#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 1.01 -4.05 2.13 4.01 -1.26 -4.82 117.16 114.17 1bbo n TYR 2 Ca 0.00 -1.89 -0.32 0.00 -0.16 0.00 0.00 57.90 55.53 1bbo n TYR 2 Cb 0.00 -1.60 -0.16 0.00 -0.31 0.00 0.00 39.34 37.27 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 -0.37 1.88 -0.21 -0.72 1.01 -1.26 -4.62 121.20 116.92 1bbo s ILE 3 Ca 0.63 -1.08 -0.28 0.00 0.00 0.00 0.00 60.65 59.91 1bbo s ILE 3 Cb 0.33 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1bbo s ILE 3 CO -0.10 0.28 2.03 0.00 0.00 0.00 0.00 174.94 177.15 1bbo h GLU 5 N 13.61 0.00 0.00 0.00 3.07 -1.95 0.26 114.58 129.56 1bbo h GLU 5 Ca -0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.46 1bbo h GLU 5 Cb 1.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1bbo h GLU 5 CO 0.98 0.00 -0.04 1.49 -1.40 0.00 0.00 179.01 180.04 1bbo h GLU 6 N 0.00 0.00 0.06 2.33 4.81 -2.00 -3.42 114.58 116.36 1bbo h GLU 6 Ca 0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1bbo h GLU 6 Cb 0.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1bbo h GLU 6 CO 0.00 0.00 -0.03 0.00 -0.73 0.00 0.00 179.01 178.25 1bbo n GLY 8 N 1.15 1.69 3.73 0.00 0.00 0.89 -5.03 105.19 107.63 1bbo n GLY 8 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1bbo n GLY 8 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1bbo s ILE 9 N -2.00 2.47 0.30 -0.61 1.10 -1.26 -4.72 121.20 116.49 1bbo s ILE 9 Ca 0.00 0.36 0.07 0.00 -0.51 0.00 0.00 60.65 60.57 1bbo s ILE 9 Cb 0.00 -3.23 -0.03 0.00 0.15 0.00 0.00 42.46 39.35 1bbo s ILE 9 CO 0.00 0.04 0.28 -0.60 -2.11 0.00 0.00 174.94 172.55 1bbo s ARG 10 N 0.49 2.86 0.00 3.50 6.06 -1.26 -2.54 118.95 128.05 1bbo s ARG 10 Ca 0.67 -1.17 0.00 0.00 -2.50 0.00 0.00 55.73 52.73 1bbo s ARG 10 Cb -0.45 -2.55 0.00 0.00 0.06 0.00 0.00 34.95 32.01 1bbo s ARG 10 CO 0.37 0.21 0.48 1.63 -2.50 0.00 0.00 175.30 175.49 1bbo n LYS 12 N -1.33 0.00 -3.99 5.12 5.02 -1.26 -5.07 118.16 116.65 1bbo n LYS 12 Ca -0.04 -0.47 -0.10 0.00 -2.02 0.00 0.00 58.31 55.68 1bbo n LYS 12 Cb 0.59 -0.44 -0.11 0.00 -0.02 0.00 0.00 35.03 35.05 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 0.00 0.34 0.00 1.97 1.02 -1.26 -5.07 119.74 116.74 1bbo s LYS 13 Ca 0.00 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 55.37 1bbo s LYS 13 Cb 0.00 0.02 0.00 0.00 -0.52 0.00 0.00 37.83 37.33 1bbo s LYS 13 CO 0.00 -0.03 0.79 -0.35 -0.92 0.00 0.00 175.35 174.84 1bbo n PRO 14 N 1.63 0.00 -0.17 -1.68 -0.04 -1.26 -2.15 135.00 131.33 1bbo n PRO 14 Ca -0.23 0.45 0.11 0.00 -0.04 0.00 0.00 63.50 63.79 1bbo n PRO 14 Cb 0.55 -1.37 0.21 0.00 -0.04 0.00 0.00 33.50 32.86 1bbo n PRO 14 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1bbo n SER 15 N -1.86 0.04 0.07 3.54 3.41 -1.26 0.19 113.62 117.76 1bbo n SER 15 Ca 0.00 0.85 -0.13 0.00 -0.26 0.00 0.00 58.87 59.33 1bbo n SER 15 Cb 0.00 -0.35 -0.09 0.00 -0.26 0.00 0.00 64.21 63.51 1bbo n SER 15 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1bbo h MET 16 N 0.00 -0.21 0.39 4.33 2.86 -1.99 -2.82 114.93 117.49 1bbo h MET 16 Ca 0.36 0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.99 1bbo h MET 16 Cb 0.85 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.56 1bbo h MET 16 CO -0.44 0.18 -0.19 1.25 1.06 0.00 0.00 176.91 178.77 1bbo h LEU 17 N -0.65 -0.44 -0.74 1.22 7.12 0.27 -2.46 115.31 119.63 1bbo h LEU 17 Ca -0.02 -0.13 0.13 0.00 0.13 0.00 0.00 57.88 57.99 1bbo h LEU 17 Cb 0.48 0.11 -0.13 0.00 -0.53 0.00 0.00 40.66 40.59 1bbo h LEU 17 CO 0.04 -0.07 -0.23 0.29 -0.13 0.00 0.00 178.44 178.34 1bbo n LYS 18 N -5.18 -0.11 -0.13 1.25 5.02 0.37 0.26 118.16 119.64 1bbo n LYS 18 Ca -0.10 1.14 -0.09 0.00 -2.02 0.00 0.00 58.31 57.24 1bbo n LYS 18 Cb 0.28 -1.70 0.05 0.00 -0.02 0.00 0.00 35.03 33.64 1bbo n LYS 18 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1bbo h LYS 19 N 0.00 0.91 0.27 1.97 1.57 -1.47 -2.74 116.57 117.08 1bbo h LYS 19 Ca 0.31 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1bbo h LYS 19 Cb 0.50 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1bbo h LYS 19 CO -0.75 1.01 -0.13 1.25 -0.57 0.00 0.00 179.45 180.26 1bbo h HIS 20 N 0.80 -0.34 -0.57 -1.35 2.76 0.40 -1.52 115.15 115.33 1bbo h HIS 20 Ca 0.11 -0.01 0.16 0.00 -2.20 0.00 0.00 60.37 58.43 1bbo h HIS 20 Cb 0.73 0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.77 1bbo h HIS 20 CO 0.04 -0.17 0.41 0.97 -1.30 0.00 0.00 177.93 177.88 1bbo h ILE 21 N -0.43 0.74 0.00 6.26 6.09 -0.47 0.60 117.51 130.29 1bbo h ILE 21 Ca -0.04 -0.02 0.00 0.00 -1.37 0.00 0.00 64.86 63.43 1bbo h ILE 21 Cb 0.33 0.68 0.00 0.00 0.47 0.00 0.00 36.82 38.30 1bbo h ILE 21 CO 0.06 0.01 0.00 0.03 -3.07 0.00 0.00 178.15 175.18 1bbo h ARG 22 N 0.06 0.00 0.00 2.19 3.08 -1.00 -2.82 114.38 115.89 1bbo h ARG 22 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1bbo h ARG 22 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.06 1bbo h ARG 22 CO -0.02 0.00 0.00 2.41 -1.07 0.00 0.00 179.97 181.29 1bbo n THR 23 N -3.04 0.00 0.12 2.04 -1.04 0.21 -2.06 114.28 110.51 1bbo n THR 23 Ca 0.02 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.12 1bbo n THR 23 Cb 0.42 -0.45 0.17 0.00 -1.82 0.00 0.00 70.33 68.65 1bbo n THR 23 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1bbo n HIS 24 N -0.76 0.42 0.00 -1.42 8.25 -1.06 -4.80 115.22 115.85 1bbo n HIS 24 Ca 0.08 -0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 1bbo n HIS 24 Cb 0.04 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.14 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 1.00 0.00 -2.03 1.59 -2.24 -0.87 -5.00 114.28 106.73 1bbo n THR 25 Ca 0.14 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.91 1bbo n THR 25 Cb 0.48 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 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 -0.25 -2.80 3.42 8.00 -1.26 -4.95 116.55 118.71 1bbo n ASP 26 Ca 0.00 -1.45 -0.36 0.00 0.71 0.00 0.00 54.79 53.68 1bbo n ASP 26 Cb 0.00 0.05 0.01 0.00 -0.02 0.00 0.00 41.12 41.16 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 0.03 3.55 -3.57 2.53 3.14 -1.26 -4.75 118.33 118.00 1bbo n VAL 27 Ca -0.08 -3.93 -0.28 0.00 -2.96 0.00 0.00 64.34 57.09 1bbo n VAL 27 Cb 0.62 -1.35 -0.12 0.00 -1.06 0.00 0.00 33.84 31.93 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 -3.37 1.14 0.66 1.45 0.52 -1.26 -4.65 118.95 113.44 1bbo s ARG 28 Ca 0.54 -2.07 0.41 0.00 -0.52 0.00 0.00 55.73 54.09 1bbo s ARG 28 Cb 0.42 -1.92 2.25 0.00 0.52 0.00 0.00 34.95 36.23 1bbo s ARG 28 CO -0.36 -1.27 2.30 -1.35 0.02 0.00 0.00 175.30 174.64 1bbo h PRO 29 N 6.22 0.00 -5.28 3.54 0.11 -1.86 -3.36 132.00 131.38 1bbo h PRO 29 Ca 0.13 0.00 -0.70 0.00 0.11 0.00 0.00 66.00 65.54 1bbo h PRO 29 Cb 0.91 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 31.88 1bbo h PRO 29 CO 0.42 0.00 1.61 0.71 -0.21 0.00 0.00 178.00 180.53 1bbo s TYR 30 N -4.22 3.13 0.04 0.65 2.02 -1.12 -4.97 117.35 112.89 1bbo s TYR 30 Ca -0.05 -1.78 -0.12 0.00 -0.37 0.00 0.00 57.07 54.75 1bbo s TYR 30 Cb 0.13 -4.50 -0.06 0.00 -0.40 0.00 0.00 41.96 37.13 1bbo s TYR 30 CO 0.42 -1.59 0.40 -1.01 -1.57 0.00 0.00 175.55 172.19 1bbo s HIS 31 N 2.89 3.65 0.29 2.71 3.76 -1.26 -1.12 115.29 126.22 1bbo s HIS 31 Ca 0.46 0.88 -0.29 0.00 -0.15 0.00 0.00 55.06 55.96 1bbo s HIS 31 Cb -0.00 -2.22 -0.10 0.00 1.11 0.00 0.00 32.58 31.37 1bbo s HIS 31 CO 0.01 0.58 1.39 0.00 -0.85 0.00 0.00 174.74 175.87 1bbo n THR 33 N 1.58 1.03 0.00 0.00 -1.04 -1.26 -4.01 114.28 110.57 1bbo n THR 33 Ca 0.04 0.26 0.00 0.00 -2.04 0.00 0.00 64.05 62.30 1bbo n THR 33 Cb 0.41 -1.14 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 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 -1.34 0.00 0.00 -1.42 4.02 -1.26 -5.08 117.16 112.08 1bbo n TYR 34 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 1bbo n TYR 34 Cb 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.38 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 -2.65 1.55 -4.88 0.00 5.15 -1.26 -4.55 115.26 108.62 1bbo n ASN 36 Ca 0.00 -1.33 -0.30 0.00 -0.60 0.00 0.00 54.58 52.35 1bbo n ASN 36 Cb 0.00 -0.02 0.01 0.00 -0.53 0.00 0.00 39.78 39.24 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 -0.48 3.58 0.26 1.20 5.36 -1.26 -4.89 117.98 121.75 1bbo s PHE 37 Ca 0.06 1.15 -0.11 0.00 -0.96 0.00 0.00 56.93 57.08 1bbo s PHE 37 Cb 0.04 -2.66 -0.01 0.00 -0.34 0.00 0.00 43.02 40.05 1bbo s PHE 37 CO 0.06 -0.65 0.46 0.45 -1.46 0.00 0.00 175.22 174.07 1bbo s SER 38 N -4.18 0.06 0.08 6.13 0.15 -1.26 -1.94 113.70 112.73 1bbo s SER 38 Ca 0.54 -1.05 0.02 0.00 0.70 0.00 0.00 55.95 56.16 1bbo s SER 38 Cb -0.11 0.59 -0.03 0.00 -1.71 0.00 0.00 66.02 64.75 1bbo s SER 38 CO 0.52 -1.15 -0.08 -0.36 1.20 0.00 0.00 173.24 173.37 1bbo s PHE 39 N -3.86 0.86 -0.37 3.44 0.40 -0.27 -4.98 117.98 113.19 1bbo s PHE 39 Ca 0.25 -0.70 0.21 0.00 -0.60 0.00 0.00 56.93 56.09 1bbo s PHE 39 Cb -0.00 -0.49 0.27 0.00 0.51 0.00 0.00 43.02 43.31 1bbo s PHE 39 CO 0.11 -0.09 1.57 -0.22 0.70 0.00 0.00 175.22 177.29 1bbo h LYS 40 N 3.66 0.00 -6.37 0.44 1.63 -1.88 -2.96 116.57 111.09 1bbo h LYS 40 Ca -0.36 0.00 -0.61 0.00 -0.85 0.00 0.00 60.65 58.83 1bbo h LYS 40 Cb 1.18 0.00 -0.14 0.00 -0.60 0.00 0.00 32.23 32.68 1bbo h LYS 40 CO 0.53 0.11 -0.73 0.95 -3.45 0.00 0.00 179.45 176.86 1bbo s THR 41 N -3.15 2.95 -0.43 1.00 -4.23 -1.26 -4.83 115.64 105.69 1bbo s THR 41 Ca 0.06 -1.95 0.24 0.00 -1.18 0.00 0.00 61.69 58.87 1bbo s THR 41 Cb 0.06 -2.50 0.34 0.00 1.34 0.00 0.00 72.50 71.73 1bbo s THR 41 CO 0.69 -0.23 1.67 0.50 -0.54 0.00 0.00 174.62 176.70 1bbo h LYS 42 N 2.59 0.00 0.81 3.99 3.64 -1.98 -3.32 116.57 122.30 1bbo h LYS 42 Ca -0.45 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.89 1bbo h LYS 42 Cb 1.23 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.06 1bbo h LYS 42 CO 0.56 0.00 -0.39 0.78 -2.27 0.00 0.00 179.45 178.13 1bbo h GLY 43 N 3.85 -1.13 -0.05 5.01 0.00 -1.99 -2.69 103.07 106.07 1bbo h GLY 43 Ca 0.00 0.42 0.23 0.00 0.00 0.00 0.00 47.33 47.98 1bbo h GLY 43 CO 0.00 -0.41 0.61 3.43 0.00 0.00 0.00 176.54 180.17 1bbo h ASN 44 N -1.18 0.68 0.30 0.19 4.21 -2.00 -1.06 115.58 116.71 1bbo h ASN 44 Ca -0.11 0.11 0.00 0.00 1.21 0.00 0.00 56.30 57.52 1bbo h ASN 44 Cb 0.84 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 38.01 1bbo h ASN 44 CO 0.18 0.16 -0.48 0.25 -1.29 0.00 0.00 177.43 176.25 1bbo h LEU 45 N 0.61 -1.39 -1.80 1.61 7.12 -1.59 0.18 115.31 120.05 1bbo h LEU 45 Ca 0.61 0.13 0.29 0.00 0.13 0.00 0.00 57.88 59.05 1bbo h LEU 45 Cb 1.16 0.49 -0.06 0.00 -0.53 0.00 0.00 40.66 41.72 1bbo h LEU 45 CO -0.42 -0.59 0.73 0.74 -0.13 0.00 0.00 178.44 178.78 1bbo h THR 46 N -0.84 0.50 -0.01 1.05 2.02 -0.89 0.04 112.91 114.77 1bbo h THR 46 Ca -0.02 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1bbo h THR 46 Cb 0.79 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1bbo h THR 46 CO -0.17 0.02 -0.07 0.11 0.37 0.00 0.00 175.52 175.79 1bbo h LYS 47 N 0.13 0.07 0.00 6.66 1.57 -0.49 -1.36 116.57 123.15 1bbo h LYS 47 Ca 0.53 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 1bbo h LYS 47 Cb 1.84 0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.16 1bbo h LYS 47 CO -0.09 0.72 0.00 1.25 -0.57 0.00 0.00 179.45 180.76 1bbo h HIS 48 N -0.57 0.00 0.09 -1.35 2.76 0.11 -2.27 115.15 113.92 1bbo h HIS 48 Ca -0.00 0.00 -0.37 0.00 -2.20 0.00 0.00 60.37 57.79 1bbo h HIS 48 Cb 0.73 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.66 1bbo h HIS 48 CO 0.16 0.00 -2.14 -1.33 -1.30 0.00 0.00 177.93 173.32 1bbo n MET 49 N -2.31 0.72 -0.29 5.26 2.81 -0.60 -4.25 117.12 118.46 1bbo n MET 49 Ca -0.01 0.23 0.11 0.00 -1.81 0.00 0.00 57.70 56.22 1bbo n MET 49 Cb 0.07 -1.65 0.27 0.00 -0.71 0.00 0.00 33.22 31.20 1bbo n MET 49 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1bbo h LYS 50 N 0.03 0.40 -6.70 0.03 3.64 -0.63 -3.42 116.57 109.92 1bbo h LYS 50 Ca -0.47 -0.02 -0.56 0.00 -1.27 0.00 0.00 60.65 58.33 1bbo h LYS 50 Cb 1.98 -0.09 0.19 0.00 -0.41 0.00 0.00 32.23 33.90 1bbo h LYS 50 CO 0.03 0.27 -0.37 0.45 -2.27 0.00 0.00 179.45 177.55 1bbo n SER 51 N -5.03 -1.16 0.00 4.20 2.88 -1.19 -4.75 113.62 108.56 1bbo n SER 51 Ca 0.20 0.56 0.01 0.00 -1.33 0.00 0.00 58.87 58.31 1bbo n SER 51 Cb 0.58 -1.23 0.06 0.00 -0.75 0.00 0.00 64.21 62.87 1bbo n SER 51 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1bbo n LYS 52 N -0.99 0.43 0.00 -1.46 5.02 -1.26 -4.34 118.16 115.55 1bbo n LYS 52 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1bbo n LYS 52 Cb 0.50 -1.08 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 1bbo n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bbo n ALA 53 N -0.58 0.00 -3.30 7.82 0.00 -1.26 -4.72 120.51 118.47 1bbo n ALA 53 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.29 1bbo n ALA 53 Cb 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.39 1bbo n ALA 53 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1bbo s HIS 54 N 0.00 -0.25 0.00 0.00 -3.43 -1.26 -4.94 115.29 105.41 1bbo s HIS 54 Ca 0.00 -1.02 0.00 0.00 -0.80 0.00 0.00 55.06 53.24 1bbo s HIS 54 Cb 0.00 -0.39 0.00 0.00 -1.43 0.00 0.00 32.58 30.76 1bbo s HIS 54 CO 0.00 -0.99 0.00 -1.13 -2.00 0.00 0.00 174.74 170.62 1bbo n SER 55 N 3.86 0.00 -1.94 7.38 3.41 -1.26 -4.92 113.62 120.16 1bbo n SER 55 Ca 0.15 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.54 1bbo n SER 55 Cb 0.47 0.07 0.13 0.00 -0.26 0.00 0.00 64.21 64.62 1bbo n SER 55 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1bbo n LYS 56 N -1.67 2.47 0.00 4.33 5.02 -1.26 -5.15 118.16 121.89 1bbo n LYS 56 Ca 0.00 -3.32 0.00 0.00 -2.02 0.00 0.00 58.31 52.97 1bbo n LYS 56 Cb 0.00 -2.13 0.00 0.00 -0.02 0.00 0.00 35.03 32.88 1bbo n LYS 56 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05