#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f2g n ILE 2 N 0.00 0.00 -4.07 0.52 -0.00 -1.26 -4.89 119.36 109.66 1f2g n ILE 2 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 62.75 62.62 1f2g n ILE 2 Cb 0.00 -0.49 -0.11 0.00 -0.00 0.00 0.00 39.64 39.03 1f2g n ILE 2 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 1f2g s GLU 3 N -3.65 0.55 -0.31 6.28 2.56 0.42 -4.98 118.70 119.57 1f2g s GLU 3 Ca 0.33 -0.77 0.06 0.00 0.00 0.00 0.00 54.97 54.60 1f2g s GLU 3 Cb -0.06 -0.33 0.19 0.00 2.00 0.00 0.00 34.13 35.93 1f2g s GLU 3 CO 0.28 0.06 0.57 0.54 -0.56 0.00 0.00 175.26 176.15 1f2g s VAL 4 N -1.36 -0.94 0.28 3.70 0.11 -1.26 -1.38 120.40 119.55 1f2g s VAL 4 Ca -0.09 -0.06 -0.04 0.00 -2.93 0.00 0.00 61.98 58.86 1f2g s VAL 4 Cb -0.10 -0.81 0.06 0.00 -1.53 0.00 0.00 36.38 34.01 1f2g s VAL 4 CO 0.01 -0.05 0.14 -0.46 -3.33 0.00 0.00 175.10 171.41 1f2g n ASN 5 N 5.20 -1.90 -0.09 3.54 0.23 -1.12 -4.96 115.26 116.15 1f2g n ASN 5 Ca 0.06 -0.15 -0.11 0.00 -0.53 0.00 0.00 54.58 53.85 1f2g n ASN 5 Cb 0.54 -0.20 -0.13 0.00 -2.08 0.00 0.00 39.78 37.91 1f2g n ASN 5 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1f2g n ASP 6 N -2.33 1.14 -0.62 0.53 5.68 -1.26 -4.35 116.55 115.34 1f2g n ASP 6 Ca 0.02 -0.04 0.48 0.00 -0.50 0.00 0.00 54.79 54.76 1f2g n ASP 6 Cb 0.10 0.55 0.75 0.00 -1.14 0.00 0.00 41.12 41.38 1f2g n ASP 6 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1f2g n ASP 7 N -2.80 0.05 -4.46 -1.12 8.00 -1.26 -4.40 116.55 110.56 1f2g n ASP 7 Ca -0.32 1.06 -0.35 0.00 0.71 0.00 0.00 54.79 55.89 1f2g n ASP 7 Cb 1.03 -0.52 0.10 0.00 -0.02 0.00 0.00 41.12 41.70 1f2g n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1f2g n MET 9 N -1.34 0.00 0.00 0.00 2.81 -1.26 -5.01 117.12 112.31 1f2g n MET 9 Ca 0.09 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.98 1f2g n MET 9 Cb 0.51 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.02 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 -1.86 0.00 -0.11 3.04 0.00 -1.26 -4.09 120.51 116.24 1f2g n ALA 10 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1f2g n ALA 10 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 -4.06 -0.11 -0.02 0.00 2.13 -1.26 -4.90 120.64 112.42 1f2g n GLU 12 Ca -0.03 0.03 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 1f2g n GLU 12 Cb 0.56 -3.00 -0.09 0.00 0.27 0.00 0.00 31.44 29.19 1f2g n GLU 12 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1f2g h ALA 13 N 0.00 0.07 -0.17 4.31 0.00 -1.96 0.34 119.26 121.85 1f2g h ALA 13 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1f2g h ALA 13 Cb 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1f2g h ALA 13 CO 0.00 -0.17 0.02 0.00 0.00 0.00 0.00 179.25 179.10 1f2g h VAL 15 N 0.23 1.54 -0.00 0.00 2.07 -1.67 0.46 116.25 118.88 1f2g h VAL 15 Ca 0.06 -2.67 0.00 0.00 0.82 0.00 0.00 66.70 64.91 1f2g h VAL 15 Cb 0.12 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1f2g h VAL 15 CO -0.00 0.77 -0.03 1.21 0.02 0.00 0.00 177.57 179.54 1f2g n GLU 16 N -3.62 0.25 -0.04 1.57 4.07 0.12 -1.06 120.64 121.92 1f2g n GLU 16 Ca -0.02 -0.02 -0.03 0.00 -0.06 0.00 0.00 57.16 57.03 1f2g n GLU 16 Cb 0.77 -1.50 -0.08 0.00 -0.06 0.00 0.00 31.44 30.58 1f2g n GLU 16 CO 0.00 0.00 0.00 1.51 -0.06 0.00 0.00 177.13 178.58 1f2g n ILE 17 N -1.36 0.58 -3.00 6.31 0.00 0.03 -4.83 119.36 117.09 1f2g n ILE 17 Ca 0.11 -0.39 -0.15 0.00 0.00 0.00 0.00 62.75 62.32 1f2g n ILE 17 Cb 0.29 -0.61 -0.02 0.00 0.00 0.00 0.00 39.64 39.30 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 2.25 0.75 -0.00 0.00 -0.04 -0.23 -0.98 135.00 136.76 1f2g n PRO 19 Ca 0.19 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.73 1f2g n PRO 19 Cb 0.55 -1.21 -0.11 0.00 -0.04 0.00 0.00 33.50 32.69 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 -0.71 0.88 -0.02 3.54 -0.08 -1.26 -4.41 116.55 114.49 1f2g n ASP 20 Ca 0.08 -0.56 0.00 0.00 -1.51 0.00 0.00 54.79 52.80 1f2g n ASP 20 Cb 0.03 1.30 -0.06 0.00 2.34 0.00 0.00 41.12 44.74 1f2g n ASP 20 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1f2g n VAL 21 N -1.66 0.23 -3.68 5.18 0.31 -0.77 -3.04 118.33 114.89 1f2g n VAL 21 Ca 0.01 -0.24 -0.14 0.00 -0.01 0.00 0.00 64.34 63.96 1f2g n VAL 21 Cb 0.33 -0.21 -0.14 0.00 -0.91 0.00 0.00 33.84 32.91 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 -2.36 -0.33 -0.03 3.52 0.08 -0.15 -1.59 117.98 117.12 1f2g s PHE 22 Ca -0.03 0.81 0.02 0.00 0.12 0.00 0.00 56.93 57.85 1f2g s PHE 22 Cb 0.04 -0.08 0.01 0.00 -0.57 0.00 0.00 43.02 42.42 1f2g s PHE 22 CO 0.31 -0.30 -0.06 -2.00 -0.10 0.00 0.00 175.22 173.07 1f2g s GLU 23 N 2.06 0.78 0.44 0.44 2.12 0.12 -3.99 118.70 120.67 1f2g s GLU 23 Ca -0.01 -0.19 -0.14 0.00 0.36 0.00 0.00 54.97 54.99 1f2g s GLU 23 Cb -0.12 -0.76 -0.11 0.00 0.26 0.00 0.00 34.13 33.40 1f2g s GLU 23 CO -0.08 0.03 -0.17 -1.33 -0.54 0.00 0.00 175.26 173.17 1f2g n MET 24 N 3.54 0.00 0.00 4.30 2.81 -1.26 -0.71 117.12 125.80 1f2g n MET 24 Ca -0.20 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.69 1f2g n MET 24 Cb 0.53 -0.77 0.00 0.00 -0.71 0.00 0.00 33.22 32.28 1f2g n MET 24 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1f2g n ASN 25 N 2.03 0.00 0.15 7.83 5.15 0.50 -4.41 115.26 126.51 1f2g n ASN 25 Ca 0.05 0.00 0.09 0.00 -0.60 0.00 0.00 54.58 54.12 1f2g n ASN 25 Cb 0.37 0.00 0.07 0.00 -0.53 0.00 0.00 39.78 39.69 1f2g n ASN 25 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1f2g h GLU 26 N 0.00 0.00 0.00 1.20 4.22 -1.92 -3.36 114.58 114.72 1f2g h GLU 26 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1f2g h GLU 26 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1f2g h GLU 26 CO 0.00 0.13 -0.21 0.39 -2.18 0.00 0.00 179.01 177.15 1f2g n GLU 27 N -3.00 0.00 -0.83 1.92 1.02 -1.26 -4.97 120.64 113.52 1f2g n GLU 27 Ca 0.01 -0.59 0.00 0.00 -0.02 0.00 0.00 57.16 56.56 1f2g n GLU 27 Cb 0.61 -0.38 0.00 0.00 -0.02 0.00 0.00 31.44 31.64 1f2g n GLU 27 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1f2g n GLY 28 N 0.00 0.55 0.34 0.62 0.00 -1.26 -4.90 105.19 100.54 1f2g n GLY 28 Ca 0.00 -0.32 0.21 0.00 0.00 0.00 0.00 46.02 45.91 1f2g n GLY 28 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1f2g h ASP 29 N 0.00 0.00 -4.54 1.61 3.58 -1.89 -3.44 116.42 111.74 1f2g h ASP 29 Ca 0.00 0.00 0.32 0.00 0.42 0.00 0.00 57.03 57.77 1f2g h ASP 29 Cb 0.00 0.00 -0.18 0.00 1.72 0.00 0.00 39.33 40.87 1f2g h ASP 29 CO 0.00 0.00 0.93 -1.59 -2.88 0.00 0.00 179.24 175.70 1f2g s LYS 30 N -4.20 0.13 -0.54 0.28 -2.85 -1.26 -4.78 119.74 106.52 1f2g s LYS 30 Ca -0.05 -0.06 -0.24 0.00 -1.00 0.00 0.00 55.97 54.63 1f2g s LYS 30 Cb 0.13 0.06 0.04 0.00 -2.06 0.00 0.00 37.83 35.99 1f2g s LYS 30 CO 0.41 -0.06 0.93 0.00 0.10 0.00 0.00 175.35 176.73 1f2g s ALA 31 N -2.17 3.17 0.46 0.59 0.00 -1.26 0.19 121.76 122.74 1f2g s ALA 31 Ca 0.12 -1.23 -0.17 0.00 0.00 0.00 0.00 51.96 50.68 1f2g s ALA 31 Cb 0.01 -3.71 -0.09 0.00 0.00 0.00 0.00 23.12 19.33 1f2g s ALA 31 CO -0.04 -2.35 0.93 0.08 0.00 0.00 0.00 175.76 174.38 1f2g s VAL 32 N 3.88 4.54 0.02 0.00 1.01 0.11 -4.78 120.40 125.17 1f2g s VAL 32 Ca 0.30 1.20 -0.21 0.00 0.00 0.00 0.00 61.98 63.27 1f2g s VAL 32 Cb -0.13 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 1f2g s VAL 32 CO 0.19 -0.52 0.61 -0.69 0.00 0.00 0.00 175.10 174.70 1f2g s VAL 33 N -2.41 4.85 -0.06 2.92 1.01 -1.26 0.15 120.40 125.60 1f2g s VAL 33 Ca 0.58 1.29 0.06 0.00 0.00 0.00 0.00 61.98 63.92 1f2g s VAL 33 Cb -0.10 -3.95 -0.09 0.00 0.00 0.00 0.00 36.38 32.24 1f2g s VAL 33 CO 0.25 0.44 0.04 2.30 0.00 0.00 0.00 175.10 178.13 1f2g n ILE 34 N 2.52 0.43 -3.73 2.22 -5.35 -0.62 -4.84 119.36 110.00 1f2g n ILE 34 Ca -0.07 -0.29 -0.36 0.00 -0.27 0.00 0.00 62.75 61.76 1f2g n ILE 34 Cb 0.51 -0.69 -0.10 0.00 -1.74 0.00 0.00 39.64 37.62 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 -3.76 5.19 0.00 7.28 3.84 -1.17 -4.92 114.94 121.40 1f2g s ASN 35 Ca -0.03 -2.88 0.00 0.00 0.21 0.00 0.00 52.86 50.15 1f2g s ASN 35 Cb 0.02 -1.84 0.00 0.00 -0.55 0.00 0.00 41.25 38.88 1f2g s ASN 35 CO 0.29 -0.36 0.59 -0.81 -2.79 0.00 0.00 177.10 174.03 1f2g n PRO 36 N 3.44 0.75 -1.70 0.43 -0.04 -1.26 -2.61 135.00 134.01 1f2g n PRO 36 Ca 0.08 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.53 1f2g n PRO 36 Cb 0.37 -1.23 0.03 0.00 -0.04 0.00 0.00 33.50 32.64 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 0.42 -0.42 0.00 3.54 2.03 -1.26 -3.98 116.55 116.89 1f2g n ASP 37 Ca 0.00 -1.26 0.00 0.00 0.52 0.00 0.00 54.79 54.05 1f2g n ASP 37 Cb 0.30 0.19 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 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 -0.40 0.00 0.00 1.67 2.88 -1.07 -4.82 113.62 111.88 1f2g n SER 38 Ca -0.06 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1f2g n SER 38 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 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 -0.16 -1.86 -4.76 -3.46 2.03 -1.26 -5.05 116.55 102.03 1f2g n ASP 39 Ca 0.00 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 54.99 1f2g n ASP 39 Cb 0.00 -0.46 -0.07 0.00 -0.72 0.00 0.00 41.12 39.87 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 -0.61 -2.67 0.05 -1.26 -5.03 118.68 111.54 1f2g s LEU 40 Ca 0.00 -1.59 -0.03 0.00 0.05 0.00 0.00 54.13 52.56 1f2g s LEU 40 Cb 0.00 -0.79 0.19 0.00 -2.05 0.00 0.00 46.19 43.54 1f2g s LEU 40 CO 0.00 -0.84 2.43 -0.67 -0.55 0.00 0.00 176.35 176.72 1f2g n ASP 41 N -1.28 6.93 -0.01 1.48 2.03 -1.26 -3.96 116.55 120.48 1f2g n ASP 41 Ca -0.17 -3.47 -0.00 0.00 0.52 0.00 0.00 54.79 51.68 1f2g n ASP 41 Cb 0.67 -1.15 -0.04 0.00 -0.72 0.00 0.00 41.12 39.88 1f2g n ASP 41 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1f2g h VAL 43 N 0.00 1.41 -0.09 0.00 2.07 -1.97 0.83 116.25 118.50 1f2g h VAL 43 Ca -0.07 -2.20 -0.14 0.00 0.82 0.00 0.00 66.70 65.11 1f2g h VAL 43 Cb 0.82 2.16 -0.01 0.00 -1.52 0.00 0.00 31.29 32.74 1f2g h VAL 43 CO 0.00 0.65 -0.56 -0.08 0.02 0.00 0.00 177.57 177.60 1f2g h GLU 44 N 0.19 0.28 0.00 1.57 4.81 -1.83 0.11 114.58 119.72 1f2g h GLU 44 Ca -0.02 -0.18 -0.04 0.00 -0.13 0.00 0.00 59.36 58.99 1f2g h GLU 44 Cb 1.27 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 1f2g h GLU 44 CO 0.11 0.77 -1.21 -0.85 -0.73 0.00 0.00 179.01 177.10 1f2g n GLU 45 N -3.91 0.62 0.07 1.92 0.28 -1.15 -2.52 120.64 115.95 1f2g n GLU 45 Ca -0.02 0.10 -0.03 0.00 -0.16 0.00 0.00 57.16 57.05 1f2g n GLU 45 Cb 0.59 -1.79 -0.07 0.00 1.43 0.00 0.00 31.44 31.61 1f2g n GLU 45 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1f2g h ALA 46 N 1.88 0.55 0.03 -1.84 0.00 0.82 -2.55 119.26 118.16 1f2g h ALA 46 Ca -0.04 -0.81 -0.10 0.00 0.00 0.00 0.00 54.91 53.96 1f2g h ALA 46 Cb 1.13 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1f2g h ALA 46 CO 0.01 1.03 -0.53 0.82 0.00 0.00 0.00 179.25 180.58 1f2g h ILE 47 N 0.00 1.49 -0.85 0.00 2.04 -0.88 -2.46 117.51 116.85 1f2g h ILE 47 Ca -0.06 -2.34 0.05 0.00 1.00 0.00 0.00 64.86 63.50 1f2g h ILE 47 Cb 1.64 3.05 -0.05 0.00 -0.74 0.00 0.00 36.82 40.72 1f2g h ILE 47 CO 0.09 0.57 0.56 -0.78 0.00 0.00 0.00 178.15 178.59 1f2g h ASP 48 N -0.85 0.88 1.35 1.72 1.82 -1.61 0.17 116.42 119.91 1f2g h ASP 48 Ca -0.13 -0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.48 1f2g h ASP 48 Cb 1.23 -0.19 -0.00 0.00 0.68 0.00 0.00 39.33 41.04 1f2g h ASP 48 CO -0.02 0.59 -0.15 0.28 -1.61 0.00 0.00 179.24 178.33 1f2g h SER 49 N 1.01 0.00 -3.55 2.28 0.02 -1.56 -3.41 113.55 108.34 1f2g h SER 49 Ca 0.35 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 60.68 1f2g h SER 49 Cb 0.11 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 62.53 1f2g h SER 49 CO -0.11 0.15 0.34 0.00 -1.14 0.00 0.00 176.83 176.06 1f2g h PRO 51 N 8.56 0.03 -0.00 0.00 0.13 -1.81 -2.75 132.00 136.16 1f2g h PRO 51 Ca -0.25 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1f2g h PRO 51 Cb 1.09 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1f2g h PRO 51 CO 0.91 0.78 -0.05 0.00 -0.23 0.00 0.00 178.00 179.41 1f2g n ALA 52 N -2.41 2.56 -3.55 -0.56 0.00 -1.26 -4.90 120.51 110.39 1f2g n ALA 52 Ca -0.01 -0.17 -0.19 0.00 0.00 0.00 0.00 53.44 53.07 1f2g n ALA 52 Cb 0.73 -1.44 -0.06 0.00 0.00 0.00 0.00 19.45 18.69 1f2g n ALA 52 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1f2g n GLU 53 N -1.29 -0.95 0.18 0.00 0.00 -1.04 -4.72 120.64 112.83 1f2g n GLU 53 Ca 0.12 0.06 0.07 0.00 0.00 0.00 0.00 57.16 57.41 1f2g n GLU 53 Cb 0.28 -2.19 0.17 0.00 0.00 0.00 0.00 31.44 29.70 1f2g n GLU 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1f2g h ALA 54 N 1.29 0.85 -2.90 -1.84 0.00 -1.90 -3.43 119.26 111.32 1f2g h ALA 54 Ca -0.39 -0.25 -0.58 0.00 0.00 0.00 0.00 54.91 53.69 1f2g h ALA 54 Cb 0.83 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 1f2g h ALA 54 CO 0.43 0.35 -0.14 0.96 0.00 0.00 0.00 179.25 180.86 1f2g s ILE 55 N -3.19 5.18 0.09 0.00 -4.36 -1.26 -2.81 121.20 114.86 1f2g s ILE 55 Ca 0.04 0.93 -0.00 0.00 -0.26 0.00 0.00 60.65 61.36 1f2g s ILE 55 Cb 0.07 -3.81 -0.04 0.00 1.25 0.00 0.00 42.46 39.93 1f2g s ILE 55 CO 0.69 0.31 -0.01 0.68 0.24 0.00 0.00 174.94 176.86 1f2g s VAL 56 N 0.74 0.31 -0.38 8.37 -7.23 -0.48 -4.87 120.40 116.86 1f2g s VAL 56 Ca 0.25 -1.88 0.06 0.00 -1.81 0.00 0.00 61.98 58.60 1f2g s VAL 56 Cb -0.15 -1.77 0.44 0.00 0.56 0.00 0.00 36.38 35.46 1f2g s VAL 56 CO 0.10 -0.77 1.18 -2.11 -0.31 0.00 0.00 175.10 173.19 1f2g n ARG 57 N -0.01 3.50 0.00 4.82 1.85 -1.26 -0.43 116.66 125.12 1f2g n ARG 57 Ca -0.10 -4.31 0.00 0.00 -1.00 0.00 0.00 57.85 52.43 1f2g n ARG 57 Cb 0.62 -2.27 0.00 0.00 -1.05 0.00 0.00 32.46 29.76 1f2g n ARG 57 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07