#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oa6 n PRO 2 N 0.00 1.96 0.28 2.89 -0.02 -1.26 -4.72 135.00 134.13 1oa6 n PRO 2 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.32 1oa6 n PRO 2 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.40 1oa6 n PRO 2 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1oa6 h ASP 3 N 0.00 -0.58 0.00 2.55 2.03 -2.00 -3.09 116.42 115.32 1oa6 h ASP 3 Ca 0.00 -0.02 -0.04 0.00 -0.73 0.00 0.00 57.03 56.24 1oa6 h ASP 3 Cb 0.00 0.15 -0.01 0.00 -0.83 0.00 0.00 39.33 38.64 1oa6 h ASP 3 CO 0.00 -0.35 0.29 2.22 -1.03 0.00 0.00 179.24 180.37 1oa6 n PHE 4 N -5.35 0.00 -1.42 4.15 1.16 -1.26 -1.66 117.46 113.08 1oa6 n PHE 4 Ca -0.12 -0.30 0.00 0.00 -1.87 0.00 0.00 57.45 55.16 1oa6 n PHE 4 Cb 0.30 -0.62 0.00 0.00 -1.61 0.00 0.00 39.48 37.56 1oa6 n PHE 4 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1oa6 n LEU 6 N 0.00 1.65 -4.65 0.00 4.77 -0.66 -4.53 117.00 113.58 1oa6 n LEU 6 Ca 0.00 0.28 -0.49 0.00 -0.03 0.00 0.00 56.01 55.77 1oa6 n LEU 6 Cb 0.38 -0.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.78 1oa6 n LEU 6 CO 0.00 -0.00 1.17 -1.84 -1.33 0.00 0.00 177.39 175.39 1oa6 n GLU 7 N -4.12 1.83 -1.49 3.23 0.28 -1.26 -4.93 120.64 114.17 1oa6 n GLU 7 Ca -0.25 0.66 -0.29 0.00 -0.16 0.00 0.00 57.16 57.11 1oa6 n GLU 7 Cb 0.59 -2.41 0.12 0.00 1.43 0.00 0.00 31.44 31.17 1oa6 n GLU 7 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1oa6 s PRO 8 N 1.46 1.59 0.09 3.44 0.04 -1.26 -4.55 135.00 135.82 1oa6 s PRO 8 Ca 0.84 0.53 -0.36 0.00 0.04 0.00 0.00 61.00 62.05 1oa6 s PRO 8 Cb -0.78 -1.87 -0.17 0.00 0.04 0.00 0.00 34.50 31.72 1oa6 s PRO 8 CO 0.44 -1.94 1.19 -2.30 0.04 0.00 0.00 177.00 174.43 1oa6 n PRO 9 N -3.63 0.83 -3.73 0.56 -0.01 -1.26 -4.91 135.00 122.85 1oa6 n PRO 9 Ca 0.07 0.30 -0.28 0.00 -0.01 0.00 0.00 63.50 63.57 1oa6 n PRO 9 Cb 0.57 -1.84 -0.16 0.00 -0.01 0.00 0.00 33.50 32.06 1oa6 n PRO 9 CO 0.00 0.00 0.00 -0.47 -0.01 0.00 0.00 175.50 175.02 1oa6 s TYR 10 N 0.12 1.12 0.09 6.00 6.14 -1.26 -4.99 117.35 124.56 1oa6 s TYR 10 Ca 0.82 -1.01 0.06 0.00 0.64 0.00 0.00 57.07 57.57 1oa6 s TYR 10 Cb -1.00 -1.14 -0.23 0.00 0.42 0.00 0.00 41.96 40.02 1oa6 s TYR 10 CO 0.51 -0.67 1.17 1.15 0.64 0.00 0.00 175.55 178.35 1oa6 h THR 11 N 6.51 1.56 -0.01 4.34 2.02 -1.90 -3.41 112.91 122.02 1oa6 h THR 11 Ca -0.16 -3.26 0.00 0.00 0.77 0.00 0.00 66.41 63.76 1oa6 h THR 11 Cb 1.10 2.81 -0.00 0.00 -1.74 0.00 0.00 68.15 70.31 1oa6 h THR 11 CO 0.36 0.90 -0.00 0.61 0.37 0.00 0.00 175.52 177.76 1oa6 n GLY 12 N 1.42 -1.33 0.20 2.16 0.00 -1.26 -0.94 105.19 105.43 1oa6 n GLY 12 Ca -0.04 -1.53 -0.09 0.00 0.00 0.00 0.00 46.02 44.36 1oa6 n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oa6 h PRO 13 N -0.00 0.64 -7.26 1.61 0.13 -1.91 -3.44 132.00 121.75 1oa6 h PRO 13 Ca 0.00 -0.11 -0.51 0.00 -0.87 0.00 0.00 66.00 64.51 1oa6 h PRO 13 Cb 0.00 -0.10 0.19 0.00 0.13 0.00 0.00 31.00 31.22 1oa6 h PRO 13 CO 0.00 0.59 0.21 0.00 -0.23 0.00 0.00 178.00 178.57 1oa6 n LYS 15 N -4.21 1.28 -1.79 0.00 4.76 -1.13 -3.91 118.16 113.16 1oa6 n LYS 15 Ca 0.10 -3.05 -0.42 0.00 -2.87 0.00 0.00 58.31 52.07 1oa6 n LYS 15 Cb 0.53 -1.12 -0.03 0.00 -1.84 0.00 0.00 35.03 32.56 1oa6 n LYS 15 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1oa6 s ALA 16 N -2.51 3.76 0.00 7.82 0.00 0.22 -4.74 121.76 126.30 1oa6 s ALA 16 Ca 0.31 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.66 1oa6 s ALA 16 Cb 0.35 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1oa6 s ALA 16 CO -0.08 -1.15 0.28 0.54 0.00 0.00 0.00 175.76 175.35 1oa6 n ARG 17 N 5.45 0.00 -3.06 0.00 3.00 -1.26 -4.50 116.66 116.29 1oa6 n ARG 17 Ca 0.17 0.00 -0.45 0.00 -0.01 0.00 0.00 57.85 57.56 1oa6 n ARG 17 Cb 0.39 -1.25 -0.03 0.00 0.00 0.00 0.00 32.46 31.56 1oa6 n ARG 17 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1oa6 s ILE 18 N 2.06 4.92 0.34 0.55 1.01 -1.25 -5.01 121.20 123.82 1oa6 s ILE 18 Ca 0.00 -1.55 -0.28 0.00 0.00 0.00 0.00 60.65 58.82 1oa6 s ILE 18 Cb 0.00 -4.63 -0.10 0.00 0.01 0.00 0.00 42.46 37.74 1oa6 s ILE 18 CO 0.00 -1.30 1.22 -0.63 0.00 0.00 0.00 174.94 174.23 1oa6 s ILE 19 N 2.21 3.00 0.33 2.92 -1.09 -1.26 -1.33 121.20 125.98 1oa6 s ILE 19 Ca 0.23 0.96 -0.00 0.00 -2.23 0.00 0.00 60.65 59.61 1oa6 s ILE 19 Cb -0.12 -3.60 -0.01 0.00 -1.58 0.00 0.00 42.46 37.16 1oa6 s ILE 19 CO -0.04 0.20 0.42 -0.13 -1.23 0.00 0.00 174.94 174.16 1oa6 s ARG 20 N -1.84 1.85 0.22 2.79 1.81 -0.67 -4.86 118.95 118.25 1oa6 s ARG 20 Ca 0.50 -1.80 0.09 0.00 -1.72 0.00 0.00 55.73 52.79 1oa6 s ARG 20 Cb -0.36 0.41 -0.04 0.00 -0.45 0.00 0.00 34.95 34.51 1oa6 s ARG 20 CO 0.47 -0.75 -0.03 0.71 -0.68 0.00 0.00 175.30 175.02 1oa6 s TYR 21 N -3.19 2.72 0.31 -0.53 1.51 -0.62 -0.98 117.35 116.56 1oa6 s TYR 21 Ca 0.33 -0.20 -0.04 0.00 -1.01 0.00 0.00 57.07 56.15 1oa6 s TYR 21 Cb 0.00 -1.27 -0.01 0.00 -0.11 0.00 0.00 41.96 40.58 1oa6 s TYR 21 CO 0.21 0.56 0.42 -0.59 -1.11 0.00 0.00 175.55 175.05 1oa6 s PHE 22 N -1.98 0.98 -0.34 2.71 -0.71 0.81 -0.49 117.98 118.96 1oa6 s PHE 22 Ca 0.28 -1.22 -0.13 0.00 -1.04 0.00 0.00 56.93 54.83 1oa6 s PHE 22 Cb -0.08 -0.13 -0.02 0.00 -1.21 0.00 0.00 43.02 41.59 1oa6 s PHE 22 CO 0.18 -1.03 0.24 -0.47 -1.34 0.00 0.00 175.22 172.80 1oa6 s TYR 23 N -3.40 3.23 -0.89 3.49 5.04 -1.26 -0.38 117.35 123.18 1oa6 s TYR 23 Ca 0.31 -0.21 -0.23 0.00 -2.44 0.00 0.00 57.07 54.50 1oa6 s TYR 23 Cb 0.01 -2.47 0.07 0.00 0.35 0.00 0.00 41.96 39.91 1oa6 s TYR 23 CO 0.18 -0.36 1.26 1.21 -1.34 0.00 0.00 175.55 176.50 1oa6 s ASN 24 N 1.72 6.41 0.00 4.32 3.84 0.55 -4.82 114.94 126.96 1oa6 s ASN 24 Ca 0.06 -1.32 0.14 0.00 0.21 0.00 0.00 52.86 51.95 1oa6 s ASN 24 Cb -0.17 -2.50 0.59 0.00 -0.55 0.00 0.00 41.25 38.62 1oa6 s ASN 24 CO 0.10 -1.46 1.44 0.00 -2.79 0.00 0.00 177.10 174.39 1oa6 n ALA 25 N 8.24 1.64 0.20 1.71 0.00 -1.26 -0.88 120.51 130.15 1oa6 n ALA 25 Ca 0.19 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.64 1oa6 n ALA 25 Cb 0.49 -1.22 0.39 0.00 0.00 0.00 0.00 19.45 19.11 1oa6 n ALA 25 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1oa6 h LYS 26 N 0.00 0.00 0.00 0.00 3.11 -1.92 -3.33 116.57 114.42 1oa6 h LYS 26 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1oa6 h LYS 26 Cb 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.46 1oa6 h LYS 26 CO 0.00 0.34 -0.31 0.00 -2.81 0.00 0.00 179.45 176.67 1oa6 n ALA 27 N -2.32 1.12 -1.08 5.00 0.00 -1.07 -5.04 120.51 117.12 1oa6 n ALA 27 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1oa6 n ALA 27 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1oa6 n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oa6 n GLY 28 N 1.02 0.96 3.35 0.00 0.00 -0.06 -5.09 105.19 105.37 1oa6 n GLY 28 Ca 0.00 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 1oa6 n GLY 28 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1oa6 s LEU 29 N -0.45 0.26 0.66 0.99 2.96 -1.07 -5.01 118.68 117.02 1oa6 s LEU 29 Ca 0.00 0.35 -0.12 0.00 -0.22 0.00 0.00 54.13 54.14 1oa6 s LEU 29 Cb 0.00 1.76 -0.01 0.00 0.50 0.00 0.00 46.19 48.45 1oa6 s LEU 29 CO 0.00 -0.51 1.05 0.00 -1.32 0.00 0.00 176.35 175.58 1oa6 n GLN 31 N -2.82 0.82 -3.84 0.00 6.02 0.49 -4.69 117.38 113.36 1oa6 n GLN 31 Ca 0.08 -2.44 -0.20 0.00 -0.01 0.00 0.00 57.00 54.43 1oa6 n GLN 31 Cb 0.53 2.58 -0.02 0.00 1.02 0.00 0.00 30.24 34.35 1oa6 n GLN 31 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1oa6 s THR 32 N -2.55 4.89 0.07 5.09 -4.23 -1.26 -0.13 115.64 117.50 1oa6 s THR 32 Ca 0.23 -1.01 -0.07 0.00 -1.18 0.00 0.00 61.69 59.65 1oa6 s THR 32 Cb -0.02 -3.71 0.03 0.00 1.34 0.00 0.00 72.50 70.13 1oa6 s THR 32 CO 0.16 -0.28 0.35 2.22 -0.54 0.00 0.00 174.62 176.53 1oa6 n PHE 33 N -1.46 -0.86 -4.84 3.99 -1.74 -0.16 -4.79 117.46 107.59 1oa6 n PHE 33 Ca -0.06 -0.44 -0.30 0.00 -0.56 0.00 0.00 57.45 56.08 1oa6 n PHE 33 Cb 0.57 0.22 -0.17 0.00 1.52 0.00 0.00 39.48 41.62 1oa6 n PHE 33 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1oa6 s VAL 34 N -2.41 1.78 -0.11 1.97 1.01 -1.26 -1.67 120.40 119.70 1oa6 s VAL 34 Ca 0.08 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.11 1oa6 s VAL 34 Cb -0.01 -1.57 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 1oa6 s VAL 34 CO 0.02 0.50 0.23 -0.47 0.00 0.00 0.00 175.10 175.38 1oa6 s TYR 35 N 0.63 3.57 0.17 5.22 5.04 -0.44 -4.51 117.35 127.02 1oa6 s TYR 35 Ca -0.13 0.62 -0.07 0.00 -2.44 0.00 0.00 57.07 55.05 1oa6 s TYR 35 Cb -0.16 -2.15 0.06 0.00 0.35 0.00 0.00 41.96 40.06 1oa6 s TYR 35 CO 0.04 0.53 1.51 0.78 -1.34 0.00 0.00 175.55 177.07 1oa6 h GLY 36 N 5.58 0.82 0.00 8.97 0.00 -1.16 -3.31 103.07 113.97 1oa6 h GLY 36 Ca -0.49 -0.86 0.00 0.00 0.00 0.00 0.00 47.33 45.98 1oa6 h GLY 36 CO 0.66 0.78 0.00 0.61 0.00 0.00 0.00 176.54 178.58 1oa6 n GLY 37 N 0.13 1.09 3.20 4.60 0.00 -1.26 0.69 105.19 113.64 1oa6 n GLY 37 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 1oa6 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa6 n ARG 39 N 1.24 -6.04 -0.85 0.00 1.74 -1.26 -4.40 116.66 107.08 1oa6 n ARG 39 Ca -0.21 0.83 -0.15 0.00 -0.77 0.00 0.00 57.85 57.55 1oa6 n ARG 39 Cb 0.54 -5.80 0.11 0.00 -1.02 0.00 0.00 32.46 26.29 1oa6 n ARG 39 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1oa6 n ALA 40 N -4.06 -1.04 -3.67 7.54 0.00 -1.26 -4.55 120.51 113.47 1oa6 n ALA 40 Ca -0.27 -0.87 -0.08 0.00 0.00 0.00 0.00 53.44 52.22 1oa6 n ALA 40 Cb 0.67 -0.05 -0.02 0.00 0.00 0.00 0.00 19.45 20.05 1oa6 n ALA 40 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1oa6 n LYS 41 N -2.64 0.65 -0.09 0.00 4.76 -1.26 -5.06 118.16 114.52 1oa6 n LYS 41 Ca 0.08 -1.03 -0.13 0.00 -2.87 0.00 0.00 58.31 54.37 1oa6 n LYS 41 Cb 0.30 0.63 -0.05 0.00 -1.84 0.00 0.00 35.03 34.07 1oa6 n LYS 41 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1oa6 h ARG 42 N 0.00 0.61 -5.32 1.97 3.08 -1.95 -3.37 114.38 109.40 1oa6 h ARG 42 Ca -0.09 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.58 1oa6 h ARG 42 Cb 0.36 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1oa6 h ARG 42 CO 0.14 0.91 0.21 1.21 -1.07 0.00 0.00 179.97 181.36 1oa6 s ASN 43 N -6.41 3.96 -0.28 7.04 3.84 -1.26 -4.79 114.94 117.03 1oa6 s ASN 43 Ca -0.13 -0.55 -0.14 0.00 0.21 0.00 0.00 52.86 52.25 1oa6 s ASN 43 Cb 0.08 -2.57 0.09 0.00 -0.55 0.00 0.00 41.25 38.30 1oa6 s ASN 43 CO 0.81 -4.01 0.67 0.21 -2.79 0.00 0.00 177.10 171.99 1oa6 s ASN 44 N 9.33 -0.99 0.24 -4.21 3.84 -1.26 -4.77 114.94 117.12 1oa6 s ASN 44 Ca 0.84 1.52 -0.02 0.00 0.21 0.00 0.00 52.86 55.41 1oa6 s ASN 44 Cb -0.08 1.63 -0.03 0.00 -0.55 0.00 0.00 41.25 42.22 1oa6 s ASN 44 CO 0.11 -0.23 0.25 -0.36 -2.79 0.00 0.00 177.10 174.08 1oa6 s PHE 45 N 1.99 1.09 -0.07 0.43 0.08 0.36 -4.97 117.98 116.87 1oa6 s PHE 45 Ca -0.09 -1.29 0.12 0.00 0.12 0.00 0.00 56.93 55.79 1oa6 s PHE 45 Cb -0.07 -0.39 -0.17 0.00 -0.57 0.00 0.00 43.02 41.82 1oa6 s PHE 45 CO -0.20 -0.79 0.15 0.36 -0.10 0.00 0.00 175.22 174.64 1oa6 n LYS 46 N -0.37 1.30 -4.09 0.44 2.85 -1.26 -1.59 118.16 115.42 1oa6 n LYS 46 Ca 0.02 -0.06 -0.11 0.00 -1.05 0.00 0.00 58.31 57.12 1oa6 n LYS 46 Cb 0.64 -1.31 -0.11 0.00 -0.65 0.00 0.00 35.03 33.61 1oa6 n LYS 46 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1oa6 s SER 47 N -4.05 0.82 0.23 -5.58 1.04 -1.26 -4.47 113.70 100.42 1oa6 s SER 47 Ca -0.05 -0.78 -0.04 0.00 0.48 0.00 0.00 55.95 55.55 1oa6 s SER 47 Cb 0.06 0.09 0.22 0.00 0.10 0.00 0.00 66.02 66.49 1oa6 s SER 47 CO 0.52 -0.37 1.68 0.00 0.98 0.00 0.00 173.24 176.04 1oa6 h ALA 48 N 3.75 0.95 -0.32 5.32 0.00 -1.95 -1.97 119.26 125.04 1oa6 h ALA 48 Ca -0.35 -0.33 0.06 0.00 0.00 0.00 0.00 54.91 54.29 1oa6 h ALA 48 Cb 1.18 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 1oa6 h ALA 48 CO 0.53 0.62 -0.03 0.93 0.00 0.00 0.00 179.25 181.30 1oa6 h GLU 49 N 0.74 0.05 0.21 0.00 3.07 -1.99 0.33 114.58 116.99 1oa6 h GLU 49 Ca 0.12 -0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.99 1oa6 h GLU 49 Cb 0.61 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.48 1oa6 h GLU 49 CO 0.04 0.04 -0.35 -0.44 -1.40 0.00 0.00 179.01 176.89 1oa6 h ASP 50 N 0.06 -1.00 -0.91 1.42 5.19 -1.83 -0.50 116.42 118.85 1oa6 h ASP 50 Ca 0.16 0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 1oa6 h ASP 50 Cb 0.22 0.36 -0.04 0.00 0.18 0.00 0.00 39.33 40.05 1oa6 h ASP 50 CO -0.29 -0.46 0.58 0.00 -3.12 0.00 0.00 179.24 175.95 1oa6 h MET 52 N 1.24 0.28 0.00 0.00 2.86 -0.58 0.41 114.93 119.14 1oa6 h MET 52 Ca 0.33 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.84 1oa6 h MET 52 Cb -0.10 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.54 1oa6 h MET 52 CO -0.07 0.55 -0.12 -0.09 1.06 0.00 0.00 176.91 178.25 1oa6 h ARG 53 N -0.02 0.00 0.00 1.72 1.12 -0.96 3.54 114.38 119.78 1oa6 h ARG 53 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.91 1oa6 h ARG 53 Cb 0.45 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.41 1oa6 h ARG 53 CO 0.01 0.12 -0.81 2.41 -3.11 0.00 0.00 179.97 178.59 1oa6 n THR 54 N -3.25 1.24 -0.08 0.20 -1.04 -0.08 -4.54 114.28 106.72 1oa6 n THR 54 Ca 0.01 0.20 -0.23 0.00 -2.04 0.00 0.00 64.05 61.99 1oa6 n THR 54 Cb 0.39 -2.20 -0.12 0.00 -1.82 0.00 0.00 70.33 66.57 1oa6 n THR 54 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1oa6 n GLY 56 N 1.62 -3.15 4.99 0.00 0.00 0.11 0.16 105.19 108.93 1oa6 n GLY 56 Ca -0.37 0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1oa6 n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa6 n GLY 57 N -0.65 0.28 0.00 -0.02 0.00 1.17 -1.72 105.19 104.25 1oa6 n GLY 57 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1oa6 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32