#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fp8 n PRO 2 N 0.00 1.31 -0.36 2.89 -0.02 -1.26 -4.93 135.00 132.63 3fp8 n PRO 2 Ca 0.00 0.50 0.02 0.00 -2.02 0.00 0.00 63.50 62.00 3fp8 n PRO 2 Cb 0.00 -2.47 0.17 0.00 -0.02 0.00 0.00 33.50 31.18 3fp8 n PRO 2 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 3fp8 h ASP 3 N 0.91 1.02 0.23 2.55 3.04 -2.02 -2.46 116.42 119.69 3fp8 h ASP 3 Ca -0.50 0.01 -0.01 0.00 -3.24 0.00 0.00 57.03 53.29 3fp8 h ASP 3 Cb 1.33 -0.21 -0.00 0.00 -1.04 0.00 0.00 39.33 39.41 3fp8 h ASP 3 CO 0.54 0.66 -0.03 2.19 -2.04 0.00 0.00 179.24 180.56 3fp8 h PHE 4 N 1.16 0.00 0.00 4.15 -5.15 -1.98 -1.81 116.94 113.31 3fp8 h PHE 4 Ca 0.42 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 58.17 3fp8 h PHE 4 Cb 0.15 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.31 3fp8 h PHE 4 CO -0.01 0.03 -0.12 0.00 -2.00 0.00 0.00 178.31 176.22 3fp8 n LEU 6 N -3.37 1.64 -4.84 0.00 4.77 -0.68 -4.56 117.00 109.96 3fp8 n LEU 6 Ca -0.01 -0.53 -0.34 0.00 -0.03 0.00 0.00 56.01 55.10 3fp8 n LEU 6 Cb 0.31 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.30 3fp8 n LEU 6 CO 0.30 0.28 0.39 -1.61 -1.33 0.00 0.00 177.39 175.43 3fp8 s GLU 7 N -2.20 4.08 0.68 3.23 0.41 -1.06 -4.96 118.70 118.88 3fp8 s GLU 7 Ca 0.30 0.71 -0.16 0.00 -0.41 0.00 0.00 54.97 55.41 3fp8 s GLU 7 Cb 0.20 -2.64 0.01 0.00 -1.78 0.00 0.00 34.13 29.92 3fp8 s GLU 7 CO 0.41 0.27 1.17 -1.25 -0.49 0.00 0.00 175.26 175.38 3fp8 s PRO 8 N -2.54 2.50 0.34 0.39 0.04 -1.26 -4.93 135.00 129.54 3fp8 s PRO 8 Ca 0.49 1.65 -0.29 0.00 0.04 0.00 0.00 61.00 62.89 3fp8 s PRO 8 Cb -0.13 -1.89 -0.12 0.00 0.04 0.00 0.00 34.50 32.40 3fp8 s PRO 8 CO 0.19 -1.53 1.43 -0.35 0.04 0.00 0.00 177.00 176.78 3fp8 n PRO 9 N -2.42 2.43 -3.81 0.56 -0.04 -1.26 -4.97 135.00 125.49 3fp8 n PRO 9 Ca 0.12 0.86 -0.36 0.00 -0.04 0.00 0.00 63.50 64.08 3fp8 n PRO 9 Cb 0.51 -2.54 -0.13 0.00 -0.04 0.00 0.00 33.50 31.30 3fp8 n PRO 9 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 3fp8 s TYR 10 N -0.82 3.32 0.20 0.54 5.04 -1.26 -4.97 117.35 119.40 3fp8 s TYR 10 Ca 0.57 -1.79 -0.07 0.00 -2.44 0.00 0.00 57.07 53.34 3fp8 s TYR 10 Cb -0.53 -2.41 0.12 0.00 0.35 0.00 0.00 41.96 39.49 3fp8 s TYR 10 CO 0.59 -0.81 1.64 1.15 -1.34 0.00 0.00 175.55 176.78 3fp8 h THR 11 N 6.32 1.26 0.00 4.34 2.02 -1.94 -3.44 112.91 121.48 3fp8 h THR 11 Ca -0.20 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 65.75 3fp8 h THR 11 Cb 1.07 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 3fp8 h THR 11 CO 0.60 0.43 0.00 0.61 0.37 0.00 0.00 175.52 177.53 3fp8 n GLY 12 N -0.34 -0.71 0.19 2.16 0.00 -1.26 -0.18 105.19 105.05 3fp8 n GLY 12 Ca 0.02 -1.70 0.07 0.00 0.00 0.00 0.00 46.02 44.41 3fp8 n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fp8 h PRO 13 N 0.00 0.00 -7.23 1.61 0.13 -1.93 -3.44 132.00 121.15 3fp8 h PRO 13 Ca 0.00 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.62 3fp8 h PRO 13 Cb 0.00 0.00 0.11 0.00 0.13 0.00 0.00 31.00 31.24 3fp8 h PRO 13 CO 0.00 0.30 0.36 0.00 -0.23 0.00 0.00 178.00 178.42 3fp8 n LYS 15 N -2.74 2.40 -2.20 0.00 5.02 -1.21 -4.30 118.16 115.13 3fp8 n LYS 15 Ca 0.10 -3.05 -0.26 0.00 -2.02 0.00 0.00 58.31 53.08 3fp8 n LYS 15 Cb 0.52 -1.90 0.09 0.00 -0.02 0.00 0.00 35.03 33.72 3fp8 n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fp8 s ALA 16 N -3.10 3.10 -0.57 7.82 0.00 -0.11 -5.04 121.76 123.86 3fp8 s ALA 16 Ca 0.46 -1.04 0.03 0.00 0.00 0.00 0.00 51.96 51.41 3fp8 s ALA 16 Cb 0.40 -2.57 0.14 0.00 0.00 0.00 0.00 23.12 21.09 3fp8 s ALA 16 CO 0.05 -1.46 0.32 0.50 0.00 0.00 0.00 175.76 175.18 3fp8 s ARG 17 N -5.32 2.15 -0.26 0.00 3.52 -1.26 -4.17 118.95 113.62 3fp8 s ARG 17 Ca 0.62 -2.72 -0.07 0.00 -0.13 0.00 0.00 55.73 53.44 3fp8 s ARG 17 Cb -0.09 -3.41 -0.01 0.00 -1.56 0.00 0.00 34.95 29.88 3fp8 s ARG 17 CO 0.46 -1.14 0.06 0.42 -0.81 0.00 0.00 175.30 174.28 3fp8 s ILE 18 N -0.43 4.07 -0.18 4.11 -1.09 -0.04 -4.95 121.20 122.69 3fp8 s ILE 18 Ca 0.18 -0.37 -0.29 0.00 -2.23 0.00 0.00 60.65 57.94 3fp8 s ILE 18 Cb -0.22 -2.95 -0.00 0.00 -1.58 0.00 0.00 42.46 37.70 3fp8 s ILE 18 CO -0.03 0.28 1.11 -0.63 -1.23 0.00 0.00 174.94 174.44 3fp8 s ILE 19 N 1.56 4.56 0.30 2.92 -1.09 -1.26 -0.11 121.20 128.07 3fp8 s ILE 19 Ca 0.05 1.87 0.03 0.00 -2.23 0.00 0.00 60.65 60.37 3fp8 s ILE 19 Cb -0.16 -4.21 -0.06 0.00 -1.58 0.00 0.00 42.46 36.46 3fp8 s ILE 19 CO 0.02 -0.13 0.07 -0.13 -1.23 0.00 0.00 174.94 173.55 3fp8 s ARG 20 N 3.03 1.55 0.05 2.79 1.81 -0.78 -4.96 118.95 122.44 3fp8 s ARG 20 Ca 0.48 -1.85 0.04 0.00 -1.72 0.00 0.00 55.73 52.68 3fp8 s ARG 20 Cb -0.18 -0.62 -0.04 0.00 -0.45 0.00 0.00 34.95 33.66 3fp8 s ARG 20 CO 0.11 -0.23 -0.02 0.71 -0.68 0.00 0.00 175.30 175.20 3fp8 s TYR 21 N -3.48 2.98 0.03 -0.53 2.02 0.55 -1.03 117.35 117.88 3fp8 s TYR 21 Ca 0.37 -0.01 -0.02 0.00 -0.37 0.00 0.00 57.07 57.04 3fp8 s TYR 21 Cb 0.08 -1.58 -0.02 0.00 -0.40 0.00 0.00 41.96 40.04 3fp8 s TYR 21 CO 0.15 0.45 0.02 -0.59 -1.57 0.00 0.00 175.55 174.00 3fp8 s PHE 22 N -1.17 0.26 -0.19 2.71 -0.71 0.17 -0.35 117.98 118.69 3fp8 s PHE 22 Ca 0.22 -0.57 -0.24 0.00 -1.04 0.00 0.00 56.93 55.31 3fp8 s PHE 22 Cb -0.11 -0.19 -0.02 0.00 -1.21 0.00 0.00 43.02 41.48 3fp8 s PHE 22 CO 0.13 -0.28 0.77 -0.47 -1.34 0.00 0.00 175.22 174.04 3fp8 s TYR 23 N -2.13 3.38 -0.55 3.49 5.04 -1.26 -0.77 117.35 124.55 3fp8 s TYR 23 Ca -0.09 1.13 -0.17 0.00 -2.44 0.00 0.00 57.07 55.50 3fp8 s TYR 23 Cb -0.05 -2.96 0.11 0.00 0.35 0.00 0.00 41.96 39.42 3fp8 s TYR 23 CO -0.03 -0.25 0.55 1.21 -1.34 0.00 0.00 175.55 175.69 3fp8 s ASN 24 N 1.21 6.18 0.27 4.32 3.84 -0.14 -4.80 114.94 125.83 3fp8 s ASN 24 Ca 0.35 -1.60 -0.02 0.00 0.21 0.00 0.00 52.86 51.80 3fp8 s ASN 24 Cb -0.16 -2.24 0.43 0.00 -0.55 0.00 0.00 41.25 38.73 3fp8 s ASN 24 CO 0.11 -0.91 1.88 0.00 -2.79 0.00 0.00 177.10 175.39 3fp8 h ALA 25 N 8.96 1.42 -0.45 1.71 0.00 -1.83 0.22 119.26 129.30 3fp8 h ALA 25 Ca -0.30 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 3fp8 h ALA 25 Cb 1.10 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 3fp8 h ALA 25 CO 1.04 0.43 0.16 1.57 0.00 0.00 0.00 179.25 182.45 3fp8 h LYS 26 N 1.16 0.68 0.00 0.00 -0.00 -1.95 -2.91 116.57 113.55 3fp8 h LYS 26 Ca 0.43 -0.13 -0.07 0.00 -0.00 0.00 0.00 60.65 60.88 3fp8 h LYS 26 Cb 0.18 -0.11 -0.01 0.00 -0.00 0.00 0.00 32.23 32.30 3fp8 h LYS 26 CO -0.17 0.63 -0.32 0.00 -0.00 0.00 0.00 179.45 179.59 3fp8 h ALA 27 N 1.01 0.82 -0.39 0.07 0.00 -1.90 -3.47 119.26 115.40 3fp8 h ALA 27 Ca 0.15 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 3fp8 h ALA 27 Cb 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3fp8 h ALA 27 CO -0.01 0.40 -0.09 0.41 0.00 0.00 0.00 179.25 179.96 3fp8 n GLY 28 N 1.02 0.41 3.68 0.00 0.00 0.75 -5.02 105.19 106.02 3fp8 n GLY 28 Ca 0.02 -0.80 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 3fp8 n GLY 28 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3fp8 s LEU 29 N -0.99 -0.28 0.09 0.99 0.05 -1.10 -5.01 118.68 112.42 3fp8 s LEU 29 Ca 0.00 -0.43 -0.23 0.00 0.05 0.00 0.00 54.13 53.53 3fp8 s LEU 29 Cb 0.00 2.58 -0.07 0.00 -2.05 0.00 0.00 46.19 46.65 3fp8 s LEU 29 CO 0.00 -1.19 0.68 0.00 -0.55 0.00 0.00 176.35 175.29 3fp8 s GLN 31 N -0.78 1.52 0.29 0.00 -0.21 0.05 -4.92 119.66 115.61 3fp8 s GLN 31 Ca 0.33 -1.85 -0.05 0.00 0.02 0.00 0.00 55.36 53.82 3fp8 s GLN 31 Cb -0.21 -0.37 -0.05 0.00 1.00 0.00 0.00 33.01 33.38 3fp8 s GLN 31 CO 0.22 -0.31 0.56 0.95 -2.12 0.00 0.00 175.29 174.58 3fp8 s THR 32 N -3.61 5.02 0.19 -0.19 -4.23 -1.26 -0.66 115.64 110.91 3fp8 s THR 32 Ca 0.36 0.05 -0.14 0.00 -1.18 0.00 0.00 61.69 60.78 3fp8 s THR 32 Cb 0.07 -3.74 0.01 0.00 1.34 0.00 0.00 72.50 70.19 3fp8 s THR 32 CO 0.15 -0.33 0.44 0.72 -0.54 0.00 0.00 174.62 175.06 3fp8 s PHE 33 N -2.09 0.11 -0.35 3.99 -0.71 -0.20 -4.89 117.98 113.84 3fp8 s PHE 33 Ca 0.44 -0.47 -0.18 0.00 -1.04 0.00 0.00 56.93 55.68 3fp8 s PHE 33 Cb -0.11 0.23 -0.00 0.00 -1.21 0.00 0.00 43.02 41.93 3fp8 s PHE 33 CO 0.30 -0.87 0.52 0.08 -1.34 0.00 0.00 175.22 173.91 3fp8 s VAL 34 N -3.93 5.01 -0.13 -2.49 1.01 -1.26 -1.86 120.40 116.75 3fp8 s VAL 34 Ca 0.14 0.33 -0.10 0.00 0.00 0.00 0.00 61.98 62.35 3fp8 s VAL 34 Cb 0.00 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 3fp8 s VAL 34 CO 0.00 -0.24 0.20 -0.47 0.00 0.00 0.00 175.10 174.60 3fp8 s TYR 35 N 2.42 3.54 -0.41 5.22 5.04 0.84 -4.35 117.35 129.65 3fp8 s TYR 35 Ca 0.19 0.56 0.26 0.00 -2.44 0.00 0.00 57.07 55.64 3fp8 s TYR 35 Cb -0.15 -2.12 0.99 0.00 0.35 0.00 0.00 41.96 41.03 3fp8 s TYR 35 CO 0.13 0.52 1.77 0.78 -1.34 0.00 0.00 175.55 177.42 3fp8 h GLY 36 N 5.67 0.00 0.00 8.97 0.00 -0.73 -0.06 103.07 116.92 3fp8 h GLY 36 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3fp8 h GLY 36 CO 0.66 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.81 3fp8 n GLY 37 N 0.33 1.28 3.27 4.60 0.00 -1.26 -0.94 105.19 112.47 3fp8 n GLY 37 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 3fp8 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fp8 n ARG 39 N -0.14 -7.87 -1.88 0.00 5.12 -1.26 -4.47 116.66 106.16 3fp8 n ARG 39 Ca -0.14 0.82 -0.40 0.00 -1.93 0.00 0.00 57.85 56.20 3fp8 n ARG 39 Cb 0.63 -5.88 0.01 0.00 -1.16 0.00 0.00 32.46 26.06 3fp8 n ARG 39 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3fp8 s ALA 40 N -3.32 3.29 0.72 7.54 0.00 -1.26 -4.85 121.76 123.88 3fp8 s ALA 40 Ca 0.57 1.40 -0.02 0.00 0.00 0.00 0.00 51.96 53.91 3fp8 s ALA 40 Cb -0.25 -3.56 0.12 0.00 0.00 0.00 0.00 23.12 19.43 3fp8 s ALA 40 CO 0.73 -1.05 0.99 0.15 0.00 0.00 0.00 175.76 176.58 3fp8 s LYS 41 N -2.33 1.72 0.41 0.00 1.02 -1.26 -5.02 119.74 114.27 3fp8 s LYS 41 Ca 0.58 -1.02 0.22 0.00 0.02 0.00 0.00 55.97 55.77 3fp8 s LYS 41 Cb -0.42 -2.31 0.77 0.00 -0.52 0.00 0.00 37.83 35.34 3fp8 s LYS 41 CO 0.55 -1.43 1.76 0.00 -0.92 0.00 0.00 175.35 175.31 3fp8 h ARG 42 N -0.54 0.00 -3.43 1.68 3.08 -1.96 -3.32 114.38 109.89 3fp8 h ARG 42 Ca -0.38 0.00 -0.72 0.00 0.07 0.00 0.00 59.98 58.95 3fp8 h ARG 42 Cb 1.27 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 31.24 3fp8 h ARG 42 CO 0.42 0.29 2.79 -1.71 -1.07 0.00 0.00 179.97 180.69 3fp8 n ASN 43 N -3.42 5.82 -3.35 7.04 5.15 -1.26 -4.70 115.26 120.54 3fp8 n ASN 43 Ca 0.00 -2.93 -0.03 0.00 -0.60 0.00 0.00 54.58 51.03 3fp8 n ASN 43 Cb 0.48 -1.53 -0.05 0.00 -0.53 0.00 0.00 39.78 38.15 3fp8 n ASN 43 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 3fp8 s ASN 44 N 1.78 -0.68 0.10 1.20 3.84 -1.25 -4.55 114.94 115.38 3fp8 s ASN 44 Ca 0.50 0.78 0.06 0.00 0.21 0.00 0.00 52.86 54.41 3fp8 s ASN 44 Cb 0.14 1.74 -0.03 0.00 -0.55 0.00 0.00 41.25 42.55 3fp8 s ASN 44 CO -0.05 -0.26 -0.16 -0.36 -2.79 0.00 0.00 177.10 173.48 3fp8 s PHE 45 N 2.73 1.41 -1.74 0.43 0.40 0.52 -4.93 117.98 116.81 3fp8 s PHE 45 Ca 0.12 -0.48 0.29 0.00 -0.60 0.00 0.00 56.93 56.26 3fp8 s PHE 45 Cb -0.14 -0.77 1.32 0.00 0.51 0.00 0.00 43.02 43.94 3fp8 s PHE 45 CO -0.18 0.12 1.91 1.63 0.70 0.00 0.00 175.22 179.41 3fp8 n LYS 46 N 0.96 0.78 -3.66 0.44 5.02 -1.26 -0.33 118.16 120.11 3fp8 n LYS 46 Ca -0.19 -0.24 -0.14 0.00 -2.02 0.00 0.00 58.31 55.73 3fp8 n LYS 46 Cb 0.55 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.00 3fp8 n LYS 46 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3fp8 s SER 47 N -2.39 -0.33 0.25 4.39 1.04 -1.26 -4.90 113.70 110.50 3fp8 s SER 47 Ca 0.32 0.17 -0.03 0.00 0.48 0.00 0.00 55.95 56.89 3fp8 s SER 47 Cb 0.20 0.41 0.29 0.00 0.10 0.00 0.00 66.02 67.03 3fp8 s SER 47 CO 0.45 -0.59 1.75 0.00 0.98 0.00 0.00 173.24 175.82 3fp8 h ALA 48 N 3.26 1.07 -0.17 5.32 0.00 -1.97 -2.30 119.26 124.47 3fp8 h ALA 48 Ca -0.30 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3fp8 h ALA 48 Cb 1.18 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3fp8 h ALA 48 CO 0.41 0.59 0.11 1.49 0.00 0.00 0.00 179.25 181.85 3fp8 h GLU 49 N 0.79 0.22 -0.66 0.00 4.22 -1.99 0.06 114.58 117.22 3fp8 h GLU 49 Ca 0.15 -0.01 -0.05 0.00 0.08 0.00 0.00 59.36 59.53 3fp8 h GLU 49 Cb 0.46 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 3fp8 h GLU 49 CO 0.02 0.14 0.20 -0.44 -2.18 0.00 0.00 179.01 176.75 3fp8 h ASP 50 N 0.22 0.94 -0.19 1.04 3.45 -1.95 -0.73 116.42 119.20 3fp8 h ASP 50 Ca 0.06 -0.16 -0.02 0.00 0.43 0.00 0.00 57.03 57.34 3fp8 h ASP 50 Cb -0.02 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 38.49 3fp8 h ASP 50 CO -0.02 0.88 0.04 0.00 -1.57 0.00 0.00 179.24 178.58 3fp8 h MET 52 N 0.12 0.31 -0.53 0.00 2.86 -0.85 0.22 114.93 117.06 3fp8 h MET 52 Ca 0.06 -0.16 -0.05 0.00 -2.06 0.00 0.00 59.70 57.49 3fp8 h MET 52 Cb 0.27 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 3fp8 h MET 52 CO 0.00 0.70 0.12 -0.09 1.06 0.00 0.00 176.91 178.70 3fp8 h ARG 53 N 0.25 0.85 0.17 1.72 1.12 -1.03 0.24 114.38 117.70 3fp8 h ARG 53 Ca 0.02 -0.21 -0.25 0.00 -1.11 0.00 0.00 59.98 58.43 3fp8 h ARG 53 Cb 0.89 -0.11 0.02 0.00 -0.01 0.00 0.00 29.97 30.76 3fp8 h ARG 53 CO 0.07 0.81 -1.14 1.15 -3.11 0.00 0.00 179.97 177.75 3fp8 h THR 54 N 0.74 1.35 -0.01 0.20 2.02 -1.17 -3.39 112.91 112.64 3fp8 h THR 54 Ca 0.16 -2.56 0.00 0.00 0.77 0.00 0.00 66.41 64.78 3fp8 h THR 54 Cb 0.35 3.07 0.00 0.00 -1.74 0.00 0.00 68.15 69.82 3fp8 h THR 54 CO 0.00 0.75 -0.11 0.00 0.37 0.00 0.00 175.52 176.53 3fp8 h GLY 56 N 2.55 0.00 0.00 0.00 0.00 -0.61 -3.48 103.07 101.53 3fp8 h GLY 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fp8 h GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3fp8 n GLY 57 N -1.05 -1.57 0.73 4.60 0.00 -1.26 -5.07 105.19 101.56 3fp8 n GLY 57 Ca -0.03 -1.27 0.09 0.00 0.00 0.00 0.00 46.02 44.82 3fp8 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32