#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9s s SER 2 N 0.00 -0.53 -0.18 1.61 0.15 -1.26 -5.18 113.70 108.31 2d9s s SER 2 Ca 0.00 0.01 -0.30 0.00 0.70 0.00 0.00 55.95 56.36 2d9s s SER 2 Cb 0.00 0.58 0.13 0.00 -1.71 0.00 0.00 66.02 65.02 2d9s s SER 2 CO 0.00 -0.93 1.03 -0.94 1.20 0.00 0.00 173.24 173.60 2d9s s SER 3 N -2.65 -0.34 0.00 5.45 1.04 -1.26 -5.15 113.70 110.79 2d9s s SER 3 Ca 0.00 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.83 2d9s s SER 3 Cb -0.01 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.42 2d9s s SER 3 CO -0.11 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.41 2d9s n GLY 4 N 0.79 1.19 3.77 7.32 0.00 -1.26 -5.16 105.19 111.85 2d9s n GLY 4 Ca -0.09 0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 2d9s n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9s s SER 5 N 0.00 7.19 0.13 1.61 0.01 -1.26 -5.07 113.70 116.31 2d9s s SER 5 Ca 0.00 1.98 -0.25 0.00 1.31 0.00 0.00 55.95 58.99 2d9s s SER 5 Cb 0.00 -2.59 0.07 0.00 0.21 0.00 0.00 66.02 63.71 2d9s s SER 5 CO 0.00 -0.18 0.83 -0.94 0.41 0.00 0.00 173.24 173.36 2d9s s SER 6 N -1.43 -0.31 0.26 2.44 1.04 -1.26 -5.15 113.70 109.29 2d9s s SER 6 Ca 0.50 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.68 2d9s s SER 6 Cb -0.23 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.41 2d9s s SER 6 CO 0.29 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 174.21 2d9s n GLY 7 N -0.39 -0.37 3.58 7.32 0.00 -1.26 -4.71 105.19 109.36 2d9s n GLY 7 Ca -0.08 -1.06 -0.40 0.00 0.00 0.00 0.00 46.02 44.47 2d9s n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2d9s s GLN 8 N 0.00 3.81 0.40 1.61 -0.21 -1.26 -4.99 119.66 119.03 2d9s s GLN 8 Ca 0.00 -0.03 0.15 0.00 0.02 0.00 0.00 55.36 55.51 2d9s s GLN 8 Cb 0.00 -3.74 1.02 0.00 1.00 0.00 0.00 33.01 31.29 2d9s s GLN 8 CO 0.00 -0.48 1.86 1.25 -2.12 0.00 0.00 175.29 175.80 2d9s h LEU 9 N 8.88 0.46 -2.10 2.90 6.46 -2.03 -1.61 115.31 128.27 2d9s h LEU 9 Ca -0.29 0.04 0.05 0.00 -0.12 0.00 0.00 57.88 57.56 2d9s h LEU 9 Cb 1.14 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 41.02 2d9s h LEU 9 CO 0.72 0.20 0.32 0.28 -0.62 0.00 0.00 178.44 179.34 2d9s h SER 10 N 0.47 0.00 0.38 1.25 0.02 -1.99 0.58 113.55 114.26 2d9s h SER 10 Ca 0.46 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.27 2d9s h SER 10 Cb 1.04 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 2d9s h SER 10 CO -0.18 0.00 -0.59 0.28 -1.14 0.00 0.00 176.83 175.20 2d9s h SER 11 N 0.00 0.23 0.62 3.07 0.02 -1.72 -3.11 113.55 112.66 2d9s h SER 11 Ca 0.08 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.79 2d9s h SER 11 Cb 0.72 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 2d9s h SER 11 CO -0.00 0.76 -0.54 -0.33 -1.14 0.00 0.00 176.83 175.59 2d9s h GLU 12 N 0.15 0.00 -0.48 3.45 4.39 -1.04 -2.94 114.58 118.10 2d9s h GLU 12 Ca -0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.70 2d9s h GLU 12 Cb 1.07 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.70 2d9s h GLU 12 CO 0.09 0.54 0.32 0.82 -1.16 0.00 0.00 179.01 179.61 2d9s h ILE 13 N 0.00 1.12 -0.33 3.13 2.04 -1.53 -1.31 117.51 120.62 2d9s h ILE 13 Ca -0.01 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 2d9s h ILE 13 Cb 0.99 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 2d9s h ILE 13 CO 0.07 0.12 0.03 -0.33 0.00 0.00 0.00 178.15 178.03 2d9s h GLU 14 N 0.65 0.50 -0.04 2.37 4.39 -1.60 -1.27 114.58 119.57 2d9s h GLU 14 Ca 0.18 -0.09 -0.14 0.00 0.34 0.00 0.00 59.36 59.65 2d9s h GLU 14 Cb -0.07 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.49 2d9s h GLU 14 CO -0.04 0.50 -0.61 0.00 -1.16 0.00 0.00 179.01 177.70 2d9s h ARG 15 N 0.48 0.15 -0.27 2.33 3.08 -1.17 -3.00 114.38 115.97 2d9s h ARG 15 Ca 0.11 -0.10 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 2d9s h ARG 15 Cb 0.28 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 2d9s h ARG 15 CO 0.01 0.71 -0.55 -0.07 -1.07 0.00 0.00 179.97 178.99 2d9s h LEU 16 N 0.11 0.92 -1.54 3.04 3.38 -0.60 -3.15 115.31 117.45 2d9s h LEU 16 Ca -0.01 -0.49 0.10 0.00 0.09 0.00 0.00 57.88 57.57 2d9s h LEU 16 Cb 1.10 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 2d9s h LEU 16 CO 0.09 1.28 0.45 0.24 0.09 0.00 0.00 178.44 180.59 2d9s h MET 17 N 0.63 0.49 0.00 1.13 2.86 -1.12 -0.75 114.93 118.17 2d9s h MET 17 Ca 0.01 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2d9s h MET 17 Cb 1.15 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.70 2d9s h MET 17 CO 0.12 0.32 0.00 0.43 1.06 0.00 0.00 176.91 178.84 2d9s n SER 18 N -4.48 0.32 -0.83 1.22 7.64 -1.18 -2.50 113.62 113.81 2d9s n SER 18 Ca 0.11 0.58 0.12 0.00 1.01 0.00 0.00 58.87 60.70 2d9s n SER 18 Cb 0.38 -0.65 0.09 0.00 -1.01 0.00 0.00 64.21 63.02 2d9s n SER 18 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d9s n GLN 19 N -1.86 2.03 -0.02 1.43 6.02 -0.29 -4.96 117.38 119.72 2d9s n GLN 19 Ca 0.02 -1.66 0.00 0.00 -0.01 0.00 0.00 57.00 55.35 2d9s n GLN 19 Cb 0.18 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 29.97 2d9s n GLN 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2d9s n GLY 20 N 1.36 0.99 3.65 1.08 0.00 -1.04 -3.90 105.19 107.33 2d9s n GLY 20 Ca 0.13 -0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 2d9s n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2d9s s TYR 21 N -2.00 3.33 0.60 1.61 2.02 -1.22 -4.42 117.35 117.28 2d9s s TYR 21 Ca 0.00 0.43 -0.17 0.00 -0.37 0.00 0.00 57.07 56.96 2d9s s TYR 21 Cb 0.00 -2.44 -0.03 0.00 -0.40 0.00 0.00 41.96 39.09 2d9s s TYR 21 CO 0.00 -0.02 1.11 -1.12 -1.57 0.00 0.00 175.55 173.95 2d9s s SER 22 N 1.17 5.43 0.25 2.29 0.01 -1.26 -4.05 113.70 117.53 2d9s s SER 22 Ca 0.14 2.06 -0.03 0.00 1.31 0.00 0.00 55.95 59.42 2d9s s SER 22 Cb -0.15 -2.56 0.45 0.00 0.21 0.00 0.00 66.02 63.98 2d9s s SER 22 CO 0.07 -1.41 1.76 0.22 0.41 0.00 0.00 173.24 174.30 2d9s h TYR 23 N 0.57 0.69 0.46 2.43 3.20 -1.98 -1.27 116.97 121.07 2d9s h TYR 23 Ca -0.48 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.41 2d9s h TYR 23 Cb 1.25 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 2d9s h TYR 23 CO 0.54 0.19 -0.33 1.96 -1.64 0.00 0.00 178.16 178.87 2d9s h GLN 24 N 0.60 -0.74 -0.71 1.82 4.20 -2.00 -2.00 115.11 116.28 2d9s h GLN 24 Ca 0.42 0.05 0.07 0.00 0.06 0.00 0.00 58.65 59.25 2d9s h GLN 24 Cb 0.54 0.17 -0.06 0.00 0.30 0.00 0.00 27.48 28.43 2d9s h GLN 24 CO -0.33 -0.50 0.39 -0.44 -0.67 0.00 0.00 178.83 177.28 2d9s h ASP 25 N -0.77 0.55 -0.12 1.46 3.32 -1.82 0.08 116.42 119.13 2d9s h ASP 25 Ca -0.05 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.07 2d9s h ASP 25 Cb 0.65 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 2d9s h ASP 25 CO 0.01 0.34 -0.03 0.40 -1.72 0.00 0.00 179.24 178.24 2d9s h ILE 26 N 0.69 0.88 -0.68 0.35 2.04 -0.98 0.11 117.51 119.92 2d9s h ILE 26 Ca 0.33 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.13 2d9s h ILE 26 Cb 0.26 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2d9s h ILE 26 CO -0.22 0.00 0.20 1.56 0.00 0.00 0.00 178.15 179.70 2d9s h GLN 27 N -0.00 1.04 -0.58 2.37 1.08 -0.82 -1.35 115.11 116.85 2d9s h GLN 27 Ca 0.06 -0.22 -0.04 0.00 -1.45 0.00 0.00 58.65 57.00 2d9s h GLN 27 Cb 0.09 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 2d9s h GLN 27 CO -0.12 0.90 0.20 0.87 -0.95 0.00 0.00 178.83 179.72 2d9s h LYS 28 N 1.00 0.89 -0.58 1.46 1.57 -0.39 -1.02 116.57 119.51 2d9s h LYS 28 Ca 0.22 -0.18 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 2d9s h LYS 28 Cb 0.30 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 2d9s h LYS 28 CO -0.01 0.79 0.01 0.00 -0.57 0.00 0.00 179.45 179.68 2d9s h ALA 29 N 1.06 0.93 0.36 3.86 0.00 -0.52 -2.63 119.26 122.33 2d9s h ALA 29 Ca 0.19 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2d9s h ALA 29 Cb 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2d9s h ALA 29 CO -0.01 0.64 -0.17 -0.07 0.00 0.00 0.00 179.25 179.64 2d9s h LEU 30 N 0.91 -0.41 -0.29 0.00 3.38 -0.87 -1.16 115.31 116.87 2d9s h LEU 30 Ca 0.17 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.09 2d9s h LEU 30 Cb 0.51 0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 2d9s h LEU 30 CO 0.03 -0.15 0.06 1.62 0.09 0.00 0.00 178.44 180.09 2d9s h VAL 31 N -0.66 0.87 0.00 1.22 3.04 -1.20 0.13 116.25 119.64 2d9s h VAL 31 Ca -0.05 -0.06 -0.03 0.00 -1.01 0.00 0.00 66.70 65.55 2d9s h VAL 31 Cb 0.47 0.68 -0.00 0.00 -2.01 0.00 0.00 31.29 30.43 2d9s h VAL 31 CO 0.08 0.03 -0.15 0.40 -1.01 0.00 0.00 177.57 176.92 2d9s h ILE 32 N 0.17 1.04 -0.31 3.17 2.04 -1.48 -1.65 117.51 120.50 2d9s h ILE 32 Ca 0.13 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2d9s h ILE 32 Cb 0.14 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2d9s h ILE 32 CO -0.17 0.15 0.00 0.00 0.00 0.00 0.00 178.15 178.13 2d9s n ALA 33 N -2.48 2.80 -3.78 1.87 0.00 -0.44 -4.90 120.51 113.58 2d9s n ALA 33 Ca -0.02 -0.75 -0.27 0.00 0.00 0.00 0.00 53.44 52.39 2d9s n ALA 33 Cb 0.22 -1.02 0.05 0.00 0.00 0.00 0.00 19.45 18.70 2d9s n ALA 33 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2d9s n HIS 34 N 0.40 -2.46 -0.88 0.00 8.25 -0.62 -1.27 115.22 118.65 2d9s n HIS 34 Ca 0.12 0.94 0.00 0.00 -0.26 0.00 0.00 57.72 58.52 2d9s n HIS 34 Cb 0.49 -4.40 0.00 0.00 1.12 0.00 0.00 29.99 27.21 2d9s n HIS 34 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2d9s n ASN 35 N -2.92 -3.40 -4.55 0.41 3.02 0.33 -4.95 115.26 103.20 2d9s n ASN 35 Ca -0.01 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.15 2d9s n ASN 35 Cb 0.55 -2.38 -0.03 0.00 -0.61 0.00 0.00 39.78 37.32 2d9s n ASN 35 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2d9s s ASN 36 N -2.09 5.41 0.19 6.41 3.84 -0.39 -4.88 114.94 123.42 2d9s s ASN 36 Ca 0.00 0.33 -0.11 0.00 0.21 0.00 0.00 52.86 53.29 2d9s s ASN 36 Cb 0.00 -2.53 0.21 0.00 -0.55 0.00 0.00 41.25 38.38 2d9s s ASN 36 CO 0.00 -2.27 1.75 -0.29 -2.79 0.00 0.00 177.10 173.50 2d9s h ILE 37 N 6.80 0.82 -0.43 -5.21 6.09 -1.92 0.10 117.51 123.75 2d9s h ILE 37 Ca -0.27 -0.13 0.01 0.00 -1.37 0.00 0.00 64.86 63.10 2d9s h ILE 37 Cb 1.15 0.39 -0.02 0.00 0.47 0.00 0.00 36.82 38.81 2d9s h ILE 37 CO 1.21 0.07 0.28 -0.33 -3.07 0.00 0.00 178.15 176.32 2d9s h GLU 38 N 0.39 0.56 -0.03 2.19 4.39 -1.98 0.64 114.58 120.74 2d9s h GLU 38 Ca 0.27 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.93 2d9s h GLU 38 Cb 0.29 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2d9s h GLU 38 CO -0.26 0.37 0.00 1.98 -1.16 0.00 0.00 179.01 179.94 2d9s h MET 39 N 0.58 0.06 -0.87 2.33 4.05 -1.85 -2.67 114.93 116.55 2d9s h MET 39 Ca 0.16 -0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.61 2d9s h MET 39 Cb -0.05 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 30.69 2d9s h MET 39 CO -0.04 0.32 0.57 0.00 0.23 0.00 0.00 176.91 177.99 2d9s h ALA 40 N 0.74 1.50 -0.77 0.39 0.00 -0.74 -0.97 119.26 119.40 2d9s h ALA 40 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2d9s h ALA 40 Cb 0.29 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2d9s h ALA 40 CO 0.00 0.40 0.49 0.87 0.00 0.00 0.00 179.25 181.01 2d9s h LYS 41 N 1.04 1.03 -0.63 0.00 1.57 -0.72 -2.31 116.57 116.55 2d9s h LYS 41 Ca 0.36 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 59.03 2d9s h LYS 41 Cb 0.11 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.17 2d9s h LYS 41 CO -0.12 0.71 0.27 -0.91 -0.57 0.00 0.00 179.45 178.82 2d9s h ASN 42 N 1.05 0.86 0.39 0.86 2.35 -0.85 -2.34 115.58 117.90 2d9s h ASN 42 Ca 0.28 -0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2d9s h ASN 42 Cb -0.08 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.04 2d9s h ASN 42 CO -0.06 0.79 -0.45 0.40 -1.65 0.00 0.00 177.43 176.46 2d9s h ILE 43 N 0.89 0.11 -0.84 2.81 2.04 -0.88 -2.33 117.51 119.30 2d9s h ILE 43 Ca 0.21 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.21 2d9s h ILE 43 Cb 0.18 0.11 -0.06 0.00 -0.74 0.00 0.00 36.82 36.31 2d9s h ILE 43 CO -0.02 0.00 0.55 -0.07 0.00 0.00 0.00 178.15 178.61 2d9s h LEU 44 N -0.87 0.59 -1.16 1.44 3.38 -1.38 0.39 115.31 117.70 2d9s h LEU 44 Ca -0.04 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2d9s h LEU 44 Cb 0.79 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2d9s h LEU 44 CO -0.10 0.31 -0.07 -0.09 0.09 0.00 0.00 178.44 178.58 2d9s h ARG 45 N 0.63 0.50 0.00 1.13 2.43 -0.86 -0.88 114.38 117.33 2d9s h ARG 45 Ca 0.41 -0.13 -0.37 0.00 -0.81 0.00 0.00 59.98 59.09 2d9s h ARG 45 Cb 0.70 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 30.12 2d9s h ARG 45 CO -0.17 0.58 -2.40 0.39 -1.51 0.00 0.00 179.97 176.86 2d9s n GLU 46 N -4.24 0.71 0.07 0.20 -0.58 -0.87 -4.61 120.64 111.31 2d9s n GLU 46 Ca 0.01 0.04 0.04 0.00 -0.42 0.00 0.00 57.16 56.83 2d9s n GLU 46 Cb 0.29 -1.51 -0.04 0.00 -0.57 0.00 0.00 31.44 29.60 2d9s n GLU 46 CO 0.00 0.00 0.00 0.74 -0.48 0.00 0.00 177.13 177.39 2d9s h PHE 47 N 0.00 0.00 -4.30 -0.32 -1.00 -1.01 -3.48 116.94 106.84 2d9s h PHE 47 Ca -0.55 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.03 2d9s h PHE 47 Cb 2.12 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 41.65 2d9s h PHE 47 CO 0.01 0.37 -0.14 0.45 -1.61 0.00 0.00 178.31 177.39 2d9s n SER 48 N -2.84 2.38 -3.62 2.17 2.88 -0.34 -5.02 113.62 109.23 2d9s n SER 48 Ca -0.05 -1.66 -0.00 0.00 -1.33 0.00 0.00 58.87 55.83 2d9s n SER 48 Cb 0.73 0.11 -0.01 0.00 -0.75 0.00 0.00 64.21 64.29 2d9s n SER 48 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2d9s s GLY 49 N -1.82 -0.38 -0.61 0.46 0.00 -1.26 -4.72 107.32 98.99 2d9s s GLY 49 Ca 0.00 0.86 -0.26 0.00 0.00 0.00 0.00 44.72 45.32 2d9s s GLY 49 CO 0.00 0.20 2.07 2.56 0.00 0.00 0.00 173.10 177.93 2d9s s PRO 50 N -2.49 2.40 0.88 2.90 0.04 -1.25 -4.75 135.00 132.72 2d9s s PRO 50 Ca 0.13 0.78 -0.11 0.00 0.04 0.00 0.00 61.00 61.85 2d9s s PRO 50 Cb 0.03 -4.52 0.12 0.00 0.04 0.00 0.00 34.50 30.17 2d9s s PRO 50 CO -0.04 -3.04 1.11 -1.12 0.04 0.00 0.00 177.00 173.95 2d9s s SER 51 N 9.54 3.38 1.02 6.66 0.01 -1.26 -5.03 113.70 128.02 2d9s s SER 51 Ca 0.78 1.95 -0.15 0.00 1.31 0.00 0.00 55.95 59.84 2d9s s SER 51 Cb -0.14 -2.50 0.20 0.00 0.21 0.00 0.00 66.02 63.80 2d9s s SER 51 CO 0.20 -2.77 1.17 -0.55 0.41 0.00 0.00 173.24 171.70 2d9s s SER 52 N -2.98 2.51 0.00 2.44 0.15 -1.26 -5.06 113.70 109.50 2d9s s SER 52 Ca 0.65 0.71 0.00 0.00 0.70 0.00 0.00 55.95 58.01 2d9s s SER 52 Cb -0.20 -1.06 0.00 0.00 -1.71 0.00 0.00 66.02 63.04 2d9s s SER 52 CO 0.58 -3.15 0.00 0.61 1.20 0.00 0.00 173.24 172.48