#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 1.97 -0.02 1.47 3.01 -1.26 -1.32 119.74 123.58 1i02 s LYS 2 Ca 0.00 -2.02 -0.08 0.00 -1.01 0.00 0.00 55.97 52.86 1i02 s LYS 2 Cb 0.00 -1.71 0.01 0.00 -1.01 0.00 0.00 37.83 35.12 1i02 s LYS 2 CO 0.00 -0.01 0.18 0.00 0.51 0.00 0.00 175.35 176.04 1i02 n ASN 4 N 1.90 -0.08 -4.96 0.00 4.13 -1.26 0.17 115.26 115.17 1i02 n ASN 4 Ca -0.19 1.01 -0.20 0.00 1.68 0.00 0.00 54.58 56.88 1i02 n ASN 4 Cb 0.57 -1.18 0.05 0.00 -1.54 0.00 0.00 39.78 37.68 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 -1.60 2.37 0.21 3.52 2.47 -0.88 -4.36 119.74 121.47 1i02 s LYS 5 Ca 0.62 -1.34 -0.13 0.00 -1.56 0.00 0.00 55.97 53.56 1i02 s LYS 5 Cb -0.65 -2.60 0.23 0.00 -1.46 0.00 0.00 37.83 33.35 1i02 s LYS 5 CO 0.58 -0.78 1.64 1.25 0.16 0.00 0.00 175.35 178.19 1i02 h LEU 6 N 0.17 -0.50 -9.79 5.43 6.46 -1.86 -3.39 115.31 111.82 1i02 h LEU 6 Ca -0.35 0.17 -0.53 0.00 -0.12 0.00 0.00 57.88 57.05 1i02 h LEU 6 Cb 1.28 0.35 -0.03 0.00 -0.73 0.00 0.00 40.66 41.53 1i02 h LEU 6 CO 0.43 -0.18 0.11 -0.69 -0.62 0.00 0.00 178.44 177.49 1i02 s VAL 7 N -6.21 4.54 -2.00 1.05 1.01 -1.26 -4.94 120.40 112.58 1i02 s VAL 7 Ca -0.14 1.39 0.08 0.00 0.00 0.00 0.00 61.98 63.31 1i02 s VAL 7 Cb 0.19 -3.95 0.22 0.00 0.00 0.00 0.00 36.38 32.84 1i02 s VAL 7 CO 0.73 0.35 0.89 -0.81 0.00 0.00 0.00 175.10 176.27 1i02 n PRO 8 N 1.13 0.44 -0.05 2.72 -0.05 -1.26 -3.13 135.00 134.80 1i02 n PRO 8 Ca -0.05 0.00 -0.13 0.00 -0.05 0.00 0.00 63.50 63.27 1i02 n PRO 8 Cb 0.50 -1.27 -0.14 0.00 -0.05 0.00 0.00 33.50 32.54 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 -0.77 1.41 0.00 1.53 4.32 -1.26 -5.02 117.00 117.21 1i02 n LEU 9 Ca 0.06 0.18 -0.03 0.00 -0.02 0.00 0.00 56.01 56.19 1i02 n LEU 9 Cb 0.03 -0.22 -0.01 0.00 -1.62 0.00 0.00 43.42 41.59 1i02 n LEU 9 CO 0.04 0.61 -0.02 2.22 -1.22 0.00 0.00 177.39 179.02 1i02 n PHE 10 N -3.11 0.03 -4.13 -1.77 -1.74 -1.18 -5.08 117.46 100.47 1i02 n PHE 10 Ca -0.29 -0.35 -0.16 0.00 -0.56 0.00 0.00 57.45 56.09 1i02 n PHE 10 Cb 1.07 -0.01 -0.05 0.00 1.52 0.00 0.00 39.48 42.01 1i02 n PHE 10 CO 0.00 0.00 0.00 1.52 -0.56 0.00 0.00 176.76 177.72 1i02 s TYR 11 N -1.69 1.24 0.33 2.97 1.13 -1.26 -2.07 117.35 118.00 1i02 s TYR 11 Ca 0.02 -1.40 0.10 0.00 -1.41 0.00 0.00 57.07 54.39 1i02 s TYR 11 Cb 0.00 -0.23 -0.06 0.00 -1.10 0.00 0.00 41.96 40.57 1i02 s TYR 11 CO 0.02 -1.09 -0.12 0.21 -2.51 0.00 0.00 175.55 172.06 1i02 s LYS 12 N -3.10 1.78 0.09 -3.49 2.47 0.13 -4.65 119.74 112.97 1i02 s LYS 12 Ca 0.33 -1.89 -0.02 0.00 -1.56 0.00 0.00 55.97 52.83 1i02 s LYS 12 Cb 0.00 -1.72 -0.05 0.00 -1.46 0.00 0.00 37.83 34.61 1i02 s LYS 12 CO 0.22 0.19 0.28 0.99 0.16 0.00 0.00 175.35 177.19 1i02 s THR 13 N -2.59 5.30 -0.14 3.43 2.01 -1.26 -0.40 115.64 121.99 1i02 s THR 13 Ca 0.32 -0.21 -0.04 0.00 0.31 0.00 0.00 61.69 62.07 1i02 s THR 13 Cb 0.00 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.86 1i02 s THR 13 CO 0.16 0.10 0.01 0.00 -0.69 0.00 0.00 174.62 174.21 1i02 n PRO 15 N 2.97 -1.67 -1.88 0.00 -0.04 -1.26 -4.26 135.00 128.85 1i02 n PRO 15 Ca -0.18 -0.45 -0.38 0.00 -0.04 0.00 0.00 63.50 62.45 1i02 n PRO 15 Cb 0.53 -2.20 0.03 0.00 -0.04 0.00 0.00 33.50 31.81 1i02 n PRO 15 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1i02 s ALA 16 N -2.47 2.92 0.00 0.55 0.00 -1.26 -2.70 121.76 118.79 1i02 s ALA 16 Ca 0.67 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.91 1i02 s ALA 16 Cb -0.24 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.35 1i02 s ALA 16 CO 0.63 -1.20 0.00 0.41 0.00 0.00 0.00 175.76 175.60 1i02 n GLY 17 N 0.66 0.70 3.21 0.00 0.00 -1.26 -5.05 105.19 103.45 1i02 n GLY 17 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 1i02 n GLY 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1i02 s LYS 18 N -0.39 1.22 0.00 1.61 2.20 -1.10 -4.77 119.74 118.52 1i02 s LYS 18 Ca 0.00 -0.88 0.00 0.00 -0.36 0.00 0.00 55.97 54.73 1i02 s LYS 18 Cb 0.00 -1.30 0.00 0.00 -1.51 0.00 0.00 37.83 35.02 1i02 s LYS 18 CO 0.00 0.33 0.12 0.27 -0.36 0.00 0.00 175.35 175.71 1i02 n ASN 19 N 1.86 0.00 -3.02 1.43 6.94 -1.25 -4.27 115.26 116.94 1i02 n ASN 19 Ca -0.17 -1.00 -0.09 0.00 -0.02 0.00 0.00 54.58 53.29 1i02 n ASN 19 Cb 0.54 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.96 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 -3.76 -4.53 4.77 -0.64 -1.01 117.00 111.83 1i02 n LEU 20 Ca 0.00 -1.01 -0.14 0.00 -0.03 0.00 0.00 56.01 54.82 1i02 n LEU 20 Cb 0.32 -0.03 -0.15 0.00 -2.33 0.00 0.00 43.42 41.23 1i02 n LEU 20 CO 0.00 -0.40 -0.29 0.00 -1.33 0.00 0.00 177.39 175.38 1i02 s TYR 22 N 1.13 2.59 -0.19 0.00 1.13 0.08 -2.68 117.35 119.40 1i02 s TYR 22 Ca -0.09 -0.24 -0.03 0.00 -1.41 0.00 0.00 57.07 55.30 1i02 s TYR 22 Cb -0.12 -1.58 0.06 0.00 -1.10 0.00 0.00 41.96 39.22 1i02 s TYR 22 CO -0.04 0.13 0.04 -1.59 -2.51 0.00 0.00 175.55 171.58 1i02 s LYS 23 N -0.76 0.56 -0.06 -3.49 -2.85 -0.62 -1.00 119.74 111.52 1i02 s LYS 23 Ca 0.11 -0.36 -0.02 0.00 -1.00 0.00 0.00 55.97 54.70 1i02 s LYS 23 Cb -0.10 -2.04 -0.04 0.00 -2.06 0.00 0.00 37.83 33.59 1i02 s LYS 23 CO 0.00 -0.64 0.06 0.00 0.10 0.00 0.00 175.35 174.88 1i02 s MET 24 N 1.90 3.10 0.41 1.78 0.23 -0.93 -2.27 119.30 123.53 1i02 s MET 24 Ca -0.00 -0.38 0.04 0.00 -1.03 0.00 0.00 55.69 54.31 1i02 s MET 24 Cb -0.17 -2.90 -0.03 0.00 -1.53 0.00 0.00 34.83 30.21 1i02 s MET 24 CO -0.08 0.70 0.11 -0.59 -2.03 0.00 0.00 175.02 173.13 1i02 s PHE 25 N -1.03 1.81 -0.28 3.16 -0.12 -1.02 -1.19 117.98 119.30 1i02 s PHE 25 Ca 0.17 -1.23 0.01 0.00 -0.05 0.00 0.00 56.93 55.83 1i02 s PHE 25 Cb -0.12 -1.20 0.34 0.00 -0.63 0.00 0.00 43.02 41.42 1i02 s PHE 25 CO 0.07 -0.23 1.65 -1.33 -0.05 0.00 0.00 175.22 175.32 1i02 n MET 26 N -0.92 1.76 0.00 1.99 2.81 -1.26 -2.63 117.12 118.88 1i02 n MET 26 Ca -0.07 -1.73 0.00 0.00 -1.81 0.00 0.00 57.70 54.09 1i02 n MET 26 Cb 0.65 -1.68 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 1i02 n MET 26 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1i02 n VAL 27 N -0.28 0.00 0.30 2.03 0.31 -1.05 -4.37 118.33 115.27 1i02 n VAL 27 Ca 0.34 0.00 0.17 0.00 -0.01 0.00 0.00 64.34 64.85 1i02 n VAL 27 Cb 1.02 0.00 0.73 0.00 -0.91 0.00 0.00 33.84 34.68 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 0.00 1.00 -2.60 3.52 0.00 -1.89 -3.29 119.26 116.00 1i02 h ALA 28 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 1i02 h ALA 28 Cb 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.37 1i02 h ALA 28 CO 0.00 0.00 -0.63 2.41 0.00 0.00 0.00 179.25 181.03 1i02 n THR 29 N -2.99 1.70 0.44 0.00 -1.04 -1.26 -4.95 114.28 106.17 1i02 n THR 29 Ca 0.00 -4.91 -0.17 0.00 -2.04 0.00 0.00 64.05 56.93 1i02 n THR 29 Cb 0.27 -2.11 -0.08 0.00 -1.82 0.00 0.00 70.33 66.58 1i02 n THR 29 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1i02 h PRO 30 N 4.79 -1.08 0.00 -2.82 0.11 -1.95 -3.01 132.00 128.03 1i02 h PRO 30 Ca 0.17 0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1i02 h PRO 30 Cb 0.73 0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1i02 h PRO 30 CO 0.74 -0.72 0.00 1.17 -0.21 0.00 0.00 178.00 178.98 1i02 n LYS 31 N -5.38 0.72 -3.47 1.05 4.81 -1.26 -4.19 118.16 110.44 1i02 n LYS 31 Ca -0.14 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.03 1i02 n LYS 31 Cb 0.44 -1.33 -0.10 0.00 0.02 0.00 0.00 35.03 34.06 1i02 n LYS 31 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1i02 s VAL 32 N -2.00 0.66 0.76 3.15 1.01 -1.14 -5.12 120.40 117.73 1i02 s VAL 32 Ca 0.23 -2.79 -0.13 0.00 0.00 0.00 0.00 61.98 59.29 1i02 s VAL 32 Cb 0.11 -1.46 0.06 0.00 0.00 0.00 0.00 36.38 35.08 1i02 s VAL 32 CO 0.18 -1.19 1.15 -2.16 0.00 0.00 0.00 175.10 173.09 1i02 s PRO 33 N -0.06 2.04 -0.16 2.72 0.05 -1.25 -4.79 135.00 133.55 1i02 s PRO 33 Ca 0.31 1.54 0.02 0.00 0.05 0.00 0.00 61.00 62.92 1i02 s PRO 33 Cb 0.01 -1.84 -0.23 0.00 0.05 0.00 0.00 34.50 32.48 1i02 s PRO 33 CO -0.18 -1.87 0.21 1.33 0.05 0.00 0.00 177.00 176.54 1i02 n VAL 34 N -3.14 1.62 -4.92 -0.36 0.24 -0.34 -4.91 118.33 106.52 1i02 n VAL 34 Ca 0.12 -0.68 -0.32 0.00 -2.04 0.00 0.00 64.34 61.41 1i02 n VAL 34 Cb 0.51 -1.36 -0.13 0.00 -1.47 0.00 0.00 33.84 31.39 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 -2.55 2.41 -0.14 7.34 1.02 -1.13 -4.96 119.74 121.73 1i02 s LYS 35 Ca -0.21 -0.75 -0.02 0.00 0.02 0.00 0.00 55.97 55.00 1i02 s LYS 35 Cb 0.07 -2.32 0.05 0.00 -0.52 0.00 0.00 37.83 35.11 1i02 s LYS 35 CO 0.74 0.61 0.03 0.50 -0.92 0.00 0.00 175.35 176.30 1i02 s ARG 36 N -0.78 0.58 0.00 1.68 6.06 -1.26 -2.18 118.95 123.05 1i02 s ARG 36 Ca 0.12 -0.18 0.00 0.00 -2.50 0.00 0.00 55.73 53.17 1i02 s ARG 36 Cb -0.11 -1.63 0.00 0.00 0.06 0.00 0.00 34.95 33.28 1i02 s ARG 36 CO 0.01 -0.51 0.00 0.41 -2.50 0.00 0.00 175.30 172.71 1i02 n GLY 37 N 5.11 4.21 3.66 8.12 0.00 -0.17 -4.11 105.19 122.01 1i02 n GLY 37 Ca -0.08 -1.03 -0.32 0.00 0.00 0.00 0.00 46.02 44.59 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 -1.09 0.62 -0.11 0.00 1.01 -1.07 -4.64 121.20 115.91 1i02 s ILE 39 Ca 0.20 -0.94 0.19 0.00 0.00 0.00 0.00 60.65 60.09 1i02 s ILE 39 Cb -0.11 -0.64 -0.28 0.00 0.01 0.00 0.00 42.46 41.44 1i02 s ILE 39 CO 0.11 -0.25 0.25 -0.90 0.00 0.00 0.00 174.94 174.15 1i02 n ASP 40 N 1.74 0.22 -3.44 3.58 5.75 -1.26 -1.62 116.55 121.52 1i02 n ASP 40 Ca -0.20 0.00 -0.15 0.00 -0.01 0.00 0.00 54.79 54.42 1i02 n ASP 40 Cb 0.55 1.44 -0.11 0.00 -1.03 0.00 0.00 41.12 41.97 1i02 n ASP 40 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1i02 s VAL 41 N -2.93 -0.42 -0.06 2.12 0.11 -1.26 -4.83 120.40 113.13 1i02 s VAL 41 Ca -0.09 -0.12 -0.29 0.00 -2.93 0.00 0.00 61.98 58.55 1i02 s VAL 41 Cb 0.09 -0.74 -0.07 0.00 -1.53 0.00 0.00 36.38 34.14 1i02 s VAL 41 CO 0.83 -0.19 1.96 0.00 -3.33 0.00 0.00 175.10 174.37 1i02 n PRO 43 N 7.82 -2.53 -3.31 0.00 -0.01 -1.26 -4.94 135.00 130.77 1i02 n PRO 43 Ca 0.22 -0.77 -0.38 0.00 -0.01 0.00 0.00 63.50 62.56 1i02 n PRO 43 Cb 0.43 -1.18 -0.06 0.00 -0.01 0.00 0.00 33.50 32.68 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 -3.68 4.13 0.07 -0.52 1.02 -1.26 -4.84 119.74 114.66 1i02 s LYS 44 Ca 0.35 0.66 -0.12 0.00 0.02 0.00 0.00 55.97 56.88 1i02 s LYS 44 Cb -0.06 -3.17 -0.06 0.00 -0.52 0.00 0.00 37.83 34.02 1i02 s LYS 44 CO 0.30 0.61 0.43 -1.12 -0.92 0.00 0.00 175.35 174.65 1i02 s SER 45 N -1.23 6.72 0.00 2.83 0.01 -1.26 -4.75 113.70 116.01 1i02 s SER 45 Ca 0.30 0.89 0.00 0.00 1.31 0.00 0.00 55.95 58.45 1i02 s SER 45 Cb -0.18 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 63.83 1i02 s SER 45 CO 0.18 0.20 0.00 -0.24 0.41 0.00 0.00 173.24 173.79 1i02 n SER 46 N 1.11 0.00 -0.01 2.44 2.88 0.97 -4.98 113.62 116.02 1i02 n SER 46 Ca -0.09 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.35 1i02 n SER 46 Cb 0.52 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.84 1i02 n SER 46 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1i02 h LEU 47 N 0.00 0.07 0.00 2.46 -0.00 -2.01 -3.40 115.31 112.43 1i02 h LEU 47 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 57.88 57.73 1i02 h LEU 47 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 40.64 1i02 h LEU 47 CO 0.00 1.14 -0.49 0.00 -0.00 0.00 0.00 178.44 179.09 1i02 n LEU 48 N -3.13 0.20 -3.99 1.67 -0.00 -1.26 -4.81 117.00 105.68 1i02 n LEU 48 Ca -0.19 -0.39 -0.27 0.00 -0.00 0.00 0.00 56.01 55.17 1i02 n LEU 48 Cb 1.05 0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 44.30 1i02 n LEU 48 CO 0.45 0.05 -0.47 0.54 -0.00 0.00 0.00 177.39 177.96 1i02 s VAL 49 N -1.73 1.26 0.03 1.47 0.11 -1.26 -2.52 120.40 117.76 1i02 s VAL 49 Ca 0.01 -0.47 0.06 0.00 -2.93 0.00 0.00 61.98 58.65 1i02 s VAL 49 Cb 0.04 -1.19 -0.02 0.00 -1.53 0.00 0.00 36.38 33.68 1i02 s VAL 49 CO 0.23 0.40 -0.17 -0.75 -3.33 0.00 0.00 175.10 171.48 1i02 s LYS 50 N 1.25 1.20 -0.28 1.54 2.47 -1.08 -0.02 119.74 124.83 1i02 s LYS 50 Ca -0.02 -0.79 -0.01 0.00 -1.56 0.00 0.00 55.97 53.59 1i02 s LYS 50 Cb -0.14 -1.24 0.04 0.00 -1.46 0.00 0.00 37.83 35.03 1i02 s LYS 50 CO -0.04 0.32 -0.04 0.71 0.16 0.00 0.00 175.35 176.46 1i02 s TYR 51 N -0.72 3.21 -0.10 4.03 1.51 -1.26 -2.44 117.35 121.57 1i02 s TYR 51 Ca 0.05 -1.86 -0.18 0.00 -1.01 0.00 0.00 57.07 54.08 1i02 s TYR 51 Cb -0.08 -2.06 -0.04 0.00 -0.11 0.00 0.00 41.96 39.66 1i02 s TYR 51 CO 0.01 -0.80 0.46 0.08 -1.11 0.00 0.00 175.55 174.20 1i02 s VAL 52 N 1.25 5.16 -0.03 0.71 1.01 -0.96 -4.87 120.40 122.67 1i02 s VAL 52 Ca -0.04 0.93 -0.02 0.00 0.00 0.00 0.00 61.98 62.85 1i02 s VAL 52 Cb -0.19 -3.80 0.01 0.00 0.00 0.00 0.00 36.38 32.41 1i02 s VAL 52 CO -0.03 0.36 0.06 0.00 0.00 0.00 0.00 175.10 175.50 1i02 n ASN 55 N 1.63 5.23 -3.86 0.00 0.23 -1.26 -1.02 115.26 116.21 1i02 n ASN 55 Ca -0.19 -3.11 -0.09 0.00 -0.53 0.00 0.00 54.58 50.65 1i02 n ASN 55 Cb 0.54 -1.47 -0.06 0.00 -2.08 0.00 0.00 39.78 36.71 1i02 n ASN 55 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1i02 s THR 56 N 0.28 0.07 -0.54 5.53 -1.32 -0.18 -4.84 115.64 114.65 1i02 s THR 56 Ca 0.39 -1.13 -0.28 0.00 -1.21 0.00 0.00 61.69 59.47 1i02 s THR 56 Cb 0.07 -1.61 0.03 0.00 -1.51 0.00 0.00 72.50 69.48 1i02 s THR 56 CO 0.01 -0.33 1.11 -0.62 -2.21 0.00 0.00 174.62 172.59 1i02 s ASP 57 N -2.91 6.49 -0.08 8.08 2.15 -1.26 -4.12 116.67 125.02 1i02 s ASP 57 Ca 0.12 0.14 -0.01 0.00 0.43 0.00 0.00 52.55 53.22 1i02 s ASP 57 Cb 0.03 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.12 1i02 s ASP 57 CO -0.04 -1.34 0.09 -1.14 -0.17 0.00 0.00 175.17 172.57 1i02 n ARG 58 N 8.00 -0.26 0.00 4.34 3.00 0.67 -4.84 116.66 127.57 1i02 n ARG 58 Ca 0.08 0.68 0.00 0.00 -0.00 0.00 0.00 57.85 58.62 1i02 n ARG 58 Cb 0.49 -2.09 0.00 0.00 0.00 0.00 0.00 32.46 30.85 1i02 n ARG 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63