#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f2g s ILE 2 N 0.00 2.78 0.38 0.52 -0.00 -1.26 -2.08 121.20 121.54 1f2g s ILE 2 Ca 0.00 -1.93 0.08 0.00 -0.00 0.00 0.00 60.65 58.80 1f2g s ILE 2 Cb 0.00 -2.84 -0.07 0.00 -0.00 0.00 0.00 42.46 39.56 1f2g s ILE 2 CO 0.00 -0.44 0.02 -1.83 -0.00 0.00 0.00 174.94 172.69 1f2g s GLU 3 N 1.09 2.01 0.27 0.37 -1.05 -0.40 -4.80 118.70 116.20 1f2g s GLU 3 Ca 0.04 -1.94 0.10 0.00 -0.15 0.00 0.00 54.97 53.01 1f2g s GLU 3 Cb -0.21 -1.79 -0.05 0.00 -0.44 0.00 0.00 34.13 31.64 1f2g s GLU 3 CO -0.05 0.02 -0.14 0.54 0.95 0.00 0.00 175.26 176.58 1f2g s VAL 4 N -2.62 2.12 0.14 1.83 0.11 -1.26 -0.78 120.40 119.93 1f2g s VAL 4 Ca 0.36 -2.28 -0.00 0.00 -2.93 0.00 0.00 61.98 57.13 1f2g s VAL 4 Cb 0.05 -2.33 0.03 0.00 -1.53 0.00 0.00 36.38 32.59 1f2g s VAL 4 CO 0.19 -0.39 0.19 0.59 -3.33 0.00 0.00 175.10 172.34 1f2g n ASN 5 N -0.59 0.22 -0.06 3.54 4.13 0.43 -4.93 115.26 117.99 1f2g n ASN 5 Ca -0.06 -1.19 -0.03 0.00 1.68 0.00 0.00 54.58 54.98 1f2g n ASN 5 Cb 0.61 -0.12 -0.13 0.00 -1.54 0.00 0.00 39.78 38.60 1f2g n ASN 5 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1f2g n ASP 6 N -3.00 0.99 0.32 6.41 2.03 -1.26 -4.25 116.55 117.80 1f2g n ASP 6 Ca 0.03 0.00 0.21 0.00 0.52 0.00 0.00 54.79 55.55 1f2g n ASP 6 Cb 0.11 1.15 1.09 0.00 -0.72 0.00 0.00 41.12 42.74 1f2g n ASP 6 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 1f2g h ASP 7 N 0.00 0.00 -2.95 1.67 3.58 -1.97 -3.43 116.42 113.33 1f2g h ASP 7 Ca -0.32 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 56.56 1f2g h ASP 7 Cb 1.67 0.00 0.09 0.00 1.72 0.00 0.00 39.33 42.82 1f2g h ASP 7 CO 0.02 0.00 0.58 0.00 -2.88 0.00 0.00 179.24 176.96 1f2g n MET 9 N 1.44 0.40 -0.92 0.00 2.81 -1.26 -4.99 117.12 114.60 1f2g n MET 9 Ca 0.09 -0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1f2g n MET 9 Cb 0.34 -1.55 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 1f2g n MET 9 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1f2g n ALA 10 N -1.95 -0.93 -0.04 3.04 0.00 -1.26 -4.90 120.51 114.47 1f2g n ALA 10 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1f2g n ALA 10 Cb 0.47 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 1f2g n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f2g n GLU 12 N -4.04 0.00 -0.01 0.00 -0.00 -1.26 -4.95 120.64 110.38 1f2g n GLU 12 Ca -0.07 0.00 -0.13 0.00 -0.00 0.00 0.00 57.16 56.97 1f2g n GLU 12 Cb 0.67 -1.44 -0.09 0.00 -0.00 0.00 0.00 31.44 30.58 1f2g n GLU 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1f2g h ALA 13 N 0.00 0.00 -0.12 -1.84 0.00 -1.94 0.24 119.26 115.60 1f2g h ALA 13 Ca 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1f2g h ALA 13 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1f2g h ALA 13 CO 0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 179.25 178.92 1f2g h VAL 15 N 0.17 1.46 0.00 0.00 2.07 -1.66 0.30 116.25 118.59 1f2g h VAL 15 Ca 0.04 -2.30 0.00 0.00 0.82 0.00 0.00 66.70 65.26 1f2g h VAL 15 Cb 0.20 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1f2g h VAL 15 CO 0.01 0.66 -0.22 1.21 0.02 0.00 0.00 177.57 179.25 1f2g n GLU 16 N -3.76 0.11 -0.10 1.57 2.13 0.81 -1.52 120.64 119.89 1f2g n GLU 16 Ca -0.02 0.07 -0.12 0.00 0.66 0.00 0.00 57.16 57.74 1f2g n GLU 16 Cb 0.68 -1.60 -0.15 0.00 0.27 0.00 0.00 31.44 30.64 1f2g n GLU 16 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1f2g n ILE 17 N -1.79 1.45 -2.92 6.31 0.00 0.73 -4.83 119.36 118.32 1f2g n ILE 17 Ca 0.06 -0.77 -0.02 0.00 0.00 0.00 0.00 62.75 62.02 1f2g n ILE 17 Cb 0.38 -0.82 0.00 0.00 0.00 0.00 0.00 39.64 39.20 1f2g n ILE 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1f2g n PRO 19 N 3.48 0.75 -0.00 0.00 -0.04 -0.58 -1.58 135.00 137.03 1f2g n PRO 19 Ca 0.15 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.71 1f2g n PRO 19 Cb 0.57 -1.23 -0.13 0.00 -0.04 0.00 0.00 33.50 32.66 1f2g n PRO 19 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1f2g n ASP 20 N -0.73 0.74 -0.04 3.54 2.03 -1.26 -4.35 116.55 116.48 1f2g n ASP 20 Ca 0.08 -0.74 -0.04 0.00 0.52 0.00 0.00 54.79 54.61 1f2g n ASP 20 Cb 0.04 1.26 -0.06 0.00 -0.72 0.00 0.00 41.12 41.63 1f2g n ASP 20 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1f2g n VAL 21 N -1.69 0.55 -3.74 5.18 0.31 -0.80 -3.51 118.33 114.63 1f2g n VAL 21 Ca 0.02 -0.33 -0.16 0.00 -0.01 0.00 0.00 64.34 63.87 1f2g n VAL 21 Cb 0.39 -0.80 -0.16 0.00 -0.91 0.00 0.00 33.84 32.36 1f2g n VAL 21 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1f2g s PHE 22 N -2.19 -0.01 0.05 3.52 0.08 -0.62 -1.41 117.98 117.40 1f2g s PHE 22 Ca -0.05 0.25 -0.02 0.00 0.12 0.00 0.00 56.93 57.22 1f2g s PHE 22 Cb 0.02 -0.26 -0.03 0.00 -0.57 0.00 0.00 43.02 42.18 1f2g s PHE 22 CO 0.32 -0.13 0.02 -2.00 -0.10 0.00 0.00 175.22 173.32 1f2g s GLU 23 N 1.38 0.61 0.45 0.44 2.12 0.21 -4.03 118.70 119.88 1f2g s GLU 23 Ca -0.06 -1.07 -0.25 0.00 0.36 0.00 0.00 54.97 53.96 1f2g s GLU 23 Cb -0.12 0.22 -0.08 0.00 0.26 0.00 0.00 34.13 34.41 1f2g s GLU 23 CO -0.04 -0.13 1.34 -1.64 -0.54 0.00 0.00 175.26 174.25 1f2g s MET 24 N -3.52 3.74 0.00 4.30 -1.94 -1.26 0.31 119.30 120.92 1f2g s MET 24 Ca 0.03 2.22 0.00 0.00 -1.71 0.00 0.00 55.69 56.23 1f2g s MET 24 Cb 0.05 -2.62 0.00 0.00 2.01 0.00 0.00 34.83 34.27 1f2g s MET 24 CO -0.09 -0.71 0.00 0.27 -0.01 0.00 0.00 175.02 174.49 1f2g n ASN 25 N -0.20 0.00 0.06 3.03 6.94 0.65 -4.69 115.26 121.05 1f2g n ASN 25 Ca 0.05 0.00 -0.11 0.00 -0.02 0.00 0.00 54.58 54.50 1f2g n ASN 25 Cb 0.44 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.78 1f2g n ASN 25 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1f2g h GLU 26 N 0.00 -0.21 0.00 -3.83 4.81 -1.95 -3.06 114.58 110.34 1f2g h GLU 26 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1f2g h GLU 26 Cb 0.00 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1f2g h GLU 26 CO 0.00 0.22 0.00 0.39 -0.73 0.00 0.00 179.01 178.89 1f2g n GLU 27 N -4.94 0.34 -2.90 1.92 -0.58 -1.26 -4.85 120.64 108.37 1f2g n GLU 27 Ca -0.08 0.08 -0.21 0.00 -0.42 0.00 0.00 57.16 56.54 1f2g n GLU 27 Cb 0.27 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.67 1f2g n GLU 27 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1f2g n GLY 28 N 0.38 -0.44 0.00 0.62 0.00 -1.16 -4.84 105.19 99.75 1f2g n GLY 28 Ca 0.10 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1f2g n GLY 28 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1f2g n ASP 29 N -2.17 0.68 -3.75 1.61 2.03 -1.26 -4.82 116.55 108.87 1f2g n ASP 29 Ca -0.12 -0.91 -0.25 0.00 0.52 0.00 0.00 54.79 54.03 1f2g n ASP 29 Cb 0.62 0.12 -0.17 0.00 -0.72 0.00 0.00 41.12 40.97 1f2g n ASP 29 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1f2g s LYS 30 N -0.12 0.64 -0.64 -0.67 2.47 -1.26 -4.67 119.74 115.49 1f2g s LYS 30 Ca 0.00 -0.14 -0.27 0.00 -1.56 0.00 0.00 55.97 54.00 1f2g s LYS 30 Cb 0.00 -1.53 -0.01 0.00 -1.46 0.00 0.00 37.83 34.83 1f2g s LYS 30 CO 0.00 -0.46 1.71 0.00 0.16 0.00 0.00 175.35 176.76 1f2g s ALA 31 N 1.92 2.32 0.45 3.13 0.00 -1.26 0.24 121.76 128.55 1f2g s ALA 31 Ca 0.02 -0.83 0.05 0.00 0.00 0.00 0.00 51.96 51.20 1f2g s ALA 31 Cb -0.14 -4.29 0.01 0.00 0.00 0.00 0.00 23.12 18.69 1f2g s ALA 31 CO -0.07 -3.74 0.63 0.08 0.00 0.00 0.00 175.76 172.66 1f2g s VAL 32 N 8.23 3.25 0.08 0.00 1.01 0.15 -4.86 120.40 128.27 1f2g s VAL 32 Ca 0.59 -0.82 -0.12 0.00 0.00 0.00 0.00 61.98 61.63 1f2g s VAL 32 Cb -0.11 -3.15 -0.06 0.00 0.00 0.00 0.00 36.38 33.06 1f2g s VAL 32 CO 0.19 -0.08 0.45 -0.69 0.00 0.00 0.00 175.10 174.97 1f2g s VAL 33 N -2.47 5.01 -0.06 2.92 1.01 -1.26 -0.62 120.40 124.92 1f2g s VAL 33 Ca 0.53 0.64 0.04 0.00 0.00 0.00 0.00 61.98 63.19 1f2g s VAL 33 Cb -0.10 -3.69 -0.06 0.00 0.00 0.00 0.00 36.38 32.53 1f2g s VAL 33 CO 0.35 0.33 -0.00 2.30 0.00 0.00 0.00 175.10 178.08 1f2g n ILE 34 N 1.05 0.38 -3.70 2.22 -5.35 -0.50 -4.84 119.36 108.62 1f2g n ILE 34 Ca -0.08 -0.21 -0.38 0.00 -0.27 0.00 0.00 62.75 61.81 1f2g n ILE 34 Cb 0.52 -0.83 -0.10 0.00 -1.74 0.00 0.00 39.64 37.50 1f2g n ILE 34 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1f2g s ASN 35 N -3.94 5.40 0.00 7.28 3.84 -1.17 -4.93 114.94 121.42 1f2g s ASN 35 Ca -0.04 -2.29 0.00 0.00 0.21 0.00 0.00 52.86 50.73 1f2g s ASN 35 Cb 0.02 -1.89 0.00 0.00 -0.55 0.00 0.00 41.25 38.83 1f2g s ASN 35 CO 0.21 -0.52 0.55 -0.81 -2.79 0.00 0.00 177.10 173.73 1f2g n PRO 36 N 4.29 0.75 -1.38 0.43 -0.04 -1.26 -2.63 135.00 135.15 1f2g n PRO 36 Ca 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.46 1f2g n PRO 36 Cb 0.40 -1.26 0.01 0.00 -0.04 0.00 0.00 33.50 32.62 1f2g n PRO 36 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1f2g n ASP 37 N 0.36 -0.28 0.00 3.54 2.03 -1.26 -4.59 116.55 116.35 1f2g n ASP 37 Ca 0.00 -0.99 0.00 0.00 0.52 0.00 0.00 54.79 54.32 1f2g n ASP 37 Cb 0.27 0.12 0.00 0.00 -0.72 0.00 0.00 41.12 40.79 1f2g n ASP 37 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1f2g n SER 38 N -0.23 0.00 0.00 1.67 2.88 -1.08 -4.75 113.62 112.11 1f2g n SER 38 Ca -0.05 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 1f2g n SER 38 Cb 0.51 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 1f2g n SER 38 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1f2g n ASP 39 N -0.95 -2.08 -4.33 -3.46 2.03 -1.26 -5.05 116.55 101.45 1f2g n ASP 39 Ca 0.00 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.07 1f2g n ASP 39 Cb 0.00 -0.35 -0.12 0.00 -0.72 0.00 0.00 41.12 39.93 1f2g n ASP 39 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 1f2g s LEU 40 N 0.00 2.38 0.43 -2.67 0.05 -1.26 -4.99 118.68 112.62 1f2g s LEU 40 Ca 0.00 -0.80 0.26 0.00 0.05 0.00 0.00 54.13 53.65 1f2g s LEU 40 Cb 0.00 -0.92 1.43 0.00 -2.05 0.00 0.00 46.19 44.65 1f2g s LEU 40 CO 0.00 0.03 1.79 -0.78 -0.55 0.00 0.00 176.35 176.84 1f2g h ASP 41 N 3.56 0.00 -1.08 1.48 3.58 -2.01 -2.08 116.42 119.87 1f2g h ASP 41 Ca -0.45 0.00 0.39 0.00 0.42 0.00 0.00 57.03 57.40 1f2g h ASP 41 Cb 1.20 0.00 -0.16 0.00 1.72 0.00 0.00 39.33 42.09 1f2g h ASP 41 CO 0.46 0.00 0.62 0.00 -2.88 0.00 0.00 179.24 177.44 1f2g h VAL 43 N 0.12 1.10 -0.43 0.00 2.07 -1.77 1.69 116.25 119.04 1f2g h VAL 43 Ca 0.81 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 68.07 1f2g h VAL 43 Cb 2.16 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 33.03 1f2g h VAL 43 CO -0.64 0.09 0.21 -0.33 0.02 0.00 0.00 177.57 176.92 1f2g h GLU 44 N 0.03 0.41 0.00 1.57 5.08 0.24 0.48 114.58 122.38 1f2g h GLU 44 Ca 0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1f2g h GLU 44 Cb 0.10 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1f2g h GLU 44 CO -0.00 0.27 0.00 1.05 -1.00 0.00 0.00 179.01 179.33 1f2g h GLU 45 N 0.42 0.00 0.00 2.33 4.11 -0.48 -0.33 114.58 120.63 1f2g h GLU 45 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.62 1f2g h GLU 45 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1f2g h GLU 45 CO -0.14 0.00 -0.66 0.00 0.07 0.00 0.00 179.01 178.29 1f2g h ALA 46 N 2.44 0.57 0.01 1.06 0.00 0.43 -3.13 119.26 120.65 1f2g h ALA 46 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.50 1f2g h ALA 46 Cb 0.68 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 1f2g h ALA 46 CO 0.00 0.00 -2.43 -0.89 0.00 0.00 0.00 179.25 175.93 1f2g n ILE 47 N -2.17 1.53 0.27 0.00 5.41 0.15 -3.30 119.36 121.25 1f2g n ILE 47 Ca 0.03 -0.48 0.13 0.00 1.00 0.00 0.00 62.75 63.43 1f2g n ILE 47 Cb 0.45 -1.65 0.64 0.00 -0.71 0.00 0.00 39.64 38.38 1f2g n ILE 47 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1f2g h ASP 48 N -0.43 0.00 0.03 4.38 3.58 -1.21 0.88 116.42 123.65 1f2g h ASP 48 Ca -0.61 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.84 1f2g h ASP 48 Cb 1.77 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.82 1f2g h ASP 48 CO -0.22 0.00 -1.58 -1.20 -2.88 0.00 0.00 179.24 173.36 1f2g n SER 49 N -2.42 0.40 -4.56 2.28 7.64 -1.18 -4.84 113.62 110.94 1f2g n SER 49 Ca -0.00 -0.37 -0.43 0.00 1.01 0.00 0.00 58.87 59.08 1f2g n SER 49 Cb 0.12 1.56 -0.05 0.00 -1.01 0.00 0.00 64.21 64.83 1f2g n SER 49 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1f2g h PRO 51 N 8.74 0.27 -0.00 0.00 0.13 -1.88 -2.85 132.00 136.40 1f2g h PRO 51 Ca -0.25 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1f2g h PRO 51 Cb 1.09 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1f2g h PRO 51 CO 0.92 0.95 -0.08 0.00 -0.23 0.00 0.00 178.00 179.57 1f2g n ALA 52 N -2.48 2.61 -3.72 -0.56 0.00 -1.26 -4.90 120.51 110.20 1f2g n ALA 52 Ca -0.04 -0.18 -0.26 0.00 0.00 0.00 0.00 53.44 52.96 1f2g n ALA 52 Cb 0.77 -1.41 -0.06 0.00 0.00 0.00 0.00 19.45 18.74 1f2g n ALA 52 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1f2g n GLU 53 N -1.27 -0.88 0.08 0.00 1.02 -1.08 -4.70 120.64 113.80 1f2g n GLU 53 Ca 0.12 0.08 0.13 0.00 -0.02 0.00 0.00 57.16 57.46 1f2g n GLU 53 Cb 0.29 -2.90 0.46 0.00 -0.02 0.00 0.00 31.44 29.27 1f2g n GLU 53 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1f2g n ALA 54 N -3.29 2.19 -2.58 0.62 0.00 -1.26 -4.60 120.51 111.58 1f2g n ALA 54 Ca -0.09 -0.03 -0.43 0.00 0.00 0.00 0.00 53.44 52.90 1f2g n ALA 54 Cb 0.41 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.36 1f2g n ALA 54 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1f2g s ILE 55 N -3.10 4.61 0.16 0.00 2.07 -1.26 -0.43 121.20 123.25 1f2g s ILE 55 Ca 0.10 0.31 0.06 0.00 -1.41 0.00 0.00 60.65 59.71 1f2g s ILE 55 Cb 0.13 -4.37 -0.04 0.00 0.13 0.00 0.00 42.46 38.32 1f2g s ILE 55 CO 0.54 -0.81 0.05 0.68 -1.91 0.00 0.00 174.94 173.50 1f2g s VAL 56 N 3.37 4.07 -0.80 4.00 -7.23 0.04 -4.97 120.40 118.88 1f2g s VAL 56 Ca 0.29 -1.23 -0.00 0.00 -1.81 0.00 0.00 61.98 59.22 1f2g s VAL 56 Cb -0.13 -3.05 0.36 0.00 0.56 0.00 0.00 36.38 34.12 1f2g s VAL 56 CO 0.21 -0.08 1.80 0.54 -0.31 0.00 0.00 175.10 177.26 1f2g n ARG 57 N -0.13 3.31 0.00 4.82 1.74 -1.26 -1.28 116.66 123.87 1f2g n ARG 57 Ca -0.09 -3.92 0.00 0.00 -0.77 0.00 0.00 57.85 53.07 1f2g n ARG 57 Cb 0.55 -2.30 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 1f2g n ARG 57 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56