ILE 39 CO 0.06 0.00 -0.40 -1.28 -0.69 0.00 0.00 178.15 175.84 2yrk h SER 40 N -0.20 -1.33 -1.02 1.72 0.87 -1.08 0.25 113.55 112.76 2yrk h SER 40 Ca 0.20 0.21 0.25 0.00 -1.23 0.00 0.00 61.79 61.22 2yrk h SER 40 Cb 0.56 0.60 -0.09 0.00 -0.44 0.00 0.00 62.40 63.02 2yrk h SER 40 CO -0.71 -0.35 0.65 0.50 -0.53 0.00 0.00 176.83 176.39 2yrk h LYS 41 N -0.30 0.44 -0.02 2.24 1.63 -1.29 0.59 116.57 119.86 2yrk h LYS 41 Ca 0.15 -0.03 -0.13 0.00 -0.85 0.00 0.00 60.65 59.80 2yrk h LYS 41 Cb 0.57 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.09 2yrk h LYS 41 CO -0.57 0.29 -0.58 0.28 -3.45 0.00 0.00 179.45 175.42 2yrk h VAL 42 N 0.45 1.41 0.00 2.00 2.07 0.22 0.27 116.25 122.67 2yrk h VAL 42 Ca 0.58 -1.98 -0.17 0.00 0.82 0.00 0.00 66.70 65.95 2yrk h VAL 42 Cb 1.37 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 33.16 2yrk h VAL 42 CO -0.30 0.57 -0.86 0.03 0.02 0.00 0.00 177.57 177.03 2yrk h ARG 43 N 0.05 0.00 0.00 1.57 3.08 0.15 -3.36 114.38 115.88 2yrk h ARG 43 Ca -0.01 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 2yrk h ARG 43 Cb 1.04 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.07 2yrk h ARG 43 CO 0.08 0.75 -0.85 0.93 -1.07 0.00 0.00 179.97 179.81 2yrk h GLU 44 N 0.00 0.00 -1.45 0.04 4.39 -0.46 0.27 114.58 117.37 2yrk h GLU 44 Ca -0.03 0.00 0.45 0.00 0.34 0.00 0.00 59.36 60.12 2yrk h GLU 44 Cb 1.63 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 30.19 2yrk h GLU 44 CO 0.10 0.90 1.00 -2.37 -1.16 0.00 0.00 179.01 177.48 2yrk n THR 45 N -4.50 -0.09 -0.02 1.13 5.66 0.95 -1.30 114.28 116.10 2yrk n THR 45 Ca -0.24 1.37 -0.03 0.00 -3.05 0.00 0.00 64.05 62.10 2yrk n THR 45 Cb 0.58 -2.26 -0.02 0.00 -1.55 0.00 0.00 70.33 67.08 2yrk n THR 45 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 2yrk n VAL 46 N -3.95 0.23 -1.78 1.08 3.14 -1.26 -4.82 118.33 110.97 2yrk n VAL 46 Ca 0.36 -0.10 -0.42 0.00 -2.96 0.00 0.00 64.34 61.22 2yrk n VAL 46 Cb 1.53 -0.70 -0.00 0.00 -1.06 0.00 0.00 33.84 33.61 2yrk n VAL 46 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2yrk n GLY 47 N 3.20 4.46 0.51 7.55 0.00 0.95 -4.31 105.19 117.56 2yrk n GLY 47 Ca -0.07 -1.65 -0.06 0.00 0.00 0.00 0.00 46.02 44.25 2yrk n GLY 47 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2yrk n SER 48 N 5.73 1.61 -4.55 1.61 3.41 -1.22 -4.48 113.62 115.73 2yrk n SER 48 Ca 0.52 0.04 -0.31 0.00 -0.26 0.00 0.00 58.87 58.85 2yrk n SER 48 Cb 0.38 -0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 64.12 2yrk n SER 48 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2yrk n GLN 49 N -3.05 0.80 -1.56 4.33 6.02 -1.26 -4.85 117.38 117.80 2yrk n GLN 49 Ca -0.12 -0.19 -0.51 0.00 -0.01 0.00 0.00 57.00 56.17 2yrk n GLN 49 Cb 0.60 -3.23 -0.05 0.00 1.02 0.00 0.00 30.24 28.58 2yrk n GLN 49 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 2yrk n LEU 50 N 15.67 1.25 -4.74 1.08 0.00 -1.26 -4.95 117.00 124.05 2yrk n LEU 50 Ca 0.43 1.13 -0.35 0.00 0.00 0.00 0.00 56.01 57.22 2yrk n LEU 50 Cb 0.46 -1.16 -0.08 0.00 0.00 0.00 0.00 43.42 42.64 2yrk n LEU 50 CO 0.71 -1.35 -0.27 -0.62 0.00 0.00 0.00 177.39 175.86 2yrk s ASP 51 N 0.14 5.59 0.27 1.96 -1.08 -1.26 -5.12 116.67 117.17 2yrk s ASP 51 Ca 0.79 0.24 0.08 0.00 -0.52 0.00 0.00 52.55 53.14 2yrk s ASP 51 Cb -0.95 -1.65 -0.06 0.00 -1.46 0.00 0.00 42.92 38.80 2yrk s ASP 51 CO 0.51 0.38 -0.09 0.00 0.52 0.00 0.00 175.17 176.49 2yrk s ARG 52 N -0.95 1.55 0.37 4.34 3.03 -1.26 -5.16 118.95 120.85 2yrk s ARG 52 Ca 0.14 -1.76 0.04 0.00 2.03 0.00 0.00 55.73 56.18 2yrk s ARG 52 Cb -0.12 -1.26 -0.03 0.00 -1.03 0.00 0.00 34.95 32.51 2yrk s ARG 52 CO 0.03 0.10 0.15 -1.21 -1.13 0.00 0.00 175.30 173.25 2yrk s GLU 53 N -3.68 1.80 0.12 3.89 8.01 -1.26 -5.11 118.70 122.48 2yrk s GLU 53 Ca 0.28 -2.07 -0.31 0.00 0.01 0.00 0.00 54.97 52.88 2yrk s GLU 53 Cb 0.02 -0.35 -0.10 0.00 -4.31 0.00 0.00 34.13 29.39 2yrk s GLU 53 CO 0.12 -0.48 1.74 0.21 0.01 0.00 0.00 175.26 176.86 2yrk s LYS 54 N -3.71 4.16 0.00 1.61 2.36 -1.26 -5.37 119.74 117.53 2yrk s LYS 54 Ca 0.30 2.50 0.00 0.00 -2.55 0.00 0.00 55.97 56.22 2yrk s LYS 54 Cb 0.03 -3.48 0.00 0.00 -1.05 0.00 0.00 37.83 33.33 2yrk s LYS 54 CO 0.17 -0.78 0.22 -0.40 1.55 0.00 0.00 175.35 176.11