#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 0.54 0.18 1.96 0.00 -1.26 -2.30 119.74 118.86 1i02 s LYS 2 Ca 0.00 0.11 0.11 0.00 0.00 0.00 0.00 55.97 56.19 1i02 s LYS 2 Cb 0.00 0.25 -0.04 0.00 0.00 0.00 0.00 37.83 38.04 1i02 s LYS 2 CO 0.00 -0.12 -0.23 0.00 0.00 0.00 0.00 175.35 174.99 1i02 n ASN 4 N 0.35 -0.10 -4.95 0.00 3.02 -1.26 -0.35 115.26 111.97 1i02 n ASN 4 Ca -0.13 0.84 -0.23 0.00 -0.03 0.00 0.00 54.58 55.03 1i02 n ASN 4 Cb 0.56 -1.25 0.05 0.00 -0.61 0.00 0.00 39.78 38.52 1i02 n ASN 4 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1i02 s LYS 5 N -2.15 2.48 0.51 3.52 -0.14 -0.10 -4.35 119.74 119.52 1i02 s LYS 5 Ca 0.68 -0.55 0.31 0.00 -1.36 0.00 0.00 55.97 55.06 1i02 s LYS 5 Cb -0.49 -2.38 1.44 0.00 -1.68 0.00 0.00 37.83 34.72 1i02 s LYS 5 CO 0.54 -0.86 1.83 1.25 -0.76 0.00 0.00 175.35 177.35 1i02 h LEU 6 N -0.14 0.09 -9.83 3.17 6.46 -1.87 -3.38 115.31 109.81 1i02 h LEU 6 Ca -0.43 0.02 -0.60 0.00 -0.12 0.00 0.00 57.88 56.75 1i02 h LEU 6 Cb 1.30 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 41.18 1i02 h LEU 6 CO 0.56 0.02 -0.28 -0.69 -0.62 0.00 0.00 178.44 177.43 1i02 s VAL 7 N -5.06 5.14 -1.74 1.05 1.01 -1.26 -4.97 120.40 114.56 1i02 s VAL 7 Ca -0.06 0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.27 1i02 s VAL 7 Cb 0.23 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1i02 s VAL 7 CO 0.79 0.26 0.62 -0.81 0.00 0.00 0.00 175.10 175.96 1i02 n PRO 8 N 0.81 0.71 -0.09 2.72 -0.05 -1.26 -3.58 135.00 134.26 1i02 n PRO 8 Ca -0.08 0.00 -0.14 0.00 -0.05 0.00 0.00 63.50 63.23 1i02 n PRO 8 Cb 0.52 -1.09 -0.08 0.00 -0.05 0.00 0.00 33.50 32.80 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 -0.33 2.78 0.00 1.53 4.32 -1.26 -5.05 117.00 118.98 1i02 n LEU 9 Ca 0.00 -0.06 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 1i02 n LEU 9 Cb 0.05 -0.65 0.00 0.00 -1.62 0.00 0.00 43.42 41.20 1i02 n LEU 9 CO 0.00 0.77 0.00 2.22 -1.22 0.00 0.00 177.39 179.16 1i02 n PHE 10 N -3.16 0.00 -3.99 -1.77 -1.74 -1.23 -5.04 117.46 100.53 1i02 n PHE 10 Ca -0.34 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.45 1i02 n PHE 10 Cb 0.84 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.78 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 -0.78 0.41 0.49 2.97 -0.85 -1.26 -0.93 117.35 117.41 1i02 s TYR 11 Ca 0.00 -0.76 0.06 0.00 -0.52 0.00 0.00 57.07 55.85 1i02 s TYR 11 Cb 0.00 0.08 -0.00 0.00 0.38 0.00 0.00 41.96 42.42 1i02 s TYR 11 CO 0.00 -0.89 0.28 0.21 -1.52 0.00 0.00 175.55 173.63 1i02 s LYS 12 N -4.01 2.27 0.07 -3.49 2.36 0.52 -4.68 119.74 112.78 1i02 s LYS 12 Ca 0.22 -1.98 0.06 0.00 -2.55 0.00 0.00 55.97 51.72 1i02 s LYS 12 Cb 0.01 -2.01 -0.04 0.00 -1.05 0.00 0.00 37.83 34.74 1i02 s LYS 12 CO 0.06 -0.40 -0.07 0.99 1.55 0.00 0.00 175.35 177.48 1i02 s THR 13 N -2.71 3.58 -0.08 3.43 2.01 -1.26 -1.35 115.64 119.26 1i02 s THR 13 Ca 0.33 -1.07 0.00 0.00 0.31 0.00 0.00 61.69 61.26 1i02 s THR 13 Cb -0.00 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1i02 s THR 13 CO 0.20 0.19 -0.06 0.00 -0.69 0.00 0.00 174.62 174.26 1i02 n PRO 15 N 2.35 -2.22 -2.13 0.00 -0.04 -1.26 -4.72 135.00 126.97 1i02 n PRO 15 Ca -0.18 -0.62 -0.41 0.00 -0.04 0.00 0.00 63.50 62.24 1i02 n PRO 15 Cb 0.53 -2.03 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 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 -2.36 3.57 0.00 0.55 0.00 -1.26 -2.85 121.76 119.42 1i02 s ALA 16 Ca 0.65 1.20 0.00 0.00 0.00 0.00 0.00 51.96 53.81 1i02 s ALA 16 Cb -0.22 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.39 1i02 s ALA 16 CO 0.66 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 176.20 1i02 n GLY 17 N 2.40 1.25 2.97 0.00 0.00 -1.26 -5.05 105.19 105.50 1i02 n GLY 17 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.68 1.90 0.00 1.61 -0.14 -1.13 -4.85 119.74 116.45 1i02 s LYS 18 Ca 0.00 -0.78 0.06 0.00 -1.36 0.00 0.00 55.97 53.89 1i02 s LYS 18 Cb 0.00 -2.34 0.16 0.00 -1.68 0.00 0.00 37.83 33.97 1i02 s LYS 18 CO 0.00 -0.43 1.12 0.09 -0.76 0.00 0.00 175.35 175.37 1i02 n ASN 19 N 4.72 2.46 -4.91 2.83 4.13 -1.25 -4.62 115.26 118.61 1i02 n ASN 19 Ca -0.14 -1.98 -0.28 0.00 1.68 0.00 0.00 54.58 53.85 1i02 n ASN 19 Cb 0.47 -0.12 -0.03 0.00 -1.54 0.00 0.00 39.78 38.56 1i02 n ASN 19 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1i02 s LEU 20 N -0.99 4.16 -0.14 3.41 2.96 -0.37 -2.10 118.68 125.62 1i02 s LEU 20 Ca 0.12 0.56 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 1i02 s LEU 20 Cb 0.06 -3.34 0.02 0.00 0.50 0.00 0.00 46.19 43.43 1i02 s LEU 20 CO 0.08 -0.09 -0.13 0.00 -1.32 0.00 0.00 176.35 174.89 1i02 s TYR 22 N 1.49 2.91 -0.21 0.00 1.13 -0.14 -2.22 117.35 120.31 1i02 s TYR 22 Ca 0.04 -0.15 -0.01 0.00 -1.41 0.00 0.00 57.07 55.54 1i02 s TYR 22 Cb -0.13 -1.33 0.06 0.00 -1.10 0.00 0.00 41.96 39.46 1i02 s TYR 22 CO -0.09 0.56 -0.01 -1.59 -2.51 0.00 0.00 175.55 171.91 1i02 s LYS 23 N -3.56 1.11 -0.54 -3.49 0.00 0.64 -1.39 119.74 112.52 1i02 s LYS 23 Ca 0.31 -0.66 -0.21 0.00 0.00 0.00 0.00 55.97 55.41 1i02 s LYS 23 Cb -0.08 -2.30 0.06 0.00 0.00 0.00 0.00 37.83 35.51 1i02 s LYS 23 CO 0.22 -0.61 0.76 1.41 0.00 0.00 0.00 175.35 177.13 1i02 s MET 24 N 1.65 3.18 0.20 1.78 -2.45 -0.84 -2.27 119.30 120.55 1i02 s MET 24 Ca -0.03 -0.72 -0.02 0.00 -1.25 0.00 0.00 55.69 53.68 1i02 s MET 24 Cb -0.18 -4.11 -0.04 0.00 1.25 0.00 0.00 34.83 31.76 1i02 s MET 24 CO -0.07 -1.38 0.14 -0.59 1.05 0.00 0.00 175.02 174.18 1i02 s PHE 25 N 3.16 1.12 0.45 4.11 -0.71 -0.94 -2.49 117.98 122.68 1i02 s PHE 25 Ca 0.20 -1.35 -0.03 0.00 -1.04 0.00 0.00 56.93 54.72 1i02 s PHE 25 Cb -0.17 -0.53 -0.02 0.00 -1.21 0.00 0.00 43.02 41.09 1i02 s PHE 25 CO 0.14 -0.65 0.72 -1.64 -1.34 0.00 0.00 175.22 172.44 1i02 s MET 26 N -4.15 3.36 0.00 1.99 -1.94 -1.26 -0.94 119.30 116.35 1i02 s MET 26 Ca 0.38 -0.09 0.15 0.00 -1.71 0.00 0.00 55.69 54.43 1i02 s MET 26 Cb 0.07 -2.47 0.77 0.00 2.01 0.00 0.00 34.83 35.20 1i02 s MET 26 CO 0.12 -0.19 1.43 0.28 -0.01 0.00 0.00 175.02 176.65 1i02 n VAL 27 N -2.15 0.59 0.17 -6.03 0.31 -1.26 -1.97 118.33 107.99 1i02 n VAL 27 Ca -0.00 0.15 0.06 0.00 -0.01 0.00 0.00 64.34 64.54 1i02 n VAL 27 Cb 0.56 -0.89 0.13 0.00 -0.91 0.00 0.00 33.84 32.73 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 2.71 0.81 -1.93 3.52 0.00 -1.89 -3.34 119.26 119.15 1i02 h ALA 28 Ca 0.00 -0.29 -0.49 0.00 0.00 0.00 0.00 54.91 54.13 1i02 h ALA 28 Cb 0.15 -0.05 -0.40 0.00 0.00 0.00 0.00 17.79 17.49 1i02 h ALA 28 CO 0.00 0.40 -1.11 0.25 0.00 0.00 0.00 179.25 178.80 1i02 n THR 29 N -3.21 0.49 0.24 0.00 -2.24 -0.83 -4.91 114.28 103.81 1i02 n THR 29 Ca 0.02 -4.58 0.08 0.00 -2.27 0.00 0.00 64.05 57.29 1i02 n THR 29 Cb 0.63 -0.35 0.59 0.00 -2.10 0.00 0.00 70.33 69.10 1i02 n THR 29 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1i02 h PRO 30 N 2.99 0.00 -0.25 -0.78 0.14 -1.68 -1.14 132.00 131.28 1i02 h PRO 30 Ca 0.09 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.23 1i02 h PRO 30 Cb 0.92 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.06 1i02 h PRO 30 CO 0.55 0.13 0.00 1.17 0.14 0.00 0.00 178.00 180.00 1i02 n LYS 31 N -4.22 1.65 -3.07 0.86 3.00 -1.26 -4.41 118.16 110.71 1i02 n LYS 31 Ca -0.02 -1.01 -0.15 0.00 -0.00 0.00 0.00 58.31 57.12 1i02 n LYS 31 Cb 0.21 -1.26 -0.04 0.00 0.00 0.00 0.00 35.03 33.93 1i02 n LYS 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1i02 n VAL 32 N 0.29 -0.60 -0.98 3.15 0.31 -0.43 -5.14 118.33 114.93 1i02 n VAL 32 Ca 0.11 -2.23 -0.33 0.00 -0.01 0.00 0.00 64.34 61.88 1i02 n VAL 32 Cb 0.25 -0.31 0.13 0.00 -0.91 0.00 0.00 33.84 33.00 1i02 n VAL 32 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1i02 n PRO 33 N 2.82 -0.01 -0.06 5.55 -0.02 -1.25 -4.85 135.00 137.18 1i02 n PRO 33 Ca 0.24 0.07 -0.11 0.00 -2.02 0.00 0.00 63.50 61.68 1i02 n PRO 33 Cb 0.52 -2.32 -0.05 0.00 -0.02 0.00 0.00 33.50 31.63 1i02 n PRO 33 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1i02 n VAL 34 N -3.49 0.66 -3.84 -1.45 0.24 -1.24 -5.00 118.33 104.21 1i02 n VAL 34 Ca 0.12 -0.20 -0.33 0.00 -2.04 0.00 0.00 64.34 61.89 1i02 n VAL 34 Cb 0.51 -1.36 -0.05 0.00 -1.47 0.00 0.00 33.84 31.48 1i02 n VAL 34 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1i02 s LYS 35 N -2.22 3.50 -0.09 7.34 2.20 -1.04 -4.95 119.74 124.47 1i02 s LYS 35 Ca -0.16 -0.26 -0.03 0.00 -0.36 0.00 0.00 55.97 55.16 1i02 s LYS 35 Cb 0.05 -3.04 0.04 0.00 -1.51 0.00 0.00 37.83 33.37 1i02 s LYS 35 CO 0.23 0.62 0.05 0.50 -0.36 0.00 0.00 175.35 176.40 1i02 s ARG 36 N -2.16 0.16 0.00 4.03 3.52 -1.26 -1.98 118.95 121.26 1i02 s ARG 36 Ca 0.32 0.14 0.00 0.00 -0.13 0.00 0.00 55.73 56.06 1i02 s ARG 36 Cb -0.13 -1.06 0.00 0.00 -1.56 0.00 0.00 34.95 32.20 1i02 s ARG 36 CO 0.22 -0.43 0.00 0.41 -0.81 0.00 0.00 175.30 174.68 1i02 n GLY 37 N 5.24 4.08 3.51 8.12 0.00 -0.49 -4.49 105.19 121.17 1i02 n GLY 37 Ca -0.05 -1.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.80 1.20 -0.06 0.00 1.01 0.28 -4.69 121.20 118.15 1i02 s ILE 39 Ca 0.13 -2.04 0.04 0.00 0.00 0.00 0.00 60.65 58.78 1i02 s ILE 39 Cb -0.11 -2.56 -0.07 0.00 0.01 0.00 0.00 42.46 39.73 1i02 s ILE 39 CO 0.02 -0.17 0.00 -0.90 0.00 0.00 0.00 174.94 173.89 1i02 n ASP 40 N -0.56 3.56 -3.78 3.58 5.75 -1.26 -1.24 116.55 122.60 1i02 n ASP 40 Ca -0.04 -0.01 -0.14 0.00 -0.01 0.00 0.00 54.79 54.60 1i02 n ASP 40 Cb 0.65 0.49 -0.15 0.00 -1.03 0.00 0.00 41.12 41.08 1i02 n ASP 40 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1i02 s VAL 41 N -2.14 -0.04 -0.02 2.12 1.01 -1.26 -4.86 120.40 115.21 1i02 s VAL 41 Ca -0.04 0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.92 1i02 s VAL 41 Cb 0.02 -0.13 -0.05 0.00 0.00 0.00 0.00 36.38 36.22 1i02 s VAL 41 CO 0.22 0.06 0.46 0.00 0.00 0.00 0.00 175.10 175.84 1i02 n PRO 43 N 2.34 1.51 -4.06 0.00 -0.02 -1.26 -5.05 135.00 128.45 1i02 n PRO 43 Ca -0.11 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.11 1i02 n PRO 43 Cb 0.52 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.95 1i02 n PRO 43 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1i02 s LYS 44 N 0.00 2.27 0.01 -0.52 -2.85 -1.26 -4.97 119.74 112.42 1i02 s LYS 44 Ca 0.00 -1.91 -0.16 0.00 -1.00 0.00 0.00 55.97 52.90 1i02 s LYS 44 Cb 0.00 -2.01 -0.06 0.00 -2.06 0.00 0.00 37.83 33.70 1i02 s LYS 44 CO 0.00 -0.28 0.46 -1.12 0.10 0.00 0.00 175.35 174.51 1i02 s SER 45 N -4.02 6.88 0.06 0.03 0.01 -1.26 -4.24 113.70 111.16 1i02 s SER 45 Ca 0.37 1.04 0.04 0.00 1.31 0.00 0.00 55.95 58.70 1i02 s SER 45 Cb 0.01 -2.29 -0.03 0.00 0.21 0.00 0.00 66.02 63.93 1i02 s SER 45 CO 0.21 0.28 -0.11 -0.55 0.41 0.00 0.00 173.24 173.48 1i02 s SER 46 N -0.93 1.35 0.16 2.44 0.15 -0.05 -5.02 113.70 111.80 1i02 s SER 46 Ca 0.25 -0.61 0.20 0.00 0.70 0.00 0.00 55.95 56.49 1i02 s SER 46 Cb -0.17 -0.01 0.83 0.00 -1.71 0.00 0.00 66.02 64.95 1i02 s SER 46 CO 0.15 -0.14 1.60 -0.11 1.20 0.00 0.00 173.24 175.94 1i02 n LEU 47 N 1.29 0.40 -0.03 3.45 7.94 -1.26 -2.85 117.00 125.95 1i02 n LEU 47 Ca -0.21 0.60 0.01 0.00 -1.11 0.00 0.00 56.01 55.30 1i02 n LEU 47 Cb 0.55 -0.56 -0.09 0.00 0.53 0.00 0.00 43.42 43.85 1i02 n LEU 47 CO 0.22 -0.46 -0.74 -0.11 -1.11 0.00 0.00 177.39 175.18 1i02 n LEU 48 N -1.95 0.00 -3.82 -1.96 7.94 -1.26 -4.59 117.00 111.36 1i02 n LEU 48 Ca 0.02 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.80 1i02 n LEU 48 Cb 0.19 0.13 -0.11 0.00 0.53 0.00 0.00 43.42 44.16 1i02 n LEU 48 CO 0.17 0.13 -0.14 0.54 -1.11 0.00 0.00 177.39 176.97 1i02 s VAL 49 N -2.57 0.04 -0.04 1.96 0.11 -1.13 -4.12 120.40 114.64 1i02 s VAL 49 Ca -0.05 -0.32 -0.02 0.00 -2.93 0.00 0.00 61.98 58.66 1i02 s VAL 49 Cb 0.06 -0.38 0.03 0.00 -1.53 0.00 0.00 36.38 34.55 1i02 s VAL 49 CO 0.48 -0.17 0.10 -0.75 -3.33 0.00 0.00 175.10 171.43 1i02 s LYS 50 N -0.61 0.07 -0.05 1.54 2.20 -0.12 -0.87 119.74 121.90 1i02 s LYS 50 Ca -0.07 0.24 0.03 0.00 -0.36 0.00 0.00 55.97 55.80 1i02 s LYS 50 Cb -0.04 -0.10 -0.03 0.00 -1.51 0.00 0.00 37.83 36.15 1i02 s LYS 50 CO 0.01 -0.10 -0.11 0.71 -0.36 0.00 0.00 175.35 175.50 1i02 s TYR 51 N 0.70 2.80 -0.10 4.03 1.51 -1.26 -2.22 117.35 122.81 1i02 s TYR 51 Ca -0.05 -0.08 0.02 0.00 -1.01 0.00 0.00 57.07 55.95 1i02 s TYR 51 Cb -0.07 -1.66 0.01 0.00 -0.11 0.00 0.00 41.96 40.13 1i02 s TYR 51 CO -0.03 0.26 -0.17 0.08 -1.11 0.00 0.00 175.55 174.58 1i02 s VAL 52 N -0.78 1.56 0.03 0.71 1.01 -0.96 -4.87 120.40 117.10 1i02 s VAL 52 Ca 0.12 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1i02 s VAL 52 Cb -0.11 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 1i02 s VAL 52 CO 0.01 0.45 -0.07 0.00 0.00 0.00 0.00 175.10 175.50 1i02 n ASN 55 N 2.97 5.20 0.00 0.00 5.15 -1.26 -1.55 115.26 125.77 1i02 n ASN 55 Ca -0.16 -3.08 0.00 0.00 -0.60 0.00 0.00 54.58 50.73 1i02 n ASN 55 Cb 0.54 -1.50 0.00 0.00 -0.53 0.00 0.00 39.78 38.30 1i02 n ASN 55 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1i02 n THR 56 N 3.61 0.00 -4.06 -0.44 -2.24 -0.89 -4.91 114.28 105.36 1i02 n THR 56 Ca 0.38 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 62.00 1i02 n THR 56 Cb 0.38 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.46 1i02 n THR 56 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1i02 s ASP 57 N 1.51 0.51 -1.50 3.42 1.01 -1.26 -4.46 116.67 115.89 1i02 s ASP 57 Ca 0.00 -0.07 -0.14 0.00 0.71 0.00 0.00 52.55 53.05 1i02 s ASP 57 Cb 0.00 -0.15 0.11 0.00 1.01 0.00 0.00 42.92 43.89 1i02 s ASP 57 CO 0.00 -0.01 0.73 0.54 0.21 0.00 0.00 175.17 176.65 1i02 n ARG 58 N 3.44 -3.90 -0.21 8.23 5.12 0.51 -4.81 116.66 125.04 1i02 n ARG 58 Ca -0.18 0.47 0.12 0.00 -1.93 0.00 0.00 57.85 56.33 1i02 n ARG 58 Cb 0.55 -5.25 0.25 0.00 -1.16 0.00 0.00 32.46 26.85 1i02 n ARG 58 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70