#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bbo n TYR 2 N 0.00 -0.86 -3.57 2.13 4.01 -1.26 -5.03 117.16 112.58 1bbo n TYR 2 Ca 0.00 -2.29 -0.41 0.00 -0.16 0.00 0.00 57.90 55.04 1bbo n TYR 2 Cb 0.00 0.73 -0.09 0.00 -0.31 0.00 0.00 39.34 39.67 1bbo n TYR 2 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1bbo s ILE 3 N -1.28 4.21 -0.23 -0.72 -1.09 -1.25 -4.17 121.20 116.66 1bbo s ILE 3 Ca 0.24 -1.69 -0.39 0.00 -2.23 0.00 0.00 60.65 56.57 1bbo s ILE 3 Cb 0.43 -3.73 -0.15 0.00 -1.58 0.00 0.00 42.46 37.42 1bbo s ILE 3 CO -0.03 -0.71 1.72 0.00 -1.23 0.00 0.00 174.94 174.68 1bbo h GLU 5 N 7.10 0.00 0.00 0.00 4.39 -1.95 0.29 114.58 124.41 1bbo h GLU 5 Ca -0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1bbo h GLU 5 Cb 1.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 1bbo h GLU 5 CO 0.94 0.00 -0.06 1.49 -1.16 0.00 0.00 179.01 180.22 1bbo h GLU 6 N 0.00 0.00 0.02 2.33 4.81 -2.01 -3.43 114.58 116.30 1bbo h GLU 6 Ca 0.02 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1bbo h GLU 6 Cb 0.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.63 1bbo h GLU 6 CO -0.00 0.00 -0.14 0.00 -0.73 0.00 0.00 179.01 178.14 1bbo n GLY 8 N 1.43 1.27 3.68 0.00 0.00 0.10 -4.97 105.19 106.70 1bbo n GLY 8 Ca -0.10 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.45 1bbo n GLY 8 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1bbo n ILE 9 N -1.28 0.22 -3.61 -0.61 3.06 -1.26 -4.48 119.36 111.40 1bbo n ILE 9 Ca 0.00 -0.04 -0.20 0.00 -2.50 0.00 0.00 62.75 60.01 1bbo n ILE 9 Cb 0.00 -1.71 -0.01 0.00 0.54 0.00 0.00 39.64 38.46 1bbo n ILE 9 CO 0.00 0.00 0.00 -0.60 -2.50 0.00 0.00 176.55 173.45 1bbo s ARG 10 N 2.07 3.22 -0.00 9.51 3.52 -1.26 -2.67 118.95 133.34 1bbo s ARG 10 Ca 0.83 -0.91 0.00 0.00 -0.13 0.00 0.00 55.73 55.52 1bbo s ARG 10 Cb -0.66 -2.83 0.00 0.00 -1.56 0.00 0.00 34.95 29.90 1bbo s ARG 10 CO 0.42 0.17 0.54 1.63 -0.81 0.00 0.00 175.30 177.24 1bbo n LYS 12 N -1.58 0.11 -4.19 5.12 5.02 -1.26 -5.05 118.16 116.33 1bbo n LYS 12 Ca -0.03 -0.56 -0.20 0.00 -2.02 0.00 0.00 58.31 55.51 1bbo n LYS 12 Cb 0.58 -0.52 -0.16 0.00 -0.02 0.00 0.00 35.03 34.91 1bbo n LYS 12 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1bbo s LYS 13 N -0.04 0.81 0.44 1.97 1.02 -1.26 -5.02 119.74 117.66 1bbo s LYS 13 Ca 0.00 -0.13 0.12 0.00 0.02 0.00 0.00 55.97 55.98 1bbo s LYS 13 Cb 0.00 -0.81 0.96 0.00 -0.52 0.00 0.00 37.83 37.46 1bbo s LYS 13 CO 0.00 -0.05 2.00 -1.00 -0.92 0.00 0.00 175.35 175.38 1bbo h PRO 14 N 7.02 0.14 -0.32 -1.68 0.13 -1.98 -2.04 132.00 133.27 1bbo h PRO 14 Ca -0.37 -0.02 0.05 0.00 -0.87 0.00 0.00 66.00 64.79 1bbo h PRO 14 Cb 1.16 -0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 1bbo h PRO 14 CO 0.48 0.23 0.01 0.66 -0.23 0.00 0.00 178.00 179.16 1bbo h SER 15 N 0.14 -0.10 -0.14 1.44 4.64 -1.98 0.93 113.55 118.48 1bbo h SER 15 Ca 0.03 0.07 -0.11 0.00 -0.47 0.00 0.00 61.79 61.31 1bbo h SER 15 Cb 0.24 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1bbo h SER 15 CO 0.01 -0.01 -0.35 0.24 -0.87 0.00 0.00 176.83 175.85 1bbo h MET 16 N 0.11 0.48 0.45 4.77 2.86 -1.90 -2.88 114.93 118.81 1bbo h MET 16 Ca 0.15 -0.33 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 1bbo h MET 16 Cb 0.20 0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1bbo h MET 16 CO -0.25 0.95 -0.21 1.25 1.06 0.00 0.00 176.91 179.71 1bbo h LEU 17 N 0.08 -0.51 -0.94 1.22 7.12 -1.08 -0.03 115.31 121.17 1bbo h LEU 17 Ca -0.01 -0.08 0.17 0.00 0.13 0.00 0.00 57.88 58.10 1bbo h LEU 17 Cb 0.97 0.13 -0.17 0.00 -0.53 0.00 0.00 40.66 41.05 1bbo h LEU 17 CO 0.08 -0.20 -0.29 0.11 -0.13 0.00 0.00 178.44 178.01 1bbo h LYS 18 N -0.82 -0.01 -0.34 1.25 1.79 0.80 0.70 116.57 119.94 1bbo h LYS 18 Ca -0.06 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.28 1bbo h LYS 18 Cb 0.56 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.20 1bbo h LYS 18 CO 0.10 -0.01 -0.33 -0.22 -1.08 0.00 0.00 179.45 177.91 1bbo h LYS 19 N -0.01 0.75 -0.55 3.15 3.64 -1.41 -2.82 116.57 119.32 1bbo h LYS 19 Ca 0.41 -0.35 0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1bbo h LYS 19 Cb 0.66 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 1bbo h LYS 19 CO -0.97 0.97 0.30 1.25 -2.27 0.00 0.00 179.45 178.73 1bbo h HIS 20 N 0.63 0.55 -0.00 1.91 2.76 0.23 -1.01 115.15 120.22 1bbo h HIS 20 Ca 0.07 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.19 1bbo h HIS 20 Cb 0.87 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.65 1bbo h HIS 20 CO 0.04 0.28 -0.32 0.97 -1.30 0.00 0.00 177.93 177.60 1bbo h ILE 21 N 0.58 1.23 0.00 6.26 6.09 -0.76 -2.10 117.51 128.81 1bbo h ILE 21 Ca 0.24 -1.10 -0.03 0.00 -1.37 0.00 0.00 64.86 62.60 1bbo h ILE 21 Cb 0.12 1.59 -0.00 0.00 0.47 0.00 0.00 36.82 39.00 1bbo h ILE 21 CO -0.15 0.32 -0.14 0.03 -3.07 0.00 0.00 178.15 175.14 1bbo h ARG 22 N 0.00 0.00 0.00 2.19 3.08 -0.94 -2.46 114.38 116.25 1bbo h ARG 22 Ca -0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 1bbo h ARG 22 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 1bbo h ARG 22 CO 0.04 0.14 -0.34 1.15 -1.07 0.00 0.00 179.97 179.89 1bbo h THR 23 N 0.00 1.03 0.00 2.04 2.02 -0.90 -2.43 112.91 114.67 1bbo h THR 23 Ca -0.00 -1.25 0.00 0.00 0.77 0.00 0.00 66.41 65.93 1bbo h THR 23 Cb 0.48 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1bbo h THR 23 CO 0.02 0.33 0.00 1.41 0.37 0.00 0.00 175.52 177.65 1bbo n HIS 24 N -3.82 0.00 0.00 3.16 8.25 -0.93 -4.33 115.22 117.55 1bbo n HIS 24 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1bbo n HIS 24 Cb 0.42 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.52 1bbo n HIS 24 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1bbo n THR 25 N -0.43 0.00 -2.26 1.59 -2.24 -0.91 -4.99 114.28 105.03 1bbo n THR 25 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 1bbo n THR 25 Cb 0.01 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.22 1bbo n THR 25 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1bbo n ASP 26 N 0.00 0.02 -2.44 3.42 8.00 -1.26 -4.93 116.55 119.37 1bbo n ASP 26 Ca 0.00 -2.00 -0.31 0.00 0.71 0.00 0.00 54.79 53.19 1bbo n ASP 26 Cb 0.00 -0.01 0.03 0.00 -0.02 0.00 0.00 41.12 41.13 1bbo n ASP 26 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1bbo n VAL 27 N 0.24 3.40 -3.84 2.53 3.14 -1.26 -4.79 118.33 117.75 1bbo n VAL 27 Ca -0.11 -3.07 -0.32 0.00 -2.96 0.00 0.00 64.34 57.89 1bbo n VAL 27 Cb 0.93 -1.30 -0.11 0.00 -1.06 0.00 0.00 33.84 32.29 1bbo n VAL 27 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1bbo s ARG 28 N -3.08 2.48 0.43 1.45 0.52 -1.26 -4.74 118.95 114.73 1bbo s ARG 28 Ca 0.54 -2.97 0.11 0.00 -0.52 0.00 0.00 55.73 52.89 1bbo s ARG 28 Cb 0.41 -3.54 0.92 0.00 0.52 0.00 0.00 34.95 33.26 1bbo s ARG 28 CO -0.16 -1.21 2.01 -1.35 0.02 0.00 0.00 175.30 174.60 1bbo h PRO 29 N 6.14 0.24 -6.30 3.54 0.11 -1.87 -3.41 132.00 130.46 1bbo h PRO 29 Ca 0.05 -0.03 -0.55 0.00 0.11 0.00 0.00 66.00 65.57 1bbo h PRO 29 Cb 0.84 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.87 1bbo h PRO 29 CO 0.73 0.28 1.21 0.71 -0.21 0.00 0.00 178.00 180.72 1bbo s TYR 30 N -4.97 2.00 -0.06 0.65 2.02 -1.17 -4.94 117.35 110.88 1bbo s TYR 30 Ca -0.06 0.64 0.05 0.00 -0.37 0.00 0.00 57.07 57.34 1bbo s TYR 30 Cb 0.16 -4.21 -0.02 0.00 -0.40 0.00 0.00 41.96 37.49 1bbo s TYR 30 CO 0.72 -2.40 -0.22 -1.01 -1.57 0.00 0.00 175.55 171.07 1bbo s HIS 31 N 6.86 2.52 0.56 2.71 3.76 -1.26 -0.26 115.29 130.17 1bbo s HIS 31 Ca 0.68 -0.53 -0.21 0.00 -0.15 0.00 0.00 55.06 54.84 1bbo s HIS 31 Cb -0.16 -1.61 -0.04 0.00 1.11 0.00 0.00 32.58 31.87 1bbo s HIS 31 CO 0.29 -0.09 1.36 0.00 -0.85 0.00 0.00 174.74 175.45 1bbo n THR 33 N -1.12 0.00 0.00 0.00 -1.04 -1.26 -4.30 114.28 106.57 1bbo n THR 33 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 1bbo n THR 33 Cb 0.45 -0.20 0.00 0.00 -1.82 0.00 0.00 70.33 68.76 1bbo n THR 33 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1bbo n TYR 34 N -0.29 -0.31 0.00 -1.42 4.02 -1.26 -5.12 117.16 112.77 1bbo n TYR 34 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1bbo n TYR 34 Cb 0.07 0.42 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 1bbo n TYR 34 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1bbo n ASN 36 N -1.23 1.45 -4.86 0.00 5.15 -1.26 -4.67 115.26 109.84 1bbo n ASN 36 Ca 0.00 -1.61 -0.31 0.00 -0.60 0.00 0.00 54.58 52.05 1bbo n ASN 36 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 1bbo n ASN 36 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1bbo s PHE 37 N -0.61 3.50 0.03 1.20 5.36 -1.26 -4.94 117.98 121.25 1bbo s PHE 37 Ca 0.00 1.32 -0.02 0.00 -0.96 0.00 0.00 56.93 57.28 1bbo s PHE 37 Cb 0.00 -2.69 -0.02 0.00 -0.34 0.00 0.00 43.02 39.97 1bbo s PHE 37 CO 0.00 -0.38 0.00 0.45 -1.46 0.00 0.00 175.22 173.83 1bbo s SER 38 N -3.36 0.27 0.21 6.13 0.15 -1.26 -2.65 113.70 113.19 1bbo s SER 38 Ca 0.56 -0.58 0.10 0.00 0.70 0.00 0.00 55.95 56.73 1bbo s SER 38 Cb -0.10 0.15 -0.05 0.00 -1.71 0.00 0.00 66.02 64.31 1bbo s SER 38 CO 0.37 -0.40 -0.20 -0.36 1.20 0.00 0.00 173.24 173.85 1bbo s PHE 39 N -2.12 2.11 -0.54 3.44 0.40 0.64 -4.98 117.98 116.93 1bbo s PHE 39 Ca -0.10 -0.40 0.24 0.00 -0.60 0.00 0.00 56.93 56.07 1bbo s PHE 39 Cb -0.05 -1.00 0.39 0.00 0.51 0.00 0.00 43.02 42.87 1bbo s PHE 39 CO -0.03 0.50 1.44 -0.22 0.70 0.00 0.00 175.22 177.61 1bbo h LYS 40 N 2.88 0.00 -5.60 0.44 1.63 -1.87 -3.10 116.57 110.96 1bbo h LYS 40 Ca -0.43 0.00 -0.45 0.00 -0.85 0.00 0.00 60.65 58.92 1bbo h LYS 40 Cb 1.22 0.00 -0.16 0.00 -0.60 0.00 0.00 32.23 32.69 1bbo h LYS 40 CO 0.54 0.00 -0.75 0.95 -3.45 0.00 0.00 179.45 176.73 1bbo s THR 41 N -3.20 1.62 -0.32 1.00 -4.23 -1.26 -4.86 115.64 104.40 1bbo s THR 41 Ca 0.06 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.83 1bbo s THR 41 Cb 0.11 -1.85 0.35 0.00 1.34 0.00 0.00 72.50 72.45 1bbo s THR 41 CO 0.69 -0.48 1.71 0.50 -0.54 0.00 0.00 174.62 176.51 1bbo h LYS 42 N 3.01 0.00 0.88 3.99 3.64 -1.99 -3.31 116.57 122.79 1bbo h LYS 42 Ca -0.40 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.94 1bbo h LYS 42 Cb 1.21 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.04 1bbo h LYS 42 CO 0.56 0.00 -0.42 0.78 -2.27 0.00 0.00 179.45 178.10 1bbo h GLY 43 N 3.51 -1.23 0.51 5.01 0.00 -2.00 -2.29 103.07 106.58 1bbo h GLY 43 Ca 0.00 0.46 0.21 0.00 0.00 0.00 0.00 47.33 48.00 1bbo h GLY 43 CO 0.00 -0.45 0.54 3.43 0.00 0.00 0.00 176.54 180.06 1bbo h ASN 44 N -1.24 0.00 0.88 0.19 4.21 -2.00 -1.66 115.58 115.95 1bbo h ASN 44 Ca -0.12 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.35 1bbo h ASN 44 Cb 0.91 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.11 1bbo h ASN 44 CO 0.20 0.00 -0.45 0.25 -1.29 0.00 0.00 177.43 176.14 1bbo h LEU 45 N 0.00 -1.09 -1.65 1.61 7.12 -1.50 -1.57 115.31 118.23 1bbo h LEU 45 Ca 0.35 0.04 0.26 0.00 0.13 0.00 0.00 57.88 58.66 1bbo h LEU 45 Cb 1.42 0.29 -0.07 0.00 -0.53 0.00 0.00 40.66 41.78 1bbo h LEU 45 CO -0.00 -0.74 0.68 0.74 -0.13 0.00 0.00 178.44 178.98 1bbo h THR 46 N -1.22 0.55 -0.62 1.05 2.02 -1.05 0.36 112.91 114.01 1bbo h THR 46 Ca -0.12 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 1bbo h THR 46 Cb 0.94 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 1bbo h THR 46 CO 0.18 0.04 0.29 0.50 0.37 0.00 0.00 175.52 176.90 1bbo h LYS 47 N 0.24 0.89 0.00 6.66 3.64 -0.98 0.81 116.57 127.84 1bbo h LYS 47 Ca 0.52 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.76 1bbo h LYS 47 Cb 1.59 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 33.26 1bbo h LYS 47 CO -0.15 0.72 0.00 1.25 -2.27 0.00 0.00 179.45 179.00 1bbo h HIS 48 N 0.85 0.00 0.09 1.91 2.76 0.63 -2.94 115.15 118.45 1bbo h HIS 48 Ca 0.21 0.00 -0.33 0.00 -2.20 0.00 0.00 60.37 58.05 1bbo h HIS 48 Cb 0.13 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.07 1bbo h HIS 48 CO 0.00 0.00 -1.80 0.52 -1.30 0.00 0.00 177.93 175.36 1bbo h MET 49 N 0.00 0.19 -0.82 5.26 2.86 -0.55 -3.36 114.93 118.51 1bbo h MET 49 Ca 0.00 -0.33 0.18 0.00 -2.06 0.00 0.00 59.70 57.49 1bbo h MET 49 Cb 0.44 0.12 -0.15 0.00 0.06 0.00 0.00 31.60 32.07 1bbo h MET 49 CO 0.00 0.99 -0.14 -0.22 1.06 0.00 0.00 176.91 178.60 1bbo h LYS 50 N 0.05 0.02 -6.97 1.72 3.64 -0.69 -3.40 116.57 110.94 1bbo h LYS 50 Ca -0.34 -0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.50 1bbo h LYS 50 Cb 2.03 -0.00 0.11 0.00 -0.41 0.00 0.00 32.23 33.96 1bbo h LYS 50 CO 0.11 0.01 0.72 0.45 -2.27 0.00 0.00 179.45 178.47 1bbo s SER 51 N -5.21 6.05 0.00 4.20 0.15 -1.25 -4.80 113.70 112.83 1bbo s SER 51 Ca -0.14 2.94 0.00 0.00 0.70 0.00 0.00 55.95 59.44 1bbo s SER 51 Cb 0.24 -2.66 0.00 0.00 -1.71 0.00 0.00 66.02 61.89 1bbo s SER 51 CO 0.76 -1.06 0.87 2.29 1.20 0.00 0.00 173.24 177.30 1bbo n LYS 52 N 0.03 0.64 0.00 5.44 2.85 -1.26 -4.48 118.16 121.38 1bbo n LYS 52 Ca 0.04 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.30 1bbo n LYS 52 Cb 0.41 -1.18 0.00 0.00 -0.65 0.00 0.00 35.03 33.61 1bbo n LYS 52 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1bbo n ALA 53 N 1.03 0.00 -3.01 0.58 0.00 -1.26 -4.76 120.51 113.10 1bbo n ALA 53 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1bbo n ALA 53 Cb 0.32 0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.76 1bbo n ALA 53 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1bbo n HIS 54 N -0.19 -1.72 0.00 0.00 1.44 -1.26 -5.02 115.22 108.47 1bbo n HIS 54 Ca 0.00 -2.74 0.00 0.00 -2.01 0.00 0.00 57.72 52.97 1bbo n HIS 54 Cb 0.00 0.51 0.00 0.00 0.12 0.00 0.00 29.99 30.62 1bbo n HIS 54 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1bbo n SER 55 N 1.64 0.00 0.00 4.39 2.88 -1.26 -4.88 113.62 116.39 1bbo n SER 55 Ca 0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 1bbo n SER 55 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1bbo n SER 55 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1bbo n LYS 56 N -1.16 0.00 0.00 -1.46 5.02 -1.26 -5.18 118.16 114.12 1bbo n LYS 56 Ca 0.00 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 1bbo n LYS 56 Cb 0.00 0.00 0.55 0.00 -0.02 0.00 0.00 35.03 35.56 1bbo n LYS 56 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51