#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b28 s LYS 2 N 0.00 0.72 0.00 0.03 -2.85 -1.26 -5.08 119.74 111.30 1b28 s LYS 2 Ca 0.00 -0.46 0.00 0.00 -1.00 0.00 0.00 55.97 54.51 1b28 s LYS 2 Cb 0.00 0.20 0.00 0.00 -2.06 0.00 0.00 37.83 35.97 1b28 s LYS 2 CO 0.00 -0.34 0.00 0.41 0.10 0.00 0.00 175.35 175.52 1b28 n GLY 3 N -0.81 0.14 0.07 0.59 0.00 -1.26 -5.06 105.19 98.85 1b28 n GLY 3 Ca 0.01 -0.41 -0.05 0.00 0.00 0.00 0.00 46.02 45.57 1b28 n GLY 3 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1b28 n MET 4 N -0.59 0.43 0.00 1.61 2.81 -1.26 -4.84 117.12 115.28 1b28 n MET 4 Ca 0.00 0.49 0.00 0.00 -1.81 0.00 0.00 57.70 56.38 1b28 n MET 4 Cb 0.29 -1.62 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 1b28 n MET 4 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1b28 n SER 5 N -4.45 0.00 0.00 7.83 2.88 -1.26 -5.05 113.62 113.57 1b28 n SER 5 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1b28 n SER 5 Cb 0.26 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 1b28 n SER 5 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1b28 n LYS 6 N -0.76 0.00 -3.11 -1.46 5.02 -1.26 -5.03 118.16 111.56 1b28 n LYS 6 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 1b28 n LYS 6 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1b28 n LYS 6 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1b28 n MET 7 N -0.11 0.93 -2.93 1.97 2.81 -1.26 -4.58 117.12 113.95 1b28 n MET 7 Ca 0.00 -3.10 -0.44 0.00 -1.81 0.00 0.00 57.70 52.35 1b28 n MET 7 Cb 0.00 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 30.98 1b28 n MET 7 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1b28 n PRO 8 N 0.50 3.45 -3.20 0.03 -0.04 -1.26 -5.00 135.00 129.49 1b28 n PRO 8 Ca 0.21 -3.91 -0.36 0.00 -0.04 0.00 0.00 63.50 59.41 1b28 n PRO 8 Cb 0.65 -2.95 -0.06 0.00 -0.04 0.00 0.00 33.50 31.09 1b28 n PRO 8 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1b28 s GLN 9 N 0.95 4.15 -0.08 0.54 0.74 -1.26 -5.06 119.66 119.65 1b28 s GLN 9 Ca 0.41 0.73 -0.02 0.00 0.05 0.00 0.00 55.36 56.53 1b28 s GLN 9 Cb -0.02 -2.91 0.04 0.00 1.10 0.00 0.00 33.01 31.22 1b28 s GLN 9 CO -0.01 0.43 0.04 0.12 -0.55 0.00 0.00 175.29 175.33 1b28 s PHE 10 N -1.49 0.36 -0.08 1.67 5.36 -1.26 -5.13 117.98 117.41 1b28 s PHE 10 Ca 0.41 -0.06 -0.15 0.00 -0.96 0.00 0.00 56.93 56.17 1b28 s PHE 10 Cb -0.16 -0.66 -0.05 0.00 -0.34 0.00 0.00 43.02 41.81 1b28 s PHE 10 CO 0.20 -0.32 0.37 0.54 -1.46 0.00 0.00 175.22 174.55 1b28 s ASN 11 N 2.07 6.65 0.32 6.13 2.20 -1.26 -5.09 114.94 125.97 1b28 s ASN 11 Ca 0.04 0.77 0.08 0.00 -0.94 0.00 0.00 52.86 52.81 1b28 s ASN 11 Cb -0.13 -2.22 -0.04 0.00 -2.00 0.00 0.00 41.25 36.85 1b28 s ASN 11 CO -0.05 0.20 0.13 -0.76 -2.94 0.00 0.00 177.10 173.68 1b28 s LEU 12 N -0.30 3.30 -0.54 3.54 1.43 -1.26 -5.09 118.68 119.76 1b28 s LEU 12 Ca 0.21 -0.71 0.04 0.00 -1.03 0.00 0.00 54.13 52.65 1b28 s LEU 12 Cb -0.15 -1.79 0.14 0.00 0.03 0.00 0.00 46.19 44.42 1b28 s LEU 12 CO 0.09 -0.23 0.30 -0.13 0.23 0.00 0.00 176.35 176.61 1b28 s ARG 13 N -3.82 1.93 0.08 1.70 0.52 -1.26 -5.08 118.95 113.01 1b28 s ARG 13 Ca 0.36 -2.64 0.09 0.00 -0.52 0.00 0.00 55.73 53.02 1b28 s ARG 13 Cb -0.04 -3.14 -0.03 0.00 0.52 0.00 0.00 34.95 32.26 1b28 s ARG 13 CO 0.22 -1.15 -0.23 -1.58 0.02 0.00 0.00 175.30 172.58 1b28 s TRP 14 N -0.38 2.03 0.47 -0.53 0.51 -1.26 -5.12 118.94 114.66 1b28 s TRP 14 Ca 0.19 -0.39 -0.24 0.00 -2.12 0.00 0.00 56.10 53.54 1b28 s TRP 14 Cb -0.22 -1.17 -0.08 0.00 -0.81 0.00 0.00 33.47 31.19 1b28 s TRP 14 CO -0.03 0.18 1.17 -2.30 -0.51 0.00 0.00 176.95 175.45 1b28 n PRO 15 N 1.46 1.58 -0.11 4.98 -0.02 -1.26 -4.83 135.00 136.81 1b28 n PRO 15 Ca -0.18 0.57 0.05 0.00 -2.02 0.00 0.00 63.50 61.93 1b28 n PRO 15 Cb 0.53 -2.29 0.38 0.00 -0.02 0.00 0.00 33.50 32.10 1b28 n PRO 15 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1b28 h ARG 16 N 1.60 0.66 -0.55 -0.52 2.43 -1.99 -1.69 114.38 114.32 1b28 h ARG 16 Ca -0.47 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 58.58 1b28 h ARG 16 Cb 1.32 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 1b28 h ARG 16 CO 0.57 0.44 0.03 0.93 -1.51 0.00 0.00 179.97 180.43 1b28 h GLU 17 N 0.68 0.93 -0.45 0.20 5.08 -1.99 -1.09 114.58 117.94 1b28 h GLU 17 Ca 0.24 -0.26 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 1b28 h GLU 17 Cb 0.11 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1b28 h GLU 17 CO -0.07 0.90 0.01 0.28 -1.00 0.00 0.00 179.01 179.14 1b28 h VAL 18 N 0.86 1.26 -0.28 3.13 2.07 -1.70 -2.53 116.25 119.07 1b28 h VAL 18 Ca 0.17 -1.02 -0.06 0.00 0.82 0.00 0.00 66.70 66.60 1b28 h VAL 18 Cb 0.47 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1b28 h VAL 18 CO 0.02 0.35 -0.08 0.25 0.02 0.00 0.00 177.57 178.13 1b28 h LEU 19 N 0.63 0.43 -1.22 2.57 5.85 -1.25 -1.04 115.31 121.27 1b28 h LEU 19 Ca 0.13 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.67 1b28 h LEU 19 Cb 0.48 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1b28 h LEU 19 CO 0.02 0.55 -0.39 0.44 -0.34 0.00 0.00 178.44 178.73 1b28 h ASP 20 N 0.42 0.00 0.75 1.25 3.32 -1.05 0.14 116.42 121.25 1b28 h ASP 20 Ca 0.09 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.93 1b28 h ASP 20 Cb 0.41 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1b28 h ASP 20 CO 0.02 0.39 -0.95 0.25 -1.72 0.00 0.00 179.24 177.23 1b28 h LEU 21 N 0.00 0.16 -1.10 1.55 5.85 -0.99 0.24 115.31 121.02 1b28 h LEU 21 Ca -0.00 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.48 1b28 h LEU 21 Cb 0.69 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 1b28 h LEU 21 CO 0.05 1.02 -0.40 0.58 -0.34 0.00 0.00 178.44 179.35 1b28 h VAL 22 N 0.05 1.30 -0.43 1.05 2.07 -0.95 0.52 116.25 119.86 1b28 h VAL 22 Ca -0.04 -1.42 -0.10 0.00 0.82 0.00 0.00 66.70 65.96 1b28 h VAL 22 Cb 1.63 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 33.10 1b28 h VAL 22 CO 0.14 0.41 -0.12 0.03 0.02 0.00 0.00 177.57 178.05 1b28 h ARG 23 N 0.08 0.83 0.45 1.57 2.47 -0.55 -2.71 114.38 116.52 1b28 h ARG 23 Ca 0.01 -0.33 -0.02 0.00 -1.26 0.00 0.00 59.98 58.38 1b28 h ARG 23 Cb 0.74 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.02 1b28 h ARG 23 CO 0.06 0.96 -0.21 0.87 0.56 0.00 0.00 179.97 182.20 1b28 h LYS 24 N 0.66 -0.58 -0.96 0.04 1.57 -0.13 -2.61 116.57 114.56 1b28 h LYS 24 Ca 0.11 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 59.03 1b28 h LYS 24 Cb 0.66 0.13 -0.08 0.00 0.08 0.00 0.00 32.23 33.02 1b28 h LYS 24 CO 0.05 -0.29 0.60 -0.24 -0.57 0.00 0.00 179.45 178.99 1b28 h VAL 25 N -0.81 0.96 -0.58 0.50 3.04 -1.01 -1.97 116.25 116.38 1b28 h VAL 25 Ca -0.06 -0.34 -0.03 0.00 -1.01 0.00 0.00 66.70 65.26 1b28 h VAL 25 Cb 0.55 -0.12 -0.03 0.00 -2.01 0.00 0.00 31.29 29.69 1b28 h VAL 25 CO 0.10 0.18 0.24 0.00 -1.01 0.00 0.00 177.57 177.09 1b28 h ALA 26 N 1.50 1.34 -0.44 3.17 0.00 -1.45 -2.60 119.26 120.78 1b28 h ALA 26 Ca 0.46 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 1b28 h ALA 26 Cb 0.38 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1b28 h ALA 26 CO -0.24 0.50 -0.20 0.93 0.00 0.00 0.00 179.25 180.24 1b28 h GLU 27 N 0.82 0.87 -0.24 0.00 5.08 -0.97 -0.77 114.58 119.38 1b28 h GLU 27 Ca 0.20 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1b28 h GLU 27 Cb 0.14 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1b28 h GLU 27 CO -0.02 1.00 0.13 0.93 -1.00 0.00 0.00 179.01 180.05 1b28 h GLU 28 N 0.76 0.33 0.00 2.33 5.08 -1.09 -1.65 114.58 120.34 1b28 h GLU 28 Ca 0.11 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1b28 h GLU 28 Cb 0.74 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.93 1b28 h GLU 28 CO 0.06 0.29 0.00 0.09 -1.00 0.00 0.00 179.01 178.45 1b28 n ASN 29 N -4.87 0.30 -2.72 1.42 3.02 -1.03 -4.95 115.26 106.43 1b28 n ASN 29 Ca -0.03 0.55 -0.10 0.00 -0.03 0.00 0.00 54.58 54.97 1b28 n ASN 29 Cb 0.07 -0.62 0.05 0.00 -0.61 0.00 0.00 39.78 38.66 1b28 n ASN 29 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1b28 n GLY 30 N 0.74 -0.57 3.18 7.41 0.00 -0.62 -5.05 105.19 110.26 1b28 n GLY 30 Ca 0.05 0.33 -0.12 0.00 0.00 0.00 0.00 46.02 46.27 1b28 n GLY 30 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1b28 s MET 31 N -3.92 0.54 0.42 1.61 0.00 -0.39 -5.03 119.30 112.53 1b28 s MET 31 Ca 0.30 -0.17 -0.24 0.00 0.00 0.00 0.00 55.69 55.58 1b28 s MET 31 Cb -0.04 0.24 -0.08 0.00 0.00 0.00 0.00 34.83 34.95 1b28 s MET 31 CO 0.52 -0.13 1.16 -1.54 0.00 0.00 0.00 175.02 175.03 1b28 s SER 32 N -1.10 6.42 0.29 1.11 1.04 -1.26 -4.50 113.70 115.71 1b28 s SER 32 Ca -0.12 2.32 -0.00 0.00 0.48 0.00 0.00 55.95 58.63 1b28 s SER 32 Cb -0.06 -2.61 0.45 0.00 0.10 0.00 0.00 66.02 63.91 1b28 s SER 32 CO 0.03 -0.74 1.85 -0.37 0.98 0.00 0.00 173.24 174.99 1b28 h VAL 33 N 2.18 1.21 0.19 5.02 -1.51 -1.94 -1.05 116.25 120.36 1b28 h VAL 33 Ca -0.49 -0.75 0.00 0.00 -1.23 0.00 0.00 66.70 64.23 1b28 h VAL 33 Cb 1.24 0.65 -0.02 0.00 -2.13 0.00 0.00 31.29 31.04 1b28 h VAL 33 CO 0.62 0.28 -0.18 0.78 -1.23 0.00 0.00 177.57 177.84 1b28 h ASN 34 N 0.77 -0.48 1.04 4.19 2.35 -1.99 -2.14 115.58 119.32 1b28 h ASN 34 Ca 0.17 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1b28 h ASN 34 Cb 0.25 0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1b28 h ASN 34 CO -0.01 -0.27 0.00 0.28 -1.65 0.00 0.00 177.43 175.78 1b28 h SER 35 N -0.40 0.00 0.17 5.81 0.02 -1.95 -2.69 113.55 114.53 1b28 h SER 35 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1b28 h SER 35 Cb 0.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1b28 h SER 35 CO -0.04 0.00 -0.08 0.22 -1.14 0.00 0.00 176.83 175.79 1b28 h TYR 36 N 0.00 -0.22 0.00 3.45 3.20 -0.55 -1.05 116.97 121.80 1b28 h TYR 36 Ca 0.00 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 1b28 h TYR 36 Cb 0.52 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1b28 h TYR 36 CO 0.00 0.17 -0.33 0.82 -1.64 0.00 0.00 178.16 177.19 1b28 h ILE 37 N -0.92 1.11 -0.92 1.81 5.03 -1.57 -0.20 117.51 121.85 1b28 h ILE 37 Ca -0.02 -1.17 0.06 0.00 -0.12 0.00 0.00 64.86 63.61 1b28 h ILE 37 Cb 0.49 1.65 -0.06 0.00 -3.03 0.00 0.00 36.82 35.87 1b28 h ILE 37 CO 0.04 0.32 0.60 0.22 -0.68 0.00 0.00 178.15 178.65 1b28 h TYR 38 N 0.00 1.07 0.00 1.37 5.03 -1.49 -1.40 116.97 121.55 1b28 h TYR 38 Ca -0.00 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.33 1b28 h TYR 38 Cb 0.62 -0.35 0.00 0.00 1.55 0.00 0.00 36.73 38.55 1b28 h TYR 38 CO 0.00 0.57 0.00 0.37 -1.32 0.00 0.00 178.16 177.78 1b28 h GLN 39 N 1.06 0.00 0.05 1.82 5.75 0.29 -2.61 115.11 121.47 1b28 h GLN 39 Ca 0.39 0.00 -0.27 0.00 -0.15 0.00 0.00 58.65 58.63 1b28 h GLN 39 Cb 0.18 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 1b28 h GLN 39 CO -0.15 0.00 -1.35 -0.07 -2.65 0.00 0.00 178.83 174.62 1b28 h LEU 40 N 0.00 0.18 0.00 -2.39 3.38 -0.22 0.10 115.31 116.36 1b28 h LEU 40 Ca 0.00 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1b28 h LEU 40 Cb 0.76 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1b28 h LEU 40 CO 0.00 1.19 0.00 1.33 0.09 0.00 0.00 178.44 181.05 1b28 n VAL 41 N -3.34 0.50 0.07 1.22 0.24 -0.62 -1.52 118.33 114.88 1b28 n VAL 41 Ca -0.10 0.12 0.07 0.00 -2.04 0.00 0.00 64.34 62.40 1b28 n VAL 41 Cb 1.01 -0.76 -0.11 0.00 -1.47 0.00 0.00 33.84 32.51 1b28 n VAL 41 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 1b28 n MET 42 N -1.46 0.66 0.02 7.34 2.81 -0.99 -3.55 117.12 121.95 1b28 n MET 42 Ca 0.06 -0.12 0.06 0.00 -1.81 0.00 0.00 57.70 55.89 1b28 n MET 42 Cb 0.24 -1.32 -0.10 0.00 -0.71 0.00 0.00 33.22 31.32 1b28 n MET 42 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1b28 n GLU 43 N -1.92 0.64 0.00 0.03 1.02 0.34 -4.30 120.64 116.44 1b28 n GLU 43 Ca -0.02 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1b28 n GLU 43 Cb 0.36 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 1b28 n GLU 43 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1b28 n SER 44 N -2.59 0.00 -4.76 1.62 2.88 -0.57 -4.86 113.62 105.34 1b28 n SER 44 Ca -0.08 0.10 -0.40 0.00 -1.33 0.00 0.00 58.87 57.16 1b28 n SER 44 Cb 0.71 -0.41 -0.03 0.00 -0.75 0.00 0.00 64.21 63.73 1b28 n SER 44 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1b28 s PHE 45 N -0.82 3.37 0.00 0.66 5.36 -1.23 -4.50 117.98 120.83 1b28 s PHE 45 Ca 0.00 1.60 0.00 0.00 -0.96 0.00 0.00 56.93 57.57 1b28 s PHE 45 Cb 0.00 -3.41 0.00 0.00 -0.34 0.00 0.00 43.02 39.27 1b28 s PHE 45 CO 0.00 -1.01 0.00 1.17 -1.46 0.00 0.00 175.22 173.92 1b28 n LYS 46 N 0.96 0.00 0.00 10.12 4.81 -1.26 -2.86 118.16 129.93 1b28 n LYS 46 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1b28 n LYS 46 Cb 0.44 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.49 1b28 n LYS 46 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1b28 n LYS 47 N -1.99 0.00 0.00 1.64 0.00 -1.26 -5.06 118.16 111.49 1b28 n LYS 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 1b28 n LYS 47 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 1b28 n LYS 47 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1b28 n GLU 48 N 0.00 0.00 0.00 1.64 1.02 -1.26 -5.09 120.64 116.95 1b28 n GLU 48 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1b28 n GLU 48 Cb 0.00 -0.29 0.00 0.00 -0.02 0.00 0.00 31.44 31.13 1b28 n GLU 48 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b28 n GLY 49 N 0.17 1.12 0.00 0.62 0.00 -1.26 -5.03 105.19 100.81 1b28 n GLY 49 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1b28 n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b28 n ARG 50 N 0.00 0.00 -0.25 1.61 3.00 -1.26 -4.80 116.66 114.96 1b28 n ARG 50 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.85 57.88 1b28 n ARG 50 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 32.46 32.60 1b28 n ARG 50 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 1b28 h ILE 51 N 0.00 0.35 0.00 0.55 6.09 -1.98 -3.42 117.51 119.09 1b28 h ILE 51 Ca 0.00 -0.03 0.00 0.00 -1.37 0.00 0.00 64.86 63.46 1b28 h ILE 51 Cb 0.00 0.25 0.00 0.00 0.47 0.00 0.00 36.82 37.54 1b28 h ILE 51 CO 0.00 0.02 0.00 0.61 -3.07 0.00 0.00 178.15 175.71 1b28 n GLY 52 N -1.42 -2.03 0.00 8.18 0.00 -1.26 -5.16 105.19 103.49 1b28 n GLY 52 Ca 0.12 0.99 0.00 0.00 0.00 0.00 0.00 46.02 47.13 1b28 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32