#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fra s ILE 2 N 0.00 4.61 -0.17 5.15 1.01 -1.26 -3.66 121.20 126.88 1fra s ILE 2 Ca 0.00 -0.10 -0.09 0.00 0.00 0.00 0.00 60.65 60.45 1fra s ILE 2 Cb 0.00 -3.74 0.06 0.00 0.01 0.00 0.00 42.46 38.79 1fra s ILE 2 CO 0.00 -0.64 0.41 0.00 0.00 0.00 0.00 174.94 174.72 1fra s PHE 4 N 1.41 2.70 -0.31 0.00 0.08 -1.26 -2.19 117.98 118.41 1fra s PHE 4 Ca -0.10 1.53 0.15 0.00 0.12 0.00 0.00 56.93 58.64 1fra s PHE 4 Cb -0.08 -3.36 0.47 0.00 -0.57 0.00 0.00 43.02 39.48 1fra s PHE 4 CO -0.13 -1.66 1.09 0.27 -0.10 0.00 0.00 175.22 174.69 1fra n ASN 5 N -1.03 2.87 -0.55 1.36 0.23 -0.69 -1.81 115.26 115.64 1fra n ASN 5 Ca 0.10 -2.89 0.00 0.00 -0.53 0.00 0.00 54.58 51.26 1fra n ASN 5 Cb 0.50 -0.46 0.00 0.00 -2.08 0.00 0.00 39.78 37.74 1fra n ASN 5 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1fra n HIS 6 N -0.47 -0.04 -3.80 -2.53 1.44 -1.26 -4.84 115.22 103.72 1fra n HIS 6 Ca 0.22 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.77 1fra n HIS 6 Cb 0.82 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.77 1fra n HIS 6 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1fra s GLN 7 N 0.24 0.04 3.15 -1.40 -1.52 -1.26 -3.98 119.66 114.94 1fra s GLN 7 Ca 0.00 0.18 0.00 0.00 -1.95 0.00 0.00 55.36 53.59 1fra s GLN 7 Cb 0.00 -0.33 0.00 0.00 -0.22 0.00 0.00 33.01 32.46 1fra s GLN 7 CO 0.00 -0.17 0.00 0.45 -0.25 0.00 0.00 175.29 175.32 1fra n SER 8 N 4.27 -0.43 -4.55 5.90 2.88 -1.22 -4.32 113.62 116.14 1fra n SER 8 Ca -0.26 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 56.86 1fra n SER 8 Cb 0.50 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.89 1fra n SER 8 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1fra s SER 9 N -4.00 6.38 -0.06 -3.46 1.04 -1.26 -5.00 113.70 107.33 1fra s SER 9 Ca 0.00 -0.06 -0.29 0.00 0.48 0.00 0.00 55.95 56.08 1fra s SER 9 Cb 0.00 -2.32 0.11 0.00 0.10 0.00 0.00 66.02 63.91 1fra s SER 9 CO 0.00 -0.66 0.89 0.00 0.98 0.00 0.00 173.24 174.46 1fra s GLN 10 N 2.73 0.78 -0.75 4.02 1.03 -1.26 -5.05 119.66 121.16 1fra s GLN 10 Ca 0.23 -0.07 -0.07 0.00 0.04 0.00 0.00 55.36 55.49 1fra s GLN 10 Cb -0.14 0.36 -0.25 0.00 0.03 0.00 0.00 33.01 33.01 1fra s GLN 10 CO 0.16 -0.30 1.79 -2.30 -2.54 0.00 0.00 175.29 172.10 1fra n PRO 11 N 0.25 0.00 -1.56 9.60 -0.02 -1.26 -4.72 135.00 137.30 1fra n PRO 11 Ca -0.11 0.00 -0.49 0.00 -2.02 0.00 0.00 63.50 60.88 1fra n PRO 11 Cb 0.60 -0.93 -0.04 0.00 -0.02 0.00 0.00 33.50 33.11 1fra n PRO 11 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fra n GLN 12 N 4.93 0.96 -4.43 -0.52 10.64 -1.26 -5.00 117.38 122.70 1fra n GLN 12 Ca 0.51 0.34 -0.22 0.00 -1.83 0.00 0.00 57.00 55.80 1fra n GLN 12 Cb 0.20 -1.79 -0.10 0.00 -0.86 0.00 0.00 30.24 27.69 1fra n GLN 12 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 1fra s THR 13 N -0.30 1.95 0.31 -0.39 -4.23 -1.26 -5.05 115.64 106.67 1fra s THR 13 Ca 0.73 -2.23 -0.02 0.00 -1.18 0.00 0.00 61.69 58.99 1fra s THR 13 Cb -0.89 -2.32 0.01 0.00 1.34 0.00 0.00 72.50 70.64 1fra s THR 13 CO 0.53 -0.40 0.44 0.35 -0.54 0.00 0.00 174.62 175.01 1fra n THR 14 N -0.56 0.00 -3.79 3.99 -2.24 -1.26 -1.71 114.28 108.71 1fra n THR 14 Ca -0.06 -1.55 -0.13 0.00 -2.27 0.00 0.00 64.05 60.04 1fra n THR 14 Cb 0.62 0.97 -0.14 0.00 -2.10 0.00 0.00 70.33 69.68 1fra n THR 14 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1fra s LYS 15 N -2.68 0.10 0.00 -0.78 1.02 -0.93 -4.87 119.74 111.61 1fra s LYS 15 Ca 0.25 0.26 0.00 0.00 0.02 0.00 0.00 55.97 56.50 1fra s LYS 15 Cb -0.01 -0.07 0.00 0.00 -0.52 0.00 0.00 37.83 37.23 1fra s LYS 15 CO 0.18 -0.10 0.56 -2.37 -0.92 0.00 0.00 175.35 172.70 1fra n THR 16 N 3.65 0.39 -1.73 2.17 5.66 -1.26 -2.21 114.28 120.95 1fra n THR 16 Ca -0.20 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.80 1fra n THR 16 Cb 0.55 -0.63 0.00 0.00 -1.55 0.00 0.00 70.33 68.70 1fra n THR 16 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1fra s SER 18 N -2.36 2.90 0.73 0.00 0.01 -1.26 -4.94 113.70 108.78 1fra s SER 18 Ca 0.00 1.16 -0.16 0.00 1.31 0.00 0.00 55.95 58.27 1fra s SER 18 Cb 0.00 -1.82 0.02 0.00 0.21 0.00 0.00 66.02 64.44 1fra s SER 18 CO 0.00 -2.96 1.09 -2.65 0.41 0.00 0.00 173.24 169.13 1fra n PRO 19 N -4.06 0.53 0.00 12.44 -0.02 -1.26 -2.66 135.00 139.97 1fra n PRO 19 Ca 0.06 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1fra n PRO 19 Cb 0.57 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1fra n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fra n GLY 20 N 0.92 1.93 3.70 -1.23 0.00 -1.26 -4.96 105.19 104.29 1fra n GLY 20 Ca 0.14 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 1fra n GLY 20 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fra n GLU 21 N 0.00 2.37 -0.55 1.61 4.71 -1.09 -4.86 120.64 122.83 1fra n GLU 21 Ca 0.00 0.84 0.00 0.00 -0.01 0.00 0.00 57.16 58.00 1fra n GLU 21 Cb 0.00 -2.57 0.00 0.00 -1.01 0.00 0.00 31.44 27.86 1fra n GLU 21 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1fra n SER 22 N 2.35 0.04 -3.79 1.62 3.41 -1.26 -4.87 113.62 111.12 1fra n SER 22 Ca 0.11 -1.96 -0.10 0.00 -0.26 0.00 0.00 58.87 56.66 1fra n SER 22 Cb 0.34 -0.20 -0.05 0.00 -0.26 0.00 0.00 64.21 64.04 1fra n SER 22 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1fra s SER 23 N -1.01 -0.17 0.10 4.04 0.15 -1.26 -4.74 113.70 110.81 1fra s SER 23 Ca 0.02 -0.57 0.09 0.00 0.70 0.00 0.00 55.95 56.19 1fra s SER 23 Cb 0.02 0.53 -0.04 0.00 -1.71 0.00 0.00 66.02 64.82 1fra s SER 23 CO -0.01 -0.98 -0.18 0.00 1.20 0.00 0.00 173.24 173.27 1fra s TYR 25 N -1.10 1.96 -0.23 0.00 -0.85 0.73 -2.03 117.35 115.84 1fra s TYR 25 Ca 0.17 -0.39 0.01 0.00 -0.52 0.00 0.00 57.07 56.34 1fra s TYR 25 Cb -0.11 -1.16 0.06 0.00 0.38 0.00 0.00 41.96 41.13 1fra s TYR 25 CO 0.09 0.12 -0.06 -1.58 -1.52 0.00 0.00 175.55 172.60 1fra s HIS 26 N -0.83 2.35 -0.28 -3.49 2.46 0.74 -2.28 115.29 113.96 1fra s HIS 26 Ca 0.09 -1.70 -0.12 0.00 0.47 0.00 0.00 55.06 53.79 1fra s HIS 26 Cb -0.09 -1.56 -0.05 0.00 -0.13 0.00 0.00 32.58 30.75 1fra s HIS 26 CO 0.02 -0.76 0.24 0.21 -2.47 0.00 0.00 174.74 171.97 1fra s LYS 27 N 1.41 3.96 -0.04 2.88 2.20 -0.38 -1.55 119.74 128.22 1fra s LYS 27 Ca -0.05 -0.23 0.02 0.00 -0.36 0.00 0.00 55.97 55.34 1fra s LYS 27 Cb -0.18 -3.66 0.01 0.00 -1.51 0.00 0.00 37.83 32.49 1fra s LYS 27 CO -0.06 -0.21 -0.08 -1.14 -0.36 0.00 0.00 175.35 173.50 1fra s GLN 28 N 1.84 1.07 -0.16 4.03 0.74 -1.01 0.11 119.66 126.27 1fra s GLN 28 Ca 0.09 -0.25 -0.29 0.00 0.05 0.00 0.00 55.36 54.95 1fra s GLN 28 Cb -0.16 -0.98 0.12 0.00 1.10 0.00 0.00 33.01 33.09 1fra s GLN 28 CO 0.11 0.02 0.95 1.67 -0.55 0.00 0.00 175.29 177.48 1fra s TRP 29 N 0.56 -0.44 0.37 1.67 -2.14 0.19 -2.31 118.94 116.84 1fra s TRP 29 Ca -0.09 0.83 -0.23 0.00 2.66 0.00 0.00 56.10 59.27 1fra s TRP 29 Cb -0.12 0.43 -0.10 0.00 -3.10 0.00 0.00 33.47 30.57 1fra s TRP 29 CO 0.01 -0.37 0.92 0.45 -2.66 0.00 0.00 176.95 175.31 1fra s SER 30 N -0.87 7.09 0.38 -2.66 0.15 -1.26 -0.03 113.70 116.51 1fra s SER 30 Ca -0.02 1.71 -0.08 0.00 0.70 0.00 0.00 55.95 58.25 1fra s SER 30 Cb -0.01 -2.54 0.03 0.00 -1.71 0.00 0.00 66.02 61.79 1fra s SER 30 CO 0.02 -0.22 0.65 -0.62 1.20 0.00 0.00 173.24 174.27 1fra s ASP 31 N -1.94 0.57 0.58 5.45 2.15 -0.43 -4.88 116.67 118.17 1fra s ASP 31 Ca 0.56 -1.39 0.28 0.00 0.43 0.00 0.00 52.55 52.43 1fra s ASP 31 Cb -0.13 0.78 1.52 0.00 -0.30 0.00 0.00 42.92 44.78 1fra s ASP 31 CO 0.18 -1.54 1.96 2.19 -0.17 0.00 0.00 175.17 177.78 1fra h PHE 32 N 2.03 0.00 0.00 -5.34 -0.00 -2.04 0.36 116.94 111.95 1fra h PHE 32 Ca -0.31 0.00 -0.20 0.00 -0.00 0.00 0.00 57.97 57.46 1fra h PHE 32 Cb 1.24 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 37.17 1fra h PHE 32 CO 1.59 0.00 -0.94 0.00 -0.00 0.00 0.00 178.31 178.96 1fra h ARG 33 N 0.00 0.00 0.00 6.09 3.08 -1.98 -3.50 114.38 118.06 1fra h ARG 33 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1fra h ARG 33 Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1fra h ARG 33 CO -0.00 0.94 0.00 0.41 -1.07 0.00 0.00 179.97 180.25 1fra n GLY 34 N 1.33 0.59 3.55 0.04 0.00 0.13 -4.96 105.19 105.88 1fra n GLY 34 Ca 0.00 -2.02 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 1fra n GLY 34 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fra s THR 35 N -1.33 3.26 -0.02 2.61 2.01 -1.26 -1.32 115.64 119.59 1fra s THR 35 Ca 0.00 -0.02 -0.28 0.00 0.31 0.00 0.00 61.69 61.71 1fra s THR 35 Cb 0.00 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.83 1fra s THR 35 CO 0.00 -0.62 0.88 -0.63 -0.69 0.00 0.00 174.62 173.55 1fra s ILE 36 N 10.74 4.93 -0.30 1.82 1.01 0.96 -4.88 121.20 135.48 1fra s ILE 36 Ca 0.77 1.83 0.02 0.00 0.00 0.00 0.00 60.65 63.27 1fra s ILE 36 Cb -0.12 -4.22 0.09 0.00 0.01 0.00 0.00 42.46 38.22 1fra s ILE 36 CO 0.14 0.20 0.04 -0.63 0.00 0.00 0.00 174.94 174.69 1fra s ILE 37 N 0.90 1.66 0.51 2.92 1.01 -1.26 -0.63 121.20 126.32 1fra s ILE 37 Ca 0.47 -1.76 -0.00 0.00 0.00 0.00 0.00 60.65 59.35 1fra s ILE 37 Cb -0.20 -2.15 0.01 0.00 0.01 0.00 0.00 42.46 40.14 1fra s ILE 37 CO 0.24 -0.49 0.75 -0.70 0.00 0.00 0.00 174.94 174.74 1fra s GLU 38 N 1.25 2.82 0.23 2.79 2.12 0.30 -3.43 118.70 124.77 1fra s GLU 38 Ca 0.06 -0.54 -0.22 0.00 0.36 0.00 0.00 54.97 54.63 1fra s GLU 38 Cb -0.18 -2.49 0.04 0.00 0.26 0.00 0.00 34.13 31.76 1fra s GLU 38 CO -0.13 -0.52 0.77 -0.98 -0.54 0.00 0.00 175.26 173.87 1fra s ARG 39 N -4.70 1.57 0.00 4.30 1.70 -1.26 -1.26 118.95 119.30 1fra s ARG 39 Ca 0.53 -0.84 0.00 0.00 -0.47 0.00 0.00 55.73 54.94 1fra s ARG 39 Cb -0.10 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 34.83 1fra s ARG 39 CO 0.39 -0.72 0.00 0.41 -1.08 0.00 0.00 175.30 174.30 1fra n GLY 40 N -0.45 -0.52 3.91 3.88 0.00 -0.75 -4.58 105.19 106.68 1fra n GLY 40 Ca -0.06 -1.55 -0.25 0.00 0.00 0.00 0.00 46.02 44.16 1fra n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fra n GLY 42 N -0.70 -0.66 2.77 0.00 0.00 -1.16 -4.80 105.19 100.63 1fra n GLY 42 Ca -0.08 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 1fra n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fra n PRO 44 N 6.50 -0.12 -2.75 0.00 -0.04 -1.26 -5.09 135.00 132.25 1fra n PRO 44 Ca 0.52 -0.45 -0.20 0.00 -0.04 0.00 0.00 63.50 63.34 1fra n PRO 44 Cb 0.03 -0.25 0.04 0.00 -0.04 0.00 0.00 33.50 33.28 1fra n PRO 44 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1fra s THR 45 N -1.36 2.66 0.00 0.52 -1.32 -1.26 -5.12 115.64 109.77 1fra s THR 45 Ca 0.15 -0.76 0.00 0.00 -1.21 0.00 0.00 61.69 59.87 1fra s THR 45 Cb -0.00 -2.90 0.00 0.00 -1.51 0.00 0.00 72.50 68.08 1fra s THR 45 CO 0.10 0.00 0.00 1.33 -2.21 0.00 0.00 174.62 173.84 1fra n VAL 46 N -2.26 0.00 -4.21 5.08 0.24 -1.26 -5.15 118.33 110.76 1fra n VAL 46 Ca 0.09 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.10 1fra n VAL 46 Cb 0.60 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.87 1fra n VAL 46 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1fra s LYS 47 N -1.70 2.19 -0.19 7.34 1.02 -1.26 -5.05 119.74 122.09 1fra s LYS 47 Ca 0.00 -1.02 -0.35 0.00 0.02 0.00 0.00 55.97 54.61 1fra s LYS 47 Cb 0.00 -2.33 -0.12 0.00 -0.52 0.00 0.00 37.83 34.86 1fra s LYS 47 CO 0.00 0.50 1.94 -2.30 -0.92 0.00 0.00 175.35 174.57 1fra n PRO 48 N 0.58 1.74 0.00 -1.68 -0.01 -1.26 -2.04 135.00 132.33 1fra n PRO 48 Ca -0.13 0.61 0.00 0.00 -0.01 0.00 0.00 63.50 63.97 1fra n PRO 48 Cb 0.53 -2.54 0.00 0.00 -0.01 0.00 0.00 33.50 31.48 1fra n PRO 48 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1fra n GLY 49 N 4.89 3.87 3.77 -1.23 0.00 -1.26 -5.10 105.19 110.12 1fra n GLY 49 Ca 0.28 -0.98 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 1fra n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fra s ILE 50 N -0.00 3.55 -0.53 -0.61 1.01 -0.86 -4.98 121.20 118.77 1fra s ILE 50 Ca 0.00 1.44 -0.16 0.00 0.00 0.00 0.00 60.65 61.93 1fra s ILE 50 Cb 0.00 -3.87 0.12 0.00 0.01 0.00 0.00 42.46 38.72 1fra s ILE 50 CO 0.00 0.25 0.50 -0.54 0.00 0.00 0.00 174.94 175.15 1fra s LYS 51 N -1.78 3.00 -0.26 2.79 -0.14 -0.98 -4.89 119.74 117.48 1fra s LYS 51 Ca 0.49 -1.61 -0.12 0.00 -1.36 0.00 0.00 55.97 53.37 1fra s LYS 51 Cb -0.29 -4.27 -0.05 0.00 -1.68 0.00 0.00 37.83 31.55 1fra s LYS 51 CO 0.37 -1.30 0.22 -1.17 -0.76 0.00 0.00 175.35 172.71 1fra s LEU 52 N 1.72 4.07 0.19 3.17 2.96 -1.26 -2.40 118.68 127.13 1fra s LEU 52 Ca 0.04 0.13 0.10 0.00 -0.22 0.00 0.00 54.13 54.18 1fra s LEU 52 Cb -0.28 -2.19 -0.04 0.00 0.50 0.00 0.00 46.19 44.17 1fra s LEU 52 CO 0.04 -0.02 -0.19 -0.55 -1.32 0.00 0.00 176.35 174.31 1fra s SER 53 N 1.39 3.72 -0.07 3.68 0.15 -0.59 -4.97 113.70 117.01 1fra s SER 53 Ca 0.09 -0.76 -0.05 0.00 0.70 0.00 0.00 55.95 55.94 1fra s SER 53 Cb -0.15 -0.42 0.03 0.00 -1.71 0.00 0.00 66.02 63.77 1fra s SER 53 CO 0.08 0.12 0.17 0.00 1.20 0.00 0.00 173.24 174.81 1fra n GLU 56 N 3.08 3.32 -3.58 0.00 1.02 -1.26 -2.40 120.64 120.82 1fra n GLU 56 Ca -0.17 -3.50 -0.13 0.00 -0.02 0.00 0.00 57.16 53.34 1fra n GLU 56 Cb 0.54 -3.16 -0.06 0.00 -0.02 0.00 0.00 31.44 28.74 1fra n GLU 56 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1fra s SER 57 N 2.77 -0.55 0.55 1.62 0.15 -1.26 -5.02 113.70 111.96 1fra s SER 57 Ca 0.45 0.81 -0.20 0.00 0.70 0.00 0.00 55.95 57.72 1fra s SER 57 Cb 0.04 0.73 -0.07 0.00 -1.71 0.00 0.00 66.02 65.01 1fra s SER 57 CO 0.01 -0.36 0.87 -1.84 1.20 0.00 0.00 173.24 173.11 1fra n GLU 58 N 1.50 0.90 -1.92 5.44 0.28 -1.26 -3.90 120.64 121.67 1fra n GLU 58 Ca -0.14 0.34 0.00 0.00 -0.16 0.00 0.00 57.16 57.20 1fra n GLU 58 Cb 0.57 -2.02 0.00 0.00 1.43 0.00 0.00 31.44 31.41 1fra n GLU 58 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 1fra n VAL 59 N -1.45 -0.99 -1.52 3.84 0.24 -0.07 -4.87 118.33 113.51 1fra n VAL 59 Ca 0.12 0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.64 1fra n VAL 59 Cb 0.46 -1.59 0.00 0.00 -1.47 0.00 0.00 33.84 31.23 1fra n VAL 59 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fra n ASN 61 N 0.00 1.11 0.00 0.00 6.94 -1.26 -4.87 115.26 117.18 1fra n ASN 61 Ca 0.00 -1.05 0.00 0.00 -0.02 0.00 0.00 54.58 53.51 1fra n ASN 61 Cb 0.59 0.11 0.00 0.00 -2.36 0.00 0.00 39.78 38.12 1fra n ASN 61 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03