#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 -0.04 0.02 1.96 0.00 -1.26 -2.58 119.74 117.84 1i02 s LYS 2 Ca 0.00 0.33 0.03 0.00 0.00 0.00 0.00 55.97 56.33 1i02 s LYS 2 Cb 0.00 -0.36 -0.04 0.00 0.00 0.00 0.00 37.83 37.43 1i02 s LYS 2 CO 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 175.35 175.07 1i02 n ASN 4 N 1.32 -1.89 -4.91 0.00 4.13 -1.26 -0.41 115.26 112.24 1i02 n ASN 4 Ca -0.14 0.64 -0.21 0.00 1.68 0.00 0.00 54.58 56.55 1i02 n ASN 4 Cb 0.52 -1.10 -0.01 0.00 -1.54 0.00 0.00 39.78 37.65 1i02 n ASN 4 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1i02 s LYS 5 N -2.08 2.49 0.38 3.52 0.00 -0.07 -4.29 119.74 119.69 1i02 s LYS 5 Ca 0.64 -1.60 0.19 0.00 0.00 0.00 0.00 55.97 55.20 1i02 s LYS 5 Cb -0.41 -2.40 1.14 0.00 0.00 0.00 0.00 37.83 36.16 1i02 s LYS 5 CO 0.59 -0.34 1.70 1.25 0.00 0.00 0.00 175.35 178.56 1i02 h LEU 6 N 0.85 0.45 -9.66 2.77 6.46 -1.85 -3.40 115.31 110.93 1i02 h LEU 6 Ca -0.39 0.13 -0.59 0.00 -0.12 0.00 0.00 57.88 56.91 1i02 h LEU 6 Cb 1.28 0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 41.23 1i02 h LEU 6 CO 0.54 -0.03 -0.13 -0.69 -0.62 0.00 0.00 178.44 177.51 1i02 s VAL 7 N -5.53 4.92 -0.23 1.05 1.01 -1.26 -4.95 120.40 115.41 1i02 s VAL 7 Ca -0.09 0.99 -0.04 0.00 0.00 0.00 0.00 61.98 62.85 1i02 s VAL 7 Cb 0.28 -3.79 -0.12 0.00 0.00 0.00 0.00 36.38 32.75 1i02 s VAL 7 CO 0.80 0.56 2.13 -0.81 0.00 0.00 0.00 175.10 177.78 1i02 n PRO 8 N 1.89 1.31 0.00 2.72 -0.05 -1.26 -3.25 135.00 136.35 1i02 n PRO 8 Ca -0.12 -0.76 0.00 0.00 -0.05 0.00 0.00 63.50 62.56 1i02 n PRO 8 Cb 0.52 -1.94 0.00 0.00 -0.05 0.00 0.00 33.50 32.03 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 3.14 0.00 -4.71 1.53 4.77 -1.26 -5.14 117.00 115.32 1i02 n LEU 9 Ca 0.28 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.94 1i02 n LEU 9 Cb 0.39 0.03 -0.08 0.00 -2.33 0.00 0.00 43.42 41.43 1i02 n LEU 9 CO 0.32 -0.06 -0.24 0.72 -1.33 0.00 0.00 177.39 176.79 1i02 s PHE 10 N -1.13 1.82 0.05 -1.77 -0.71 -1.20 -5.05 117.98 109.99 1i02 s PHE 10 Ca 0.00 -1.05 -0.08 0.00 -1.04 0.00 0.00 56.93 54.76 1i02 s PHE 10 Cb 0.00 -1.50 -0.00 0.00 -1.21 0.00 0.00 43.02 40.30 1i02 s PHE 10 CO 0.00 0.10 0.17 1.52 -1.34 0.00 0.00 175.22 175.67 1i02 s TYR 11 N -2.95 0.12 0.50 3.49 1.13 -1.26 -0.90 117.35 117.47 1i02 s TYR 11 Ca 0.08 -0.40 0.04 0.00 -1.41 0.00 0.00 57.07 55.38 1i02 s TYR 11 Cb 0.01 -0.07 0.02 0.00 -1.10 0.00 0.00 41.96 40.83 1i02 s TYR 11 CO 0.05 -0.44 0.69 0.15 -2.51 0.00 0.00 175.55 173.49 1i02 s LYS 12 N -2.85 2.66 -0.01 -3.49 1.02 0.46 -4.77 119.74 112.76 1i02 s LYS 12 Ca -0.03 -0.99 -0.09 0.00 0.02 0.00 0.00 55.97 54.88 1i02 s LYS 12 Cb 0.00 -2.61 -0.05 0.00 -0.52 0.00 0.00 37.83 34.66 1i02 s LYS 12 CO -0.06 -0.53 0.29 0.99 -0.92 0.00 0.00 175.35 175.13 1i02 s THR 13 N -2.59 5.25 -0.03 2.17 2.01 -1.26 -1.36 115.64 119.84 1i02 s THR 13 Ca 0.56 0.35 0.07 0.00 0.31 0.00 0.00 61.69 62.99 1i02 s THR 13 Cb -0.10 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 1i02 s THR 13 CO 0.36 0.45 -0.25 0.00 -0.69 0.00 0.00 174.62 174.48 1i02 n PRO 15 N 2.56 -1.94 -2.29 0.00 -0.04 -1.26 -4.61 135.00 127.41 1i02 n PRO 15 Ca -0.16 -0.55 -0.42 0.00 -0.04 0.00 0.00 63.50 62.33 1i02 n PRO 15 Cb 0.51 -1.84 -0.03 0.00 -0.04 0.00 0.00 33.50 32.10 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 -2.28 3.54 0.00 0.55 0.00 -1.26 -3.36 121.76 118.95 1i02 s ALA 16 Ca 0.60 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.41 1i02 s ALA 16 Cb -0.16 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1i02 s ALA 16 CO 0.66 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 176.04 1i02 n GLY 17 N 3.52 3.16 3.44 0.00 0.00 -1.26 -5.03 105.19 109.02 1i02 n GLY 17 Ca 0.12 -1.11 -0.44 0.00 0.00 0.00 0.00 46.02 44.59 1i02 n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i02 s LYS 18 N 0.00 3.39 -0.04 1.61 1.02 -1.21 -4.76 119.74 119.74 1i02 s LYS 18 Ca 0.00 -1.46 0.21 0.00 0.02 0.00 0.00 55.97 54.74 1i02 s LYS 18 Cb 0.00 -4.62 0.67 0.00 -0.52 0.00 0.00 37.83 33.36 1i02 s LYS 18 CO 0.00 -1.75 1.57 -1.71 -0.92 0.00 0.00 175.35 172.54 1i02 n ASN 19 N 6.79 4.24 -4.48 2.83 4.05 -1.24 -4.59 115.26 122.86 1i02 n ASN 19 Ca 0.11 -2.16 -0.43 0.00 0.45 0.00 0.00 54.58 52.55 1i02 n ASN 19 Cb 0.47 -0.52 -0.05 0.00 1.23 0.00 0.00 39.78 40.91 1i02 n ASN 19 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1i02 s LEU 20 N -1.30 4.54 -0.51 1.20 1.02 -0.85 -0.08 118.68 122.71 1i02 s LEU 20 Ca 0.50 -0.64 -0.22 0.00 0.02 0.00 0.00 54.13 53.79 1i02 s LEU 20 Cb 0.28 -2.63 0.04 0.00 0.02 0.00 0.00 46.19 43.90 1i02 s LEU 20 CO 0.30 -1.06 0.78 0.00 0.02 0.00 0.00 176.35 176.39 1i02 s TYR 22 N 3.27 3.23 -0.04 0.00 1.13 -0.42 -2.49 117.35 122.02 1i02 s TYR 22 Ca 0.24 0.26 -0.02 0.00 -1.41 0.00 0.00 57.07 56.14 1i02 s TYR 22 Cb -0.15 -2.34 0.03 0.00 -1.10 0.00 0.00 41.96 38.40 1i02 s TYR 22 CO 0.17 -0.38 0.06 -1.59 -2.51 0.00 0.00 175.55 171.30 1i02 s LYS 23 N -4.58 -0.03 -0.28 -3.49 -2.85 -0.38 -2.02 119.74 106.10 1i02 s LYS 23 Ca 0.49 0.36 -0.09 0.00 -1.00 0.00 0.00 55.97 55.73 1i02 s LYS 23 Cb -0.10 -0.54 -0.02 0.00 -2.06 0.00 0.00 37.83 35.11 1i02 s LYS 23 CO 0.38 -0.33 0.12 1.41 0.10 0.00 0.00 175.35 177.03 1i02 s MET 24 N 2.16 3.51 0.00 1.78 1.75 -1.07 -2.44 119.30 124.99 1i02 s MET 24 Ca 0.05 -0.59 0.00 0.00 -1.25 0.00 0.00 55.69 53.90 1i02 s MET 24 Cb -0.12 -3.47 0.00 0.00 2.84 0.00 0.00 34.83 34.08 1i02 s MET 24 CO -0.03 -0.30 0.00 1.97 -0.65 0.00 0.00 175.02 176.01 1i02 n PHE 25 N 4.96 0.00 -1.65 4.11 -1.74 -1.05 -2.13 117.46 119.96 1i02 n PHE 25 Ca -0.15 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.74 1i02 n PHE 25 Cb 0.50 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.50 1i02 n PHE 25 CO 0.00 0.00 0.00 -1.33 -0.56 0.00 0.00 176.76 174.87 1i02 n MET 26 N 0.00 3.06 0.00 3.97 2.81 -1.26 -2.07 117.12 123.63 1i02 n MET 26 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1i02 n MET 26 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 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 0.00 0.00 -0.18 2.03 0.31 -1.04 -3.85 118.33 115.61 1i02 n VAL 27 Ca 0.00 -0.04 -0.12 0.00 -0.01 0.00 0.00 64.34 64.17 1i02 n VAL 27 Cb 0.00 0.41 -0.09 0.00 -0.91 0.00 0.00 33.84 33.26 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 -0.69 -3.23 3.52 0.00 -1.96 -3.19 119.26 113.71 1i02 h ALA 28 Ca 0.00 0.02 -0.68 0.00 0.00 0.00 0.00 54.91 54.25 1i02 h ALA 28 Cb 0.00 1.14 -0.36 0.00 0.00 0.00 0.00 17.79 18.56 1i02 h ALA 28 CO 0.00 -0.96 -0.46 0.99 0.00 0.00 0.00 179.25 178.83 1i02 s THR 29 N -5.34 3.38 0.00 0.00 2.01 -1.26 -4.96 115.64 109.46 1i02 s THR 29 Ca -0.12 -2.86 -0.01 0.00 0.31 0.00 0.00 61.69 59.01 1i02 s THR 29 Cb 0.08 -3.25 -0.03 0.00 0.01 0.00 0.00 72.50 69.31 1i02 s THR 29 CO 0.55 -0.82 0.89 -0.81 -0.69 0.00 0.00 174.62 173.74 1i02 n PRO 30 N 3.62 0.36 -0.28 4.92 -0.05 -1.21 -2.28 135.00 140.09 1i02 n PRO 30 Ca 0.06 -0.13 0.00 0.00 -0.05 0.00 0.00 63.50 63.38 1i02 n PRO 30 Cb 0.37 -1.51 0.00 0.00 -0.05 0.00 0.00 33.50 32.31 1i02 n PRO 30 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 175.50 176.62 1i02 n LYS 31 N 2.44 0.00 -3.16 0.54 4.81 -1.26 -4.98 118.16 116.56 1i02 n LYS 31 Ca 0.06 -0.10 -0.20 0.00 -0.87 0.00 0.00 58.31 57.19 1i02 n LYS 31 Cb 0.17 -0.07 -0.04 0.00 0.02 0.00 0.00 35.03 35.12 1i02 n LYS 31 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 1i02 n VAL 32 N 0.00 0.35 -0.62 3.15 3.14 -0.97 -5.11 118.33 118.27 1i02 n VAL 32 Ca 0.00 -4.70 -0.30 0.00 -2.96 0.00 0.00 64.34 56.38 1i02 n VAL 32 Cb 0.51 -0.68 0.19 0.00 -1.06 0.00 0.00 33.84 32.81 1i02 n VAL 32 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1i02 n PRO 33 N 0.34 -1.21 0.00 1.45 -0.01 -1.26 -4.82 135.00 129.49 1i02 n PRO 33 Ca 0.26 -0.30 0.00 0.00 -0.01 0.00 0.00 63.50 63.44 1i02 n PRO 33 Cb 0.60 -2.21 0.00 0.00 -0.01 0.00 0.00 33.50 31.88 1i02 n PRO 33 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 175.50 176.82 1i02 n VAL 34 N -4.45 0.00 -3.06 -1.45 0.24 -1.24 -4.99 118.33 103.37 1i02 n VAL 34 Ca 0.08 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 62.00 1i02 n VAL 34 Cb 0.53 -0.38 -0.06 0.00 -1.47 0.00 0.00 33.84 32.47 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 -1.64 4.39 -0.26 7.34 -0.14 -0.91 -4.85 119.74 123.68 1i02 s LYS 35 Ca 0.00 0.99 -0.03 0.00 -1.36 0.00 0.00 55.97 55.57 1i02 s LYS 35 Cb 0.00 -3.10 0.09 0.00 -1.68 0.00 0.00 37.83 33.14 1i02 s LYS 35 CO 0.00 0.51 0.10 1.03 -0.76 0.00 0.00 175.35 176.23 1i02 s ARG 36 N -1.49 0.36 0.00 1.68 3.00 -1.26 -2.59 118.95 118.66 1i02 s ARG 36 Ca 0.38 -0.57 0.00 0.00 0.00 0.00 0.00 55.73 55.54 1i02 s ARG 36 Cb -0.20 -1.60 0.00 0.00 0.00 0.00 0.00 34.95 33.15 1i02 s ARG 36 CO 0.23 -0.90 0.00 0.41 0.00 0.00 0.00 175.30 175.04 1i02 n GLY 37 N 5.13 4.14 3.54 -3.53 0.00 -0.86 -4.16 105.19 109.46 1i02 n GLY 37 Ca -0.06 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.62 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 -1.16 0.60 -0.11 0.00 1.01 0.80 -4.74 121.20 117.59 1i02 s ILE 39 Ca 0.20 -1.85 0.10 0.00 0.00 0.00 0.00 60.65 59.09 1i02 s ILE 39 Cb -0.11 -1.57 -0.14 0.00 0.01 0.00 0.00 42.46 40.65 1i02 s ILE 39 CO 0.12 -0.86 0.03 -0.90 0.00 0.00 0.00 174.94 173.33 1i02 n ASP 40 N 0.10 2.23 -3.82 3.58 5.68 -1.26 -2.00 116.55 121.06 1i02 n ASP 40 Ca -0.13 -0.00 -0.19 0.00 -0.50 0.00 0.00 54.79 53.97 1i02 n ASP 40 Cb 0.60 0.73 -0.16 0.00 -1.14 0.00 0.00 41.12 41.15 1i02 n ASP 40 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1i02 s VAL 41 N -2.28 0.27 -0.23 2.12 0.11 -1.26 -4.90 120.40 114.23 1i02 s VAL 41 Ca -0.06 0.06 -0.23 0.00 -2.93 0.00 0.00 61.98 58.82 1i02 s VAL 41 Cb 0.03 -0.36 -0.01 0.00 -1.53 0.00 0.00 36.38 34.51 1i02 s VAL 41 CO 0.46 0.18 0.75 0.00 -3.33 0.00 0.00 175.10 173.15 1i02 n PRO 43 N 5.69 -1.10 -3.91 0.00 -0.01 -1.26 -5.03 135.00 129.38 1i02 n PRO 43 Ca 0.03 0.00 -0.23 0.00 -0.01 0.00 0.00 63.50 63.29 1i02 n PRO 43 Cb 0.48 0.00 -0.05 0.00 -0.01 0.00 0.00 33.50 33.92 1i02 n PRO 43 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 175.50 173.90 1i02 s LYS 44 N -2.26 2.41 0.77 -0.52 -2.85 -1.26 -4.89 119.74 111.13 1i02 s LYS 44 Ca 0.00 -1.62 -0.12 0.00 -1.00 0.00 0.00 55.97 53.23 1i02 s LYS 44 Cb 0.00 -2.20 0.06 0.00 -2.06 0.00 0.00 37.83 33.63 1i02 s LYS 44 CO 0.00 -0.07 1.13 -1.54 0.10 0.00 0.00 175.35 174.97 1i02 s SER 45 N -3.97 4.24 0.00 0.03 1.04 -1.26 -4.63 113.70 109.14 1i02 s SER 45 Ca 0.43 2.04 0.00 0.00 0.48 0.00 0.00 55.95 58.90 1i02 s SER 45 Cb -0.01 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1i02 s SER 45 CO 0.25 -2.22 0.00 -0.24 0.98 0.00 0.00 173.24 172.01 1i02 n SER 46 N -3.28 0.98 0.16 7.02 2.88 -0.38 -5.02 113.62 115.99 1i02 n SER 46 Ca 0.11 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.57 1i02 n SER 46 Cb 0.52 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.94 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 -0.41 -1.99 2.46 3.38 -2.03 -3.40 115.31 113.32 1i02 h LEU 47 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1i02 h LEU 47 Cb 0.00 0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1i02 h LEU 47 CO 0.00 0.03 0.00 0.18 0.09 0.00 0.00 178.44 178.74 1i02 n LEU 48 N -5.10 1.49 -4.21 1.67 4.77 -1.26 -4.91 117.00 109.46 1i02 n LEU 48 Ca -0.06 -1.49 -0.21 0.00 -0.03 0.00 0.00 56.01 54.21 1i02 n LEU 48 Cb 0.19 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.16 1i02 n LEU 48 CO 0.15 0.37 -0.48 0.54 -1.33 0.00 0.00 177.39 176.64 1i02 s VAL 49 N -0.50 1.36 0.10 4.08 0.11 -1.26 -2.48 120.40 121.81 1i02 s VAL 49 Ca 0.00 -1.28 -0.04 0.00 -2.93 0.00 0.00 61.98 57.73 1i02 s VAL 49 Cb 0.00 -1.24 -0.03 0.00 -1.53 0.00 0.00 36.38 33.58 1i02 s VAL 49 CO 0.00 -0.06 0.10 -0.75 -3.33 0.00 0.00 175.10 171.06 1i02 s LYS 50 N -1.55 0.85 -0.13 1.54 2.20 -0.88 -1.24 119.74 120.53 1i02 s LYS 50 Ca 0.03 -1.22 -0.01 0.00 -0.36 0.00 0.00 55.97 54.40 1i02 s LYS 50 Cb -0.09 0.28 0.04 0.00 -1.51 0.00 0.00 37.83 36.54 1i02 s LYS 50 CO 0.02 -0.24 -0.02 0.71 -0.36 0.00 0.00 175.35 175.46 1i02 s TYR 51 N -3.95 1.21 -0.19 4.03 1.51 -1.26 -2.52 117.35 116.17 1i02 s TYR 51 Ca 0.13 -0.68 -0.11 0.00 -1.01 0.00 0.00 57.07 55.40 1i02 s TYR 51 Cb 0.06 -1.08 -0.05 0.00 -0.11 0.00 0.00 41.96 40.78 1i02 s TYR 51 CO -0.05 -0.50 0.17 0.08 -1.11 0.00 0.00 175.55 174.14 1i02 s VAL 52 N 1.80 5.38 -0.04 0.71 1.01 -1.02 -4.83 120.40 123.40 1i02 s VAL 52 Ca 0.03 0.28 0.03 0.00 0.00 0.00 0.00 61.98 62.31 1i02 s VAL 52 Cb -0.14 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.74 1i02 s VAL 52 CO -0.07 0.42 -0.11 0.00 0.00 0.00 0.00 175.10 175.34 1i02 n ASN 55 N 2.95 6.96 -4.02 0.00 3.02 -1.25 -0.02 115.26 122.90 1i02 n ASN 55 Ca -0.18 -3.12 -0.09 0.00 -0.03 0.00 0.00 54.58 51.16 1i02 n ASN 55 Cb 0.52 -1.41 -0.06 0.00 -0.61 0.00 0.00 39.78 38.23 1i02 n ASN 55 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1i02 s THR 56 N -0.54 0.00 -0.22 3.41 -4.23 0.89 -4.84 115.64 110.10 1i02 s THR 56 Ca 0.49 -1.47 -0.25 0.00 -1.18 0.00 0.00 61.69 59.28 1i02 s THR 56 Cb 0.15 -2.22 -0.01 0.00 1.34 0.00 0.00 72.50 71.76 1i02 s THR 56 CO -0.06 -0.01 0.82 -1.81 -0.54 0.00 0.00 174.62 173.03 1i02 s ASP 57 N -3.03 6.86 -0.68 3.99 1.01 -1.26 -4.11 116.67 119.46 1i02 s ASP 57 Ca 0.24 1.07 -0.03 0.00 0.71 0.00 0.00 52.55 54.54 1i02 s ASP 57 Cb 0.00 -2.44 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 1i02 s ASP 57 CO 0.09 -0.48 0.60 -1.14 0.21 0.00 0.00 175.17 174.46 1i02 n ARG 58 N 5.76 -1.40 0.00 8.23 0.00 0.20 -4.96 116.66 124.49 1i02 n ARG 58 Ca 0.05 0.77 0.00 0.00 -0.00 0.00 0.00 57.85 58.67 1i02 n ARG 58 Cb 0.48 -4.53 0.00 0.00 0.00 0.00 0.00 32.46 28.41 1i02 n ARG 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63