#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gab n ILE 2 N 0.00 0.00 -0.12 1.09 0.13 -1.26 -4.69 119.36 114.51 1gab n ILE 2 Ca 0.00 0.00 0.02 0.00 -1.10 0.00 0.00 62.75 61.67 1gab n ILE 2 Cb 0.00 -0.22 0.22 0.00 -0.84 0.00 0.00 39.64 38.80 1gab n ILE 2 CO 0.00 0.00 0.00 0.47 2.80 0.00 0.00 176.55 179.82 1gab n ASP 3 N -1.91 3.72 -4.21 9.51 8.00 -1.26 -4.61 116.55 125.78 1gab n ASP 3 Ca 0.05 -2.58 -0.44 0.00 0.71 0.00 0.00 54.79 52.53 1gab n ASP 3 Cb 0.48 -0.62 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 1gab n ASP 3 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gab n GLN 4 N 0.27 3.83 -0.09 -1.24 6.02 -1.26 -4.73 117.38 120.18 1gab n GLN 4 Ca 0.18 -4.50 -0.18 0.00 -0.01 0.00 0.00 57.00 52.50 1gab n GLN 4 Cb 0.84 -2.53 -0.13 0.00 1.02 0.00 0.00 30.24 29.44 1gab n GLN 4 CO 0.00 0.00 0.00 -2.67 -1.01 0.00 0.00 177.06 173.38 1gab n TRP 5 N 2.19 0.34 -2.64 1.08 4.27 -1.26 -5.06 117.44 116.36 1gab n TRP 5 Ca 0.25 0.08 -0.03 0.00 -3.89 0.00 0.00 57.50 53.91 1gab n TRP 5 Cb 0.37 -1.05 0.00 0.00 -1.36 0.00 0.00 31.31 29.28 1gab n TRP 5 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1gab n LEU 6 N -3.25 -7.46 -2.09 5.67 4.32 -1.26 -4.80 117.00 108.13 1gab n LEU 6 Ca -0.40 1.02 -0.16 0.00 -0.02 0.00 0.00 56.01 56.45 1gab n LEU 6 Cb 1.02 -3.16 -0.08 0.00 -1.62 0.00 0.00 43.42 39.59 1gab n LEU 6 CO 0.33 -2.66 1.46 -0.11 -1.22 0.00 0.00 177.39 175.19 1gab n LEU 7 N 0.30 5.87 0.03 2.23 7.94 -1.26 -4.15 117.00 127.96 1gab n LEU 7 Ca 0.04 -3.40 0.11 0.00 -1.11 0.00 0.00 56.01 51.65 1gab n LEU 7 Cb 0.15 -1.26 -0.00 0.00 0.53 0.00 0.00 43.42 42.83 1gab n LEU 7 CO 0.42 1.55 -0.07 0.29 -1.11 0.00 0.00 177.39 178.47 1gab n LYS 8 N 1.47 0.32 0.00 1.96 4.01 -1.26 -4.28 118.16 120.38 1gab n LYS 8 Ca 0.37 -0.01 0.00 0.00 -0.51 0.00 0.00 58.31 58.16 1gab n LYS 8 Cb 0.68 -1.59 0.00 0.00 -0.51 0.00 0.00 35.03 33.61 1gab n LYS 8 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1gab n ASN 9 N -2.00 0.00 0.00 4.39 2.04 -1.26 -1.15 115.26 117.28 1gab n ASN 9 Ca 0.01 0.00 0.08 0.00 -0.44 0.00 0.00 54.58 54.23 1gab n ASN 9 Cb 0.45 0.00 0.46 0.00 -2.53 0.00 0.00 39.78 38.15 1gab n ASN 9 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1gab n ALA 10 N -2.70 2.08 -0.41 -2.53 0.00 -1.26 -4.13 120.51 111.56 1gab n ALA 10 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1gab n ALA 10 Cb 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1gab n ALA 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1gab n LYS 11 N -0.99 0.00 0.00 0.00 0.00 -0.30 -1.16 118.16 115.72 1gab n LYS 11 Ca 0.12 0.68 0.12 0.00 0.00 0.00 0.00 58.31 59.22 1gab n LYS 11 Cb 0.05 -1.30 0.60 0.00 0.00 0.00 0.00 35.03 34.38 1gab n LYS 11 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1gab n GLU 12 N -2.00 0.33 -0.06 1.64 1.02 -1.25 -2.58 120.64 117.73 1gab n GLU 12 Ca 0.00 0.06 -0.13 0.00 -0.02 0.00 0.00 57.16 57.07 1gab n GLU 12 Cb 0.00 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 29.86 1gab n GLU 12 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1gab h ASP 13 N 0.00 0.52 0.56 1.62 3.58 -1.31 -2.26 116.42 119.13 1gab h ASP 13 Ca 0.00 -0.50 -0.28 0.00 0.42 0.00 0.00 57.03 56.66 1gab h ASP 13 Cb 0.23 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.09 1gab h ASP 13 CO 0.00 0.92 -1.56 0.00 -2.88 0.00 0.00 179.24 175.72 1gab h ALA 14 N 0.61 0.59 0.00 -0.78 0.00 -1.29 -3.30 119.26 115.09 1gab h ALA 14 Ca 0.02 -1.30 -0.02 0.00 0.00 0.00 0.00 54.91 53.61 1gab h ALA 14 Cb 0.80 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1gab h ALA 14 CO 0.06 1.43 -0.11 0.82 0.00 0.00 0.00 179.25 181.45 1gab h ILE 15 N 0.02 0.96 0.00 0.00 2.04 -1.55 -1.21 117.51 117.77 1gab h ILE 15 Ca -0.23 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1gab h ILE 15 Cb 1.97 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 39.26 1gab h ILE 15 CO 0.10 0.10 0.00 0.00 0.00 0.00 0.00 178.15 178.36 1gab n ALA 16 N -2.47 1.16 0.12 1.87 0.00 -0.85 -1.07 120.51 119.27 1gab n ALA 16 Ca -0.03 0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1gab n ALA 16 Cb 0.18 -1.11 -0.15 0.00 0.00 0.00 0.00 19.45 18.37 1gab n ALA 16 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1gab n GLU 17 N -1.65 0.59 -0.08 0.00 2.13 -0.46 -4.25 120.64 116.92 1gab n GLU 17 Ca 0.01 -0.16 -0.11 0.00 0.66 0.00 0.00 57.16 57.55 1gab n GLU 17 Cb 0.05 -1.48 -0.05 0.00 0.27 0.00 0.00 31.44 30.22 1gab n GLU 17 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1gab n LEU 18 N -2.11 1.83 -0.23 4.31 7.99 -0.23 -2.93 117.00 125.62 1gab n LEU 18 Ca -0.03 0.56 0.31 0.00 -0.01 0.00 0.00 56.01 56.84 1gab n LEU 18 Cb 0.50 -0.91 0.73 0.00 -0.11 0.00 0.00 43.42 43.64 1gab n LEU 18 CO 0.43 -0.18 1.29 0.50 -1.51 0.00 0.00 177.39 177.91 1gab h LYS 19 N -1.00 0.00 0.00 3.23 3.64 -1.55 0.42 116.57 121.31 1gab h LYS 19 Ca -0.14 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 58.99 1gab h LYS 19 Cb 0.82 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.60 1gab h LYS 19 CO -0.08 0.00 -1.43 -0.22 -2.27 0.00 0.00 179.45 175.45 1gab h LYS 20 N 0.00 0.00 -0.19 1.90 3.64 -1.74 -3.32 116.57 116.85 1gab h LYS 20 Ca 0.48 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.75 1gab h LYS 20 Cb 1.97 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.77 1gab h LYS 20 CO -0.01 0.63 -0.33 0.00 -2.27 0.00 0.00 179.45 177.47 1gab h ALA 21 N 1.05 1.07 0.00 5.00 0.00 -0.09 -3.47 119.26 122.81 1gab h ALA 21 Ca -0.18 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1gab h ALA 21 Cb 1.89 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1gab h ALA 21 CO 0.09 0.58 0.00 0.41 0.00 0.00 0.00 179.25 180.33 1gab n GLY 22 N -0.25 3.87 3.53 0.00 0.00 -0.61 -5.09 105.19 106.63 1gab n GLY 22 Ca -0.01 -0.87 -0.49 0.00 0.00 0.00 0.00 46.02 44.65 1gab n GLY 22 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1gab n ILE 23 N 0.00 1.32 -2.16 -0.61 5.41 -1.25 -4.87 119.36 117.20 1gab n ILE 23 Ca 0.00 -0.33 0.03 0.00 1.00 0.00 0.00 62.75 63.45 1gab n ILE 23 Cb 0.00 -0.56 0.03 0.00 -0.71 0.00 0.00 39.64 38.40 1gab n ILE 23 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1gab n THR 24 N 0.83 0.23 -1.32 1.39 -2.24 -1.26 -4.27 114.28 107.63 1gab n THR 24 Ca 0.15 -0.78 -0.33 0.00 -2.27 0.00 0.00 64.05 60.83 1gab n THR 24 Cb 0.24 0.65 0.10 0.00 -2.10 0.00 0.00 70.33 69.22 1gab n THR 24 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1gab s SER 25 N -1.70 4.20 0.00 3.42 0.15 -1.26 -4.93 113.70 113.58 1gab s SER 25 Ca 0.20 2.14 0.23 0.00 0.70 0.00 0.00 55.95 59.22 1gab s SER 25 Cb 0.22 -2.56 0.17 0.00 -1.71 0.00 0.00 66.02 62.14 1gab s SER 25 CO -0.08 -2.25 1.19 0.47 1.20 0.00 0.00 173.24 173.77 1gab n ASP 26 N -3.11 1.32 0.18 5.45 8.00 -1.26 -3.95 116.55 123.19 1gab n ASP 26 Ca 0.12 -1.06 0.12 0.00 0.71 0.00 0.00 54.79 54.67 1gab n ASP 26 Cb 0.52 0.51 0.17 0.00 -0.02 0.00 0.00 41.12 42.30 1gab n ASP 26 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1gab h PHE 27 N 1.17 0.00 0.00 1.24 3.57 -1.97 0.74 116.94 121.69 1gab h PHE 27 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1gab h PHE 27 Cb 0.60 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1gab h PHE 27 CO 0.00 0.00 -1.01 0.66 -2.23 0.00 0.00 178.31 175.73 1gab n TYR 28 N -2.91 0.05 -0.05 0.41 4.01 -1.25 -3.69 117.16 113.72 1gab n TYR 28 Ca 0.04 0.01 -0.11 0.00 -0.16 0.00 0.00 57.90 57.68 1gab n TYR 28 Cb 0.52 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 39.34 1gab n TYR 28 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1gab n PHE 29 N -1.66 0.00 -0.30 -0.72 3.72 -1.21 -4.14 117.46 113.14 1gab n PHE 29 Ca 0.03 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.38 1gab n PHE 29 Cb 0.37 -0.37 0.07 0.00 -0.94 0.00 0.00 39.48 38.61 1gab n PHE 29 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 1gab h ASN 30 N -0.37 1.06 0.11 4.37 -1.24 -1.08 -0.99 115.58 117.45 1gab h ASN 30 Ca -0.26 -0.13 0.00 0.00 0.71 0.00 0.00 56.30 56.62 1gab h ASN 30 Cb 1.23 -0.27 0.00 0.00 0.73 0.00 0.00 38.32 40.01 1gab h ASN 30 CO -0.16 0.89 -0.01 0.00 -1.29 0.00 0.00 177.43 176.86 1gab n ALA 31 N -2.40 2.65 0.01 1.57 0.00 -1.24 -3.80 120.51 117.30 1gab n ALA 31 Ca 0.08 -0.22 -0.08 0.00 0.00 0.00 0.00 53.44 53.23 1gab n ALA 31 Cb 0.13 -1.47 -0.06 0.00 0.00 0.00 0.00 19.45 18.05 1gab n ALA 31 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1gab h ILE 32 N 0.24 0.67 0.00 0.00 2.04 -1.33 -0.26 117.51 118.87 1gab h ILE 32 Ca 0.00 -1.27 0.00 0.00 1.00 0.00 0.00 64.86 64.59 1gab h ILE 32 Cb 0.11 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1gab h ILE 32 CO 0.00 0.20 0.00 -3.20 0.00 0.00 0.00 178.15 175.15 1gab n ASN 33 N -4.84 0.00 -0.01 1.72 4.05 -1.23 -1.98 115.26 112.96 1gab n ASN 33 Ca -0.06 0.16 0.08 0.00 0.45 0.00 0.00 54.58 55.21 1gab n ASN 33 Cb 0.22 -0.32 -0.14 0.00 1.23 0.00 0.00 39.78 40.77 1gab n ASN 33 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1gab n LYS 34 N -1.32 0.59 -0.99 1.20 5.02 -1.21 -4.62 118.16 116.83 1gab n LYS 34 Ca 0.06 -0.16 -0.37 0.00 -2.02 0.00 0.00 58.31 55.82 1gab n LYS 34 Cb 0.12 -1.43 0.04 0.00 -0.02 0.00 0.00 35.03 33.74 1gab n LYS 34 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1gab n ALA 35 N -2.16 -5.59 -0.89 7.82 0.00 -0.11 -4.87 120.51 114.70 1gab n ALA 35 Ca -0.05 -0.98 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1gab n ALA 35 Cb 0.51 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.95 1gab n ALA 35 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1gab n LYS 36 N 2.40 0.00 0.00 0.00 5.02 -1.26 -4.91 118.16 119.41 1gab n LYS 36 Ca -0.02 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1gab n LYS 36 Cb 0.64 -1.05 0.00 0.00 -0.02 0.00 0.00 35.03 34.60 1gab n LYS 36 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1gab n THR 37 N -0.90 0.00 0.00 -0.18 5.66 -1.26 -4.99 114.28 112.61 1gab n THR 37 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 1gab n THR 37 Cb 0.00 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 68.70 1gab n THR 37 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 1gab h VAL 38 N 0.00 0.99 -0.12 1.08 2.07 -1.95 -0.78 116.25 117.55 1gab h VAL 38 Ca 0.00 -1.44 0.03 0.00 0.82 0.00 0.00 66.70 66.12 1gab h VAL 38 Cb 0.00 1.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1gab h VAL 38 CO 0.00 0.29 0.26 1.05 0.02 0.00 0.00 177.57 179.19 1gab h GLU 39 N -0.90 0.00 0.06 1.57 4.11 -1.99 0.48 114.58 117.90 1gab h GLU 39 Ca -0.01 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.14 1gab h GLU 39 Cb 0.57 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1gab h GLU 39 CO 0.02 0.00 -1.45 1.49 0.07 0.00 0.00 179.01 179.14 1gab h GLU 40 N 0.00 0.12 0.68 1.06 4.57 -1.93 -2.38 114.58 116.70 1gab h GLU 40 Ca 0.06 -0.20 -0.03 0.00 -1.18 0.00 0.00 59.36 58.00 1gab h GLU 40 Cb 0.57 0.07 0.01 0.00 -0.16 0.00 0.00 28.75 29.24 1gab h GLU 40 CO -0.00 0.92 -0.33 0.28 -1.18 0.00 0.00 179.01 178.70 1gab h VAL 41 N 0.03 0.01 -0.56 0.32 2.07 0.14 0.15 116.25 118.41 1gab h VAL 41 Ca -0.20 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.03 1gab h VAL 41 Cb 1.95 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1gab h VAL 41 CO 0.13 0.00 0.37 0.78 0.02 0.00 0.00 177.57 178.87 1gab h ASN 42 N -1.24 0.55 0.86 0.57 2.35 -1.32 -0.25 115.58 117.09 1gab h ASN 42 Ca -0.09 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.56 1gab h ASN 42 Cb 0.70 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1gab h ASN 42 CO 0.15 0.37 -0.43 0.00 -1.65 0.00 0.00 177.43 175.88 1gab h ALA 43 N 1.68 0.96 -0.00 -0.83 0.00 -1.33 -2.82 119.26 116.91 1gab h ALA 43 Ca 0.23 -0.39 -0.17 0.00 0.00 0.00 0.00 54.91 54.58 1gab h ALA 43 Cb 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1gab h ALA 43 CO -0.06 0.53 -0.80 1.37 0.00 0.00 0.00 179.25 180.30 1gab h LEU 44 N 0.00 0.01 -1.83 0.00 8.10 0.10 -2.90 115.31 118.80 1gab h LEU 44 Ca -0.00 -0.01 -0.03 0.00 0.11 0.00 0.00 57.88 57.94 1gab h LEU 44 Cb 0.97 -0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 41.18 1gab h LEU 44 CO 0.06 0.80 -0.14 0.50 -4.11 0.00 0.00 178.44 175.54 1gab h LYS 45 N 0.01 0.00 0.00 0.17 1.63 -1.08 -1.05 116.57 116.25 1gab h LYS 45 Ca -0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1gab h LYS 45 Cb 1.41 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.04 1gab h LYS 45 CO 0.10 0.14 -0.01 -0.91 -3.45 0.00 0.00 179.45 175.32 1gab h ASN 46 N 0.00 0.00 0.65 4.20 4.21 -1.48 -3.10 115.58 120.05 1gab h ASN 46 Ca -0.00 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.50 1gab h ASN 46 Cb 0.34 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.54 1gab h ASN 46 CO 0.02 0.00 -0.11 -0.62 -1.29 0.00 0.00 177.43 175.43 1gab n GLU 47 N -2.43 0.29 -0.02 0.81 1.02 -0.40 -3.67 120.64 116.23 1gab n GLU 47 Ca 0.05 -0.07 -0.15 0.00 -0.02 0.00 0.00 57.16 56.97 1gab n GLU 47 Cb 0.45 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.27 1gab n GLU 47 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1gab h ILE 48 N 0.17 1.49 -1.00 -3.67 5.03 -1.57 0.12 117.51 118.08 1gab h ILE 48 Ca 0.00 -1.87 0.13 0.00 -0.12 0.00 0.00 64.86 63.00 1gab h ILE 48 Cb 0.42 2.59 -0.09 0.00 -3.03 0.00 0.00 36.82 36.70 1gab h ILE 48 CO 0.00 0.52 0.62 -0.07 -0.68 0.00 0.00 178.15 178.55 1gab h LEU 49 N -0.34 0.90 0.00 1.44 4.07 -1.75 -3.23 115.31 116.40 1gab h LEU 49 Ca -0.03 0.06 0.00 0.00 0.08 0.00 0.00 57.88 57.98 1gab h LEU 49 Cb 1.02 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 42.64 1gab h LEU 49 CO 0.06 0.46 0.00 1.17 -1.08 0.00 0.00 178.44 179.05 1gab n LYS 50 N -4.65 0.00 -0.71 1.13 0.00 -1.20 -4.49 118.16 108.24 1gab n LYS 50 Ca 0.19 0.34 -0.32 0.00 0.00 0.00 0.00 58.31 58.52 1gab n LYS 50 Cb 0.39 -0.83 0.15 0.00 0.00 0.00 0.00 35.03 34.74 1gab n LYS 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1gab n ALA 51 N -1.54 -2.07 -1.02 3.14 0.00 0.43 -1.60 120.51 117.85 1gab n ALA 51 Ca 0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 53.44 52.74 1gab n ALA 51 Cb 0.00 -1.95 -0.00 0.00 0.00 0.00 0.00 19.45 17.50 1gab n ALA 51 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1gab n HIS 52 N -4.03 0.00 -0.23 0.00 -0.00 -1.26 -4.59 115.22 105.11 1gab n HIS 52 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.80 1gab n HIS 52 Cb 0.54 -1.59 0.00 0.00 -0.00 0.00 0.00 29.99 28.94 1gab n HIS 52 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34