#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i02 s LYS 2 N 0.00 1.50 -0.08 1.96 1.02 -1.26 0.22 119.74 123.10 1i02 s LYS 2 Ca 0.00 -1.63 -0.08 0.00 0.02 0.00 0.00 55.97 54.27 1i02 s LYS 2 Cb 0.00 -1.54 0.02 0.00 -0.52 0.00 0.00 37.83 35.80 1i02 s LYS 2 CO 0.00 0.29 0.23 0.00 -0.92 0.00 0.00 175.35 174.95 1i02 n ASN 4 N 2.81 -1.33 -4.96 0.00 4.13 -1.26 -1.53 115.26 113.12 1i02 n ASN 4 Ca -0.14 0.91 -0.22 0.00 1.68 0.00 0.00 54.58 56.81 1i02 n ASN 4 Cb 0.58 -1.05 -0.01 0.00 -1.54 0.00 0.00 39.78 37.76 1i02 n ASN 4 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1i02 s LYS 5 N -1.40 3.38 0.31 3.52 2.20 0.19 -4.48 119.74 123.47 1i02 s LYS 5 Ca 0.62 -0.61 0.26 0.00 -0.36 0.00 0.00 55.97 55.88 1i02 s LYS 5 Cb -0.64 -2.77 1.00 0.00 -1.51 0.00 0.00 37.83 33.92 1i02 s LYS 5 CO 0.59 0.22 0.97 -0.11 -0.36 0.00 0.00 175.35 176.66 1i02 n LEU 6 N -1.64 0.07 -4.74 5.43 0.00 -1.26 -4.11 117.00 110.75 1i02 n LEU 6 Ca -0.05 0.74 -0.36 0.00 0.00 0.00 0.00 56.01 56.34 1i02 n LEU 6 Cb 0.57 -0.37 -0.08 0.00 0.00 0.00 0.00 43.42 43.54 1i02 n LEU 6 CO 0.46 -0.78 -0.26 -0.69 0.00 0.00 0.00 177.39 176.13 1i02 s VAL 7 N -4.39 4.77 -0.41 1.96 1.01 -1.26 -4.97 120.40 117.11 1i02 s VAL 7 Ca -0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.84 1i02 s VAL 7 Cb 0.18 -3.05 -0.08 0.00 0.00 0.00 0.00 36.38 33.42 1i02 s VAL 7 CO 0.53 0.59 1.95 -0.81 0.00 0.00 0.00 175.10 177.36 1i02 n PRO 8 N 2.31 1.37 0.00 2.72 -0.05 -1.26 -3.15 135.00 136.94 1i02 n PRO 8 Ca -0.19 -0.91 0.00 0.00 -0.05 0.00 0.00 63.50 62.35 1i02 n PRO 8 Cb 0.54 -2.08 0.00 0.00 -0.05 0.00 0.00 33.50 31.91 1i02 n PRO 8 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 175.50 176.73 1i02 n LEU 9 N 3.60 0.00 0.00 1.53 4.77 -1.26 -5.12 117.00 120.52 1i02 n LEU 9 Ca 0.29 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.18 1i02 n LEU 9 Cb 0.26 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 1i02 n LEU 9 CO 0.45 -0.01 -0.06 2.22 -1.33 0.00 0.00 177.39 178.65 1i02 n PHE 10 N -1.52 -0.02 -4.04 -1.77 1.16 -1.19 -5.05 117.46 105.03 1i02 n PHE 10 Ca 0.00 -1.05 -0.12 0.00 -1.87 0.00 0.00 57.45 54.41 1i02 n PHE 10 Cb 0.00 0.02 -0.04 0.00 -1.61 0.00 0.00 39.48 37.85 1i02 n PHE 10 CO 0.00 0.00 0.00 1.52 -1.87 0.00 0.00 176.76 176.41 1i02 s TYR 11 N -2.22 0.74 0.35 2.97 -0.85 -1.26 -0.64 117.35 116.44 1i02 s TYR 11 Ca 0.10 -1.05 0.09 0.00 -0.52 0.00 0.00 57.07 55.68 1i02 s TYR 11 Cb 0.00 0.06 -0.06 0.00 0.38 0.00 0.00 41.96 42.34 1i02 s TYR 11 CO 0.07 -1.09 -0.06 0.15 -1.52 0.00 0.00 175.55 173.09 1i02 s LYS 12 N -3.41 1.88 0.61 -3.49 1.02 -0.58 -4.73 119.74 111.03 1i02 s LYS 12 Ca 0.27 -1.93 0.01 0.00 0.02 0.00 0.00 55.97 54.34 1i02 s LYS 12 Cb -0.00 -1.73 0.07 0.00 -0.52 0.00 0.00 37.83 35.64 1i02 s LYS 12 CO 0.15 0.11 0.85 0.99 -0.92 0.00 0.00 175.35 176.53 1i02 s THR 13 N -2.61 2.47 0.02 2.17 2.01 -1.26 -1.53 115.64 116.90 1i02 s THR 13 Ca 0.33 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.69 1i02 s THR 13 Cb 0.03 -2.82 -0.02 0.00 0.01 0.00 0.00 72.50 69.71 1i02 s THR 13 CO 0.17 0.00 -0.05 0.00 -0.69 0.00 0.00 174.62 174.05 1i02 s PRO 15 N -1.09 -0.55 1.28 0.00 0.04 -1.26 -2.86 135.00 130.57 1i02 s PRO 15 Ca -0.08 0.76 -0.18 0.00 0.04 0.00 0.00 61.00 61.53 1i02 s PRO 15 Cb -0.07 -1.60 0.32 0.00 0.04 0.00 0.00 34.50 33.18 1i02 s PRO 15 CO -0.00 -3.45 1.00 0.00 0.04 0.00 0.00 177.00 174.58 1i02 s ALA 16 N -2.60 -0.36 -1.40 8.56 0.00 -1.26 -3.71 121.76 120.98 1i02 s ALA 16 Ca 0.68 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1i02 s ALA 16 Cb -0.23 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 19.85 1i02 s ALA 16 CO 0.63 -4.11 0.00 0.41 0.00 0.00 0.00 175.76 172.69 1i02 n GLY 17 N 0.65 -0.07 3.04 0.00 0.00 -1.26 -4.99 105.19 102.55 1i02 n GLY 17 Ca 0.09 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 1i02 n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i02 s LYS 18 N -4.63 0.49 0.00 1.61 0.00 -1.24 -4.80 119.74 111.16 1i02 s LYS 18 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 55.97 55.33 1i02 s LYS 18 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 37.83 37.55 1i02 s LYS 18 CO 0.00 0.05 0.00 0.27 0.00 0.00 0.00 175.35 175.67 1i02 n ASN 19 N 1.75 0.00 -2.68 0.03 6.94 -1.25 -4.63 115.26 115.42 1i02 n ASN 19 Ca -0.21 -0.66 -0.07 0.00 -0.02 0.00 0.00 54.58 53.63 1i02 n ASN 19 Cb 0.55 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.97 1i02 n ASN 19 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1i02 n LEU 20 N 0.00 0.00 -3.80 -4.53 4.77 -0.45 -1.32 117.00 111.67 1i02 n LEU 20 Ca 0.00 -0.70 -0.13 0.00 -0.03 0.00 0.00 56.01 55.15 1i02 n LEU 20 Cb 0.16 0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.15 1i02 n LEU 20 CO 0.00 -0.30 -0.11 0.00 -1.33 0.00 0.00 177.39 175.65 1i02 s TYR 22 N -0.03 1.77 -0.28 0.00 1.13 -0.97 -2.56 117.35 116.41 1i02 s TYR 22 Ca -0.01 -0.34 0.03 0.00 -1.41 0.00 0.00 57.07 55.34 1i02 s TYR 22 Cb -0.02 -1.13 0.08 0.00 -1.10 0.00 0.00 41.96 39.78 1i02 s TYR 22 CO 0.01 -0.02 -0.03 -1.59 -2.51 0.00 0.00 175.55 171.40 1i02 s LYS 23 N -0.50 1.75 -0.10 -3.49 -2.85 -1.07 -1.49 119.74 111.98 1i02 s LYS 23 Ca 0.08 -1.41 -0.18 0.00 -1.00 0.00 0.00 55.97 53.46 1i02 s LYS 23 Cb -0.08 -2.85 -0.04 0.00 -2.06 0.00 0.00 37.83 32.80 1i02 s LYS 23 CO -0.01 -0.72 0.47 1.41 0.10 0.00 0.00 175.35 176.60 1i02 s MET 24 N 1.14 4.30 0.32 1.78 1.75 -0.50 -2.59 119.30 125.51 1i02 s MET 24 Ca -0.01 0.45 0.02 0.00 -1.25 0.00 0.00 55.69 54.90 1i02 s MET 24 Cb -0.19 -3.41 -0.02 0.00 2.84 0.00 0.00 34.83 34.05 1i02 s MET 24 CO -0.08 0.21 0.35 -0.59 -0.65 0.00 0.00 175.02 174.27 1i02 s PHE 25 N 0.44 1.39 -0.24 4.11 -0.12 -1.02 -0.65 117.98 121.89 1i02 s PHE 25 Ca 0.26 -1.47 -0.20 0.00 -0.05 0.00 0.00 56.93 55.47 1i02 s PHE 25 Cb -0.15 -0.43 -0.02 0.00 -0.63 0.00 0.00 43.02 41.79 1i02 s PHE 25 CO 0.11 -0.96 0.60 -1.64 -0.05 0.00 0.00 175.22 173.27 1i02 s MET 26 N -3.37 4.13 0.56 1.99 -1.94 -1.26 -1.80 119.30 117.61 1i02 s MET 26 Ca 0.36 0.51 0.23 0.00 -1.71 0.00 0.00 55.69 55.08 1i02 s MET 26 Cb 0.02 -3.63 0.80 0.00 2.01 0.00 0.00 34.83 34.02 1i02 s MET 26 CO 0.23 -0.34 1.18 0.28 -0.01 0.00 0.00 175.02 176.35 1i02 n VAL 27 N 5.03 0.00 0.19 -6.03 0.31 -0.90 0.26 118.33 117.20 1i02 n VAL 27 Ca -0.02 1.14 0.04 0.00 -0.01 0.00 0.00 64.34 65.50 1i02 n VAL 27 Cb 0.49 -2.06 0.39 0.00 -0.91 0.00 0.00 33.84 31.75 1i02 n VAL 27 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1i02 h ALA 28 N 0.46 1.29 -2.03 3.52 0.00 -1.90 -3.33 119.26 117.27 1i02 h ALA 28 Ca 0.43 -0.32 -0.52 0.00 0.00 0.00 0.00 54.91 54.50 1i02 h ALA 28 Cb 2.66 -0.06 -0.40 0.00 0.00 0.00 0.00 17.79 20.00 1i02 h ALA 28 CO -0.00 0.44 -1.10 0.25 0.00 0.00 0.00 179.25 178.83 1i02 n THR 29 N -3.93 -0.08 0.87 0.00 -2.24 0.73 -4.92 114.28 104.71 1i02 n THR 29 Ca -0.02 -4.45 0.07 0.00 -2.27 0.00 0.00 64.05 57.39 1i02 n THR 29 Cb 0.41 -1.09 0.41 0.00 -2.10 0.00 0.00 70.33 67.97 1i02 n THR 29 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1i02 n PRO 30 N 0.72 0.43 0.02 -0.78 -0.05 -1.18 -2.43 135.00 131.75 1i02 n PRO 30 Ca 0.24 0.00 0.11 0.00 -0.05 0.00 0.00 63.50 63.80 1i02 n PRO 30 Cb 0.58 -1.50 0.10 0.00 -0.05 0.00 0.00 33.50 32.63 1i02 n PRO 30 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 175.50 177.08 1i02 n LYS 31 N -1.00 0.18 -3.19 0.54 5.02 -1.26 -4.56 118.16 113.89 1i02 n LYS 31 Ca 0.10 0.01 -0.22 0.00 -2.02 0.00 0.00 58.31 56.19 1i02 n LYS 31 Cb 0.05 -1.57 -0.06 0.00 -0.02 0.00 0.00 35.03 33.42 1i02 n LYS 31 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1i02 n VAL 32 N -1.81 -0.78 -0.78 -0.18 0.31 -1.02 -5.13 118.33 108.94 1i02 n VAL 32 Ca 0.03 -3.22 -0.32 0.00 -0.01 0.00 0.00 64.34 60.82 1i02 n VAL 32 Cb 0.40 -1.20 0.16 0.00 -0.91 0.00 0.00 33.84 32.28 1i02 n VAL 32 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1i02 n PRO 33 N 2.18 -0.30 0.08 5.55 -0.04 -1.26 -4.88 135.00 136.32 1i02 n PRO 33 Ca 0.23 -0.02 0.08 0.00 -0.04 0.00 0.00 63.50 63.75 1i02 n PRO 33 Cb 0.52 -2.36 -0.03 0.00 -0.04 0.00 0.00 33.50 31.59 1i02 n PRO 33 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1i02 n VAL 34 N -4.00 0.81 -4.54 0.52 0.24 0.17 -4.87 118.33 106.66 1i02 n VAL 34 Ca 0.12 -0.60 -0.21 0.00 -2.04 0.00 0.00 64.34 61.61 1i02 n VAL 34 Cb 0.52 -0.47 -0.15 0.00 -1.47 0.00 0.00 33.84 32.27 1i02 n VAL 34 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1i02 s LYS 35 N -3.22 1.04 -0.32 7.34 -0.14 -1.12 -5.02 119.74 118.30 1i02 s LYS 35 Ca -0.01 -0.43 -0.01 0.00 -1.36 0.00 0.00 55.97 54.16 1i02 s LYS 35 Cb 0.09 -0.99 0.11 0.00 -1.68 0.00 0.00 37.83 35.36 1i02 s LYS 35 CO 0.80 0.24 0.13 0.50 -0.76 0.00 0.00 175.35 176.26 1i02 s ARG 36 N -0.18 0.61 0.00 1.68 3.52 -1.26 -1.41 118.95 121.90 1i02 s ARG 36 Ca 0.03 -1.05 0.00 0.00 -0.13 0.00 0.00 55.73 54.58 1i02 s ARG 36 Cb -0.06 -1.73 0.00 0.00 -1.56 0.00 0.00 34.95 31.60 1i02 s ARG 36 CO -0.00 -1.04 0.00 0.41 -0.81 0.00 0.00 175.30 173.86 1i02 n GLY 37 N 4.73 5.48 3.32 8.12 0.00 -0.56 -4.10 105.19 122.19 1i02 n GLY 37 Ca -0.01 -1.22 -0.26 0.00 0.00 0.00 0.00 46.02 44.54 1i02 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i02 s ILE 39 N -1.11 0.35 -0.04 0.00 1.01 -1.08 -4.55 121.20 115.78 1i02 s ILE 39 Ca 0.09 -1.22 0.06 0.00 0.00 0.00 0.00 60.65 59.58 1i02 s ILE 39 Cb -0.10 -0.74 -0.09 0.00 0.01 0.00 0.00 42.46 41.54 1i02 s ILE 39 CO 0.05 -0.57 0.08 -0.90 0.00 0.00 0.00 174.94 173.59 1i02 n ASP 40 N 1.14 3.45 -3.89 3.58 5.68 -1.26 -1.34 116.55 123.90 1i02 n ASP 40 Ca -0.21 0.00 -0.11 0.00 -0.50 0.00 0.00 54.79 53.97 1i02 n ASP 40 Cb 0.56 0.95 -0.12 0.00 -1.14 0.00 0.00 41.12 41.37 1i02 n ASP 40 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1i02 s VAL 41 N -2.30 0.05 -0.34 2.12 1.01 -1.26 -4.88 120.40 114.80 1i02 s VAL 41 Ca -0.03 -0.38 -0.20 0.00 0.00 0.00 0.00 61.98 61.38 1i02 s VAL 41 Cb 0.03 -0.19 -0.00 0.00 0.00 0.00 0.00 36.38 36.22 1i02 s VAL 41 CO 0.27 -0.21 0.59 0.00 0.00 0.00 0.00 175.10 175.75 1i02 n PRO 43 N 5.90 -4.36 -3.31 0.00 -0.01 -1.26 -4.94 135.00 127.02 1i02 n PRO 43 Ca -0.02 -1.29 -0.39 0.00 -0.01 0.00 0.00 63.50 61.78 1i02 n PRO 43 Cb 0.49 -1.91 -0.08 0.00 -0.01 0.00 0.00 33.50 31.99 1i02 n PRO 43 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 175.50 175.64 1i02 s LYS 44 N -4.82 4.05 1.29 -0.52 1.02 -1.26 -4.89 119.74 114.61 1i02 s LYS 44 Ca 0.64 0.19 -0.16 0.00 0.02 0.00 0.00 55.97 56.66 1i02 s LYS 44 Cb -0.13 -3.65 0.33 0.00 -0.52 0.00 0.00 37.83 33.86 1i02 s LYS 44 CO 0.55 -0.30 0.98 -1.12 -0.92 0.00 0.00 175.35 174.54 1i02 s SER 45 N 1.57 -0.02 0.00 2.83 0.01 -1.26 -4.93 113.70 111.90 1i02 s SER 45 Ca 0.18 1.29 0.00 0.00 1.31 0.00 0.00 55.95 58.74 1i02 s SER 45 Cb -0.16 -1.97 0.00 0.00 0.21 0.00 0.00 66.02 64.11 1i02 s SER 45 CO 0.09 -4.78 0.00 -0.24 0.41 0.00 0.00 173.24 168.72 1i02 n SER 46 N -5.29 0.10 0.07 2.44 2.88 0.17 -4.99 113.62 109.00 1i02 n SER 46 Ca 0.06 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.72 1i02 n SER 46 Cb 0.56 0.00 0.24 0.00 -0.75 0.00 0.00 64.21 64.26 1i02 n SER 46 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1i02 n LEU 47 N 0.00 0.70 0.00 2.46 7.94 -1.26 -4.29 117.00 122.55 1i02 n LEU 47 Ca 0.00 0.31 0.00 0.00 -1.11 0.00 0.00 56.01 55.21 1i02 n LEU 47 Cb 0.00 -0.23 0.00 0.00 0.53 0.00 0.00 43.42 43.72 1i02 n LEU 47 CO 0.00 -0.07 0.12 0.00 -1.11 0.00 0.00 177.39 176.32 1i02 n LEU 48 N -2.10 0.00 -4.06 -1.96 -0.00 -1.26 -4.95 117.00 102.67 1i02 n LEU 48 Ca 0.04 -0.02 -0.16 0.00 -0.00 0.00 0.00 56.01 55.87 1i02 n LEU 48 Cb 0.43 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.72 1i02 n LEU 48 CO 0.35 0.03 -0.42 0.54 -0.00 0.00 0.00 177.39 177.89 1i02 s VAL 49 N 0.00 0.65 -0.03 1.47 0.11 -1.26 -2.12 120.40 119.22 1i02 s VAL 49 Ca 0.00 -0.83 -0.02 0.00 -2.93 0.00 0.00 61.98 58.20 1i02 s VAL 49 Cb 0.00 -0.64 0.02 0.00 -1.53 0.00 0.00 36.38 34.23 1i02 s VAL 49 CO 0.00 -0.15 0.07 -0.75 -3.33 0.00 0.00 175.10 170.94 1i02 s LYS 50 N -1.08 0.04 -0.17 1.54 2.20 -0.75 -0.65 119.74 120.87 1i02 s LYS 50 Ca -0.04 0.20 -0.05 0.00 -0.36 0.00 0.00 55.97 55.72 1i02 s LYS 50 Cb -0.07 -0.12 -0.03 0.00 -1.51 0.00 0.00 37.83 36.09 1i02 s LYS 50 CO 0.00 -0.11 0.00 0.71 -0.36 0.00 0.00 175.35 175.60 1i02 s TYR 51 N 0.70 3.10 -0.02 4.03 1.51 -1.26 -2.44 117.35 122.97 1i02 s TYR 51 Ca -0.06 -0.19 -0.07 0.00 -1.01 0.00 0.00 57.07 55.75 1i02 s TYR 51 Cb -0.08 -2.02 -0.05 0.00 -0.11 0.00 0.00 41.96 39.71 1i02 s TYR 51 CO -0.03 0.01 0.24 0.08 -1.11 0.00 0.00 175.55 174.74 1i02 s VAL 52 N 0.45 5.34 -0.11 0.71 1.01 -1.07 -4.91 120.40 121.82 1i02 s VAL 52 Ca -0.01 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.12 1i02 s VAL 52 Cb -0.14 -3.54 0.06 0.00 0.00 0.00 0.00 36.38 32.76 1i02 s VAL 52 CO 0.02 0.43 0.20 0.00 0.00 0.00 0.00 175.10 175.75 1i02 n ASN 55 N 1.62 6.23 -3.75 0.00 6.94 -1.26 -1.42 115.26 123.61 1i02 n ASN 55 Ca -0.18 -3.12 -0.10 0.00 -0.02 0.00 0.00 54.58 51.16 1i02 n ASN 55 Cb 0.53 -1.43 -0.06 0.00 -2.36 0.00 0.00 39.78 36.46 1i02 n ASN 55 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1i02 s THR 56 N -0.22 0.10 -0.48 5.53 -4.23 -0.44 -4.84 115.64 111.06 1i02 s THR 56 Ca 0.45 -0.83 -0.27 0.00 -1.18 0.00 0.00 61.69 59.86 1i02 s THR 56 Cb 0.13 -1.15 0.03 0.00 1.34 0.00 0.00 72.50 72.85 1i02 s THR 56 CO -0.03 -0.46 1.03 -0.62 -0.54 0.00 0.00 174.62 174.01 1i02 s ASP 57 N -2.57 6.55 0.00 3.99 -1.08 -1.26 -3.85 116.67 118.45 1i02 s ASP 57 Ca 0.01 0.24 0.00 0.00 -0.52 0.00 0.00 52.55 52.28 1i02 s ASP 57 Cb 0.02 -2.50 0.00 0.00 -1.46 0.00 0.00 42.92 38.98 1i02 s ASP 57 CO -0.09 -1.17 0.00 -1.14 0.52 0.00 0.00 175.17 173.29 1i02 n ARG 58 N 7.55 0.00 0.00 4.34 0.63 -0.43 -4.92 116.66 123.83 1i02 n ARG 58 Ca 0.09 0.05 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 1i02 n ARG 58 Cb 0.49 -1.44 0.00 0.00 0.45 0.00 0.00 32.46 31.95 1i02 n ARG 58 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12