#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 1.35 -0.01 1.47 -2.85 -1.26 -1.15 119.74 117.28 1i02 s LYS 2 Ca 0.00 -1.71 -0.11 0.00 -1.00 0.00 0.00 55.97 53.15 1i02 s LYS 2 Cb 0.00 -0.24 0.01 0.00 -2.06 0.00 0.00 37.83 35.54 1i02 s LYS 2 CO 0.00 -0.27 0.22 0.00 0.10 0.00 0.00 175.35 175.40 1i02 n ASN 4 N 1.50 1.19 -4.50 0.00 5.03 -1.26 0.15 115.26 117.37 1i02 n ASN 4 Ca -0.21 1.14 -0.25 0.00 0.87 0.00 0.00 54.58 56.13 1i02 n ASN 4 Cb 0.56 -1.19 0.14 0.00 -1.02 0.00 0.00 39.78 38.27 1i02 n ASN 4 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 1i02 s LYS 5 N -0.34 1.28 0.39 3.52 0.00 -0.45 -4.41 119.74 119.73 1i02 s LYS 5 Ca 0.74 -1.13 0.18 0.00 0.00 0.00 0.00 55.97 55.76 1i02 s LYS 5 Cb -0.88 -2.23 1.09 0.00 0.00 0.00 0.00 37.83 35.80 1i02 s LYS 5 CO 0.52 -1.78 1.77 -0.07 0.00 0.00 0.00 175.35 175.79 1i02 h LEU 6 N -0.83 0.47 -9.63 2.77 3.38 -1.84 -3.39 115.31 106.23 1i02 h LEU 6 Ca -0.36 0.09 -0.64 0.00 0.09 0.00 0.00 57.88 57.06 1i02 h LEU 6 Cb 1.25 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.95 1i02 h LEU 6 CO 0.36 0.09 -0.37 -0.69 0.09 0.00 0.00 178.44 177.91 1i02 s VAL 7 N -5.51 5.32 -1.83 1.22 1.01 -1.26 -4.95 120.40 114.39 1i02 s VAL 7 Ca -0.09 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.35 1i02 s VAL 7 Cb 0.25 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 33.11 1i02 s VAL 7 CO 0.80 0.59 0.39 -0.81 0.00 0.00 0.00 175.10 176.07 1i02 n PRO 8 N 2.02 0.42 -0.11 2.72 -0.05 -1.26 -3.09 135.00 135.65 1i02 n PRO 8 Ca -0.17 0.00 -0.20 0.00 -0.05 0.00 0.00 63.50 63.08 1i02 n PRO 8 Cb 0.54 -1.04 -0.12 0.00 -0.05 0.00 0.00 33.50 32.83 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 -0.37 2.81 -4.62 1.53 4.77 -1.26 -5.03 117.00 114.83 1i02 n LEU 9 Ca 0.00 -0.03 -0.29 0.00 -0.03 0.00 0.00 56.01 55.66 1i02 n LEU 9 Cb 0.02 -0.94 -0.07 0.00 -2.33 0.00 0.00 43.42 40.10 1i02 n LEU 9 CO 0.00 0.88 -0.21 0.72 -1.33 0.00 0.00 177.39 177.46 1i02 s PHE 10 N -2.52 1.78 0.31 -1.77 -0.71 -1.18 -5.06 117.98 108.82 1i02 s PHE 10 Ca -0.33 -1.21 0.04 0.00 -1.04 0.00 0.00 56.93 54.38 1i02 s PHE 10 Cb 0.09 -1.31 -0.04 0.00 -1.21 0.00 0.00 43.02 40.55 1i02 s PHE 10 CO 0.62 -0.14 0.17 1.52 -1.34 0.00 0.00 175.22 176.05 1i02 s TYR 11 N -3.07 1.61 0.46 3.49 -0.85 -1.26 -1.34 117.35 116.38 1i02 s TYR 11 Ca 0.14 -1.41 0.06 0.00 -0.52 0.00 0.00 57.07 55.33 1i02 s TYR 11 Cb 0.01 -0.84 -0.03 0.00 0.38 0.00 0.00 41.96 41.49 1i02 s TYR 11 CO 0.10 -0.57 0.16 0.21 -1.52 0.00 0.00 175.55 173.93 1i02 s LYS 12 N -3.77 2.19 -0.14 -3.49 2.20 0.12 -4.65 119.74 112.21 1i02 s LYS 12 Ca 0.36 -2.03 -0.06 0.00 -0.36 0.00 0.00 55.97 53.87 1i02 s LYS 12 Cb 0.04 -1.86 -0.04 0.00 -1.51 0.00 0.00 37.83 34.46 1i02 s LYS 12 CO 0.19 -0.26 0.08 0.99 -0.36 0.00 0.00 175.35 175.98 1i02 s THR 13 N -2.71 4.94 -0.31 3.43 2.01 -1.26 -0.67 115.64 121.07 1i02 s THR 13 Ca 0.31 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 62.14 1i02 s THR 13 Cb 0.03 -3.17 -0.02 0.00 0.01 0.00 0.00 72.50 69.35 1i02 s THR 13 CO 0.17 0.54 0.49 0.00 -0.69 0.00 0.00 174.62 175.14 1i02 n PRO 15 N 5.61 -2.22 -1.30 0.00 -0.04 -1.26 -3.76 135.00 132.03 1i02 n PRO 15 Ca -0.05 -0.62 -0.35 0.00 -0.04 0.00 0.00 63.50 62.44 1i02 n PRO 15 Cb 0.49 -2.11 0.09 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 n ALA 16 N -4.86 -0.44 -0.97 0.55 0.00 -1.26 -1.90 120.51 111.64 1i02 n ALA 16 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1i02 n ALA 16 Cb 0.55 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.91 1i02 n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i02 n GLY 17 N 1.11 0.90 3.03 0.00 0.00 -1.26 -4.98 105.19 103.99 1i02 n GLY 17 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.08 1.70 -0.01 1.61 1.02 -0.80 -4.36 119.74 118.83 1i02 s LYS 18 Ca 0.00 -0.42 0.01 0.00 0.02 0.00 0.00 55.97 55.58 1i02 s LYS 18 Cb 0.00 -1.41 0.02 0.00 -0.52 0.00 0.00 37.83 35.92 1i02 s LYS 18 CO 0.00 0.04 0.73 0.09 -0.92 0.00 0.00 175.35 175.29 1i02 n ASN 19 N 3.76 0.64 -4.50 2.83 4.13 -1.16 -4.56 115.26 116.40 1i02 n ASN 19 Ca -0.23 -1.50 -0.31 0.00 1.68 0.00 0.00 54.58 54.22 1i02 n ASN 19 Cb 0.52 -0.05 -0.07 0.00 -1.54 0.00 0.00 39.78 38.64 1i02 n ASN 19 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1i02 s LEU 20 N -0.42 2.11 0.31 3.41 1.02 -1.07 -1.76 118.68 122.27 1i02 s LEU 20 Ca 0.02 -1.72 0.10 0.00 0.02 0.00 0.00 54.13 52.55 1i02 s LEU 20 Cb 0.02 -0.46 -0.06 0.00 0.02 0.00 0.00 46.19 45.71 1i02 s LEU 20 CO 0.00 -0.96 -0.14 0.00 0.02 0.00 0.00 176.35 175.28 1i02 s TYR 22 N -2.61 0.27 -0.19 0.00 -0.85 -0.36 -2.69 117.35 110.92 1i02 s TYR 22 Ca 0.31 -0.13 0.00 0.00 -0.52 0.00 0.00 57.07 56.73 1i02 s TYR 22 Cb -0.00 -0.18 0.05 0.00 0.38 0.00 0.00 41.96 42.21 1i02 s TYR 22 CO 0.15 -0.03 -0.07 -1.59 -1.52 0.00 0.00 175.55 172.50 1i02 s LYS 23 N -0.33 1.66 -0.38 -3.49 0.00 0.02 -1.31 119.74 115.91 1i02 s LYS 23 Ca -0.02 -0.73 -0.08 0.00 0.00 0.00 0.00 55.97 55.14 1i02 s LYS 23 Cb -0.03 -2.28 0.06 0.00 0.00 0.00 0.00 37.83 35.58 1i02 s LYS 23 CO -0.00 -0.47 0.19 1.41 0.00 0.00 0.00 175.35 176.48 1i02 s MET 24 N 1.51 2.62 0.22 1.78 1.75 -0.93 -1.44 119.30 124.82 1i02 s MET 24 Ca -0.01 -1.31 0.00 0.00 -1.25 0.00 0.00 55.69 53.12 1i02 s MET 24 Cb -0.16 -3.65 0.00 0.00 2.84 0.00 0.00 34.83 33.86 1i02 s MET 24 CO -0.08 -0.81 0.02 1.97 -0.65 0.00 0.00 175.02 175.47 1i02 n PHE 25 N 4.88 0.34 -3.16 4.11 -1.74 -0.91 -1.86 117.46 119.12 1i02 n PHE 25 Ca -0.11 -1.09 -0.40 0.00 -0.56 0.00 0.00 57.45 55.29 1i02 n PHE 25 Cb 0.44 -0.15 -0.06 0.00 1.52 0.00 0.00 39.48 41.22 1i02 n PHE 25 CO 0.00 0.00 0.00 -1.64 -0.56 0.00 0.00 176.76 174.56 1i02 s MET 26 N -2.82 4.16 0.45 3.97 -1.94 -1.26 -2.21 119.30 119.64 1i02 s MET 26 Ca 0.01 0.50 0.23 0.00 -1.71 0.00 0.00 55.69 54.73 1i02 s MET 26 Cb -0.00 -3.61 0.78 0.00 2.01 0.00 0.00 34.83 34.01 1i02 s MET 26 CO 0.01 -0.28 1.01 0.28 -0.01 0.00 0.00 175.02 176.03 1i02 n VAL 27 N 4.87 0.00 -0.10 -6.03 0.31 -0.75 -0.87 118.33 115.76 1i02 n VAL 27 Ca -0.02 0.98 -0.11 0.00 -0.01 0.00 0.00 64.34 65.17 1i02 n VAL 27 Cb 0.50 -1.74 -0.06 0.00 -0.91 0.00 0.00 33.84 31.63 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 0.45 -0.55 -2.48 3.52 0.00 -1.90 -3.35 119.26 114.94 1i02 h ALA 28 Ca 0.42 0.03 -0.68 0.00 0.00 0.00 0.00 54.91 54.69 1i02 h ALA 28 Cb 2.33 0.93 -0.18 0.00 0.00 0.00 0.00 17.79 20.86 1i02 h ALA 28 CO -0.00 -0.93 -0.25 0.95 0.00 0.00 0.00 179.25 179.02 1i02 s THR 29 N -5.81 5.13 0.19 0.00 -4.23 -0.05 -4.95 115.64 105.92 1i02 s THR 29 Ca -0.15 -0.17 -0.06 0.00 -1.18 0.00 0.00 61.69 60.13 1i02 s THR 29 Cb 0.10 -3.93 -0.01 0.00 1.34 0.00 0.00 72.50 70.01 1i02 s THR 29 CO 0.64 -0.26 1.56 1.55 -0.54 0.00 0.00 174.62 177.57 1i02 h PRO 30 N 8.60 0.77 -0.24 3.99 0.14 -1.83 -3.28 132.00 140.15 1i02 h PRO 30 Ca -0.28 -0.37 -0.08 0.00 0.14 0.00 0.00 66.00 65.40 1i02 h PRO 30 Cb 1.13 -0.00 -0.05 0.00 0.14 0.00 0.00 31.00 32.21 1i02 h PRO 30 CO 0.74 1.00 -0.09 1.63 0.14 0.00 0.00 178.00 181.42 1i02 n LYS 31 N -4.06 2.02 -3.38 0.86 5.02 -1.26 -4.78 118.16 112.58 1i02 n LYS 31 Ca -0.01 -3.02 -0.26 0.00 -2.02 0.00 0.00 58.31 53.00 1i02 n LYS 31 Cb 0.50 -1.76 -0.08 0.00 -0.02 0.00 0.00 35.03 33.67 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 -1.00 0.86 -1.32 -0.18 0.31 -1.24 -5.10 118.33 110.67 1i02 n VAL 32 Ca 0.26 -4.59 -0.35 0.00 -0.01 0.00 0.00 64.34 59.64 1i02 n VAL 32 Cb 0.90 -2.02 0.09 0.00 -0.91 0.00 0.00 33.84 31.90 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 1.33 0.45 0.00 5.55 -0.01 -1.26 -4.79 135.00 136.26 1i02 n PRO 33 Ca 0.26 0.21 0.00 0.00 -0.01 0.00 0.00 63.50 63.95 1i02 n PRO 33 Cb 0.45 -2.19 0.00 0.00 -0.01 0.00 0.00 33.50 31.76 1i02 n PRO 33 CO 0.00 0.00 0.00 1.55 -0.01 0.00 0.00 175.50 177.04 1i02 n VAL 34 N -2.57 0.00 -3.48 -1.45 3.14 -1.26 -4.94 118.33 107.77 1i02 n VAL 34 Ca 0.13 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.13 1i02 n VAL 34 Cb 0.50 -0.51 -0.06 0.00 -1.06 0.00 0.00 33.84 32.71 1i02 n VAL 34 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1i02 s LYS 35 N -1.90 3.94 -0.21 1.45 -0.14 -0.78 -4.91 119.74 117.19 1i02 s LYS 35 Ca 0.00 0.44 -0.04 0.00 -1.36 0.00 0.00 55.97 55.01 1i02 s LYS 35 Cb 0.00 -3.22 0.08 0.00 -1.68 0.00 0.00 37.83 33.01 1i02 s LYS 35 CO 0.00 0.69 0.13 0.50 -0.76 0.00 0.00 175.35 175.91 1i02 s ARG 36 N -1.09 0.13 0.00 1.68 3.52 -1.26 -2.18 118.95 119.75 1i02 s ARG 36 Ca 0.24 -0.13 0.00 0.00 -0.13 0.00 0.00 55.73 55.71 1i02 s ARG 36 Cb -0.17 -1.51 0.00 0.00 -1.56 0.00 0.00 34.95 31.71 1i02 s ARG 36 CO 0.14 -0.76 0.00 0.41 -0.81 0.00 0.00 175.30 174.28 1i02 n GLY 37 N 5.28 4.43 3.45 8.12 0.00 -0.43 -3.33 105.19 122.72 1i02 n GLY 37 Ca -0.06 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.88 0.24 -0.14 0.00 1.01 -0.77 -4.70 121.20 115.95 1i02 s ILE 39 Ca 0.14 -1.99 -0.03 0.00 0.00 0.00 0.00 60.65 58.76 1i02 s ILE 39 Cb -0.10 -2.49 -0.08 0.00 0.01 0.00 0.00 42.46 39.80 1i02 s ILE 39 CO 0.04 -0.06 -0.16 -0.90 0.00 0.00 0.00 174.94 173.86 1i02 n ASP 40 N -0.32 1.97 -3.99 3.58 5.68 -1.26 -2.61 116.55 119.59 1i02 n ASP 40 Ca 0.00 0.05 -0.23 0.00 -0.50 0.00 0.00 54.79 54.11 1i02 n ASP 40 Cb 0.66 -0.33 -0.16 0.00 -1.14 0.00 0.00 41.12 40.15 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 -2.27 0.98 -0.23 2.12 1.01 -1.26 -4.67 120.40 116.07 1i02 s VAL 41 Ca -0.19 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.11 1i02 s VAL 41 Cb 0.06 -0.91 -0.01 0.00 0.00 0.00 0.00 36.38 35.52 1i02 s VAL 41 CO 0.29 0.32 1.39 0.00 0.00 0.00 0.00 175.10 177.09 1i02 n PRO 43 N 7.19 -1.87 0.00 0.00 -0.01 -1.26 -5.00 135.00 134.05 1i02 n PRO 43 Ca 0.16 -0.52 0.00 0.00 -0.01 0.00 0.00 63.50 63.12 1i02 n PRO 43 Cb 0.46 -1.86 0.00 0.00 -0.01 0.00 0.00 33.50 32.09 1i02 n PRO 43 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 175.50 175.85 1i02 n LYS 44 N -3.01 -0.38 -4.08 -0.52 2.85 -1.26 -4.80 118.16 106.97 1i02 n LYS 44 Ca 0.02 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.96 1i02 n LYS 44 Cb 0.59 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.91 1i02 n LYS 44 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1i02 s SER 45 N -1.51 5.53 0.26 -5.58 0.01 -1.26 -4.44 113.70 106.71 1i02 s SER 45 Ca 0.00 0.02 0.11 0.00 1.31 0.00 0.00 55.95 57.39 1i02 s SER 45 Cb 0.00 -1.51 -0.05 0.00 0.21 0.00 0.00 66.02 64.68 1i02 s SER 45 CO 0.00 0.20 -0.19 -0.55 0.41 0.00 0.00 173.24 173.11 1i02 s SER 46 N -2.19 3.33 0.00 2.44 0.15 -0.67 -5.00 113.70 111.76 1i02 s SER 46 Ca 0.27 -1.02 0.15 0.00 0.70 0.00 0.00 55.95 56.05 1i02 s SER 46 Cb -0.12 -0.26 0.89 0.00 -1.71 0.00 0.00 66.02 64.82 1i02 s SER 46 CO 0.20 -0.01 1.57 0.18 1.20 0.00 0.00 173.24 176.38 1i02 n LEU 47 N -0.52 0.01 0.00 3.45 7.99 -1.26 -3.77 117.00 122.90 1i02 n LEU 47 Ca -0.06 -0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.93 1i02 n LEU 47 Cb 0.60 -0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.91 1i02 n LEU 47 CO 0.37 0.00 -0.13 -0.11 -1.51 0.00 0.00 177.39 176.01 1i02 n LEU 48 N -0.73 0.06 -4.23 2.23 7.94 -1.26 -4.94 117.00 116.08 1i02 n LEU 48 Ca 0.11 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.88 1i02 n LEU 48 Cb 0.05 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 43.90 1i02 n LEU 48 CO 0.08 0.01 -0.39 0.54 -1.11 0.00 0.00 177.39 176.53 1i02 s VAL 49 N -1.27 0.94 -0.03 1.96 0.11 -1.25 -1.81 120.40 119.06 1i02 s VAL 49 Ca 0.00 -2.01 -0.07 0.00 -2.93 0.00 0.00 61.98 56.97 1i02 s VAL 49 Cb 0.00 -1.86 0.01 0.00 -1.53 0.00 0.00 36.38 33.00 1i02 s VAL 49 CO 0.00 -0.73 0.17 -0.75 -3.33 0.00 0.00 175.10 170.46 1i02 s LYS 50 N -3.80 0.38 -0.07 1.54 2.20 -0.94 -1.66 119.74 117.38 1i02 s LYS 50 Ca 0.17 -0.10 0.05 0.00 -0.36 0.00 0.00 55.97 55.73 1i02 s LYS 50 Cb 0.04 0.17 -0.01 0.00 -1.51 0.00 0.00 37.83 36.52 1i02 s LYS 50 CO -0.00 -0.08 -0.24 0.71 -0.36 0.00 0.00 175.35 175.37 1i02 s TYR 51 N -0.73 2.50 -0.12 4.03 1.51 -1.26 -2.14 117.35 121.14 1i02 s TYR 51 Ca -0.08 -0.84 0.02 0.00 -1.01 0.00 0.00 57.07 55.17 1i02 s TYR 51 Cb -0.05 -1.65 -0.00 0.00 -0.11 0.00 0.00 41.96 40.16 1i02 s TYR 51 CO 0.01 -0.29 -0.20 0.08 -1.11 0.00 0.00 175.55 174.04 1i02 s VAL 52 N 0.03 2.32 0.13 0.71 1.01 -0.52 -4.85 120.40 119.22 1i02 s VAL 52 Ca -0.09 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.02 1i02 s VAL 52 Cb -0.15 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1i02 s VAL 52 CO 0.06 0.54 -0.10 0.00 0.00 0.00 0.00 175.10 175.60 1i02 n ASN 55 N 3.47 5.20 -1.64 0.00 2.85 -1.26 -1.85 115.26 122.03 1i02 n ASN 55 Ca -0.18 -3.08 -0.05 0.00 -0.11 0.00 0.00 54.58 51.17 1i02 n ASN 55 Cb 0.56 -1.50 -0.01 0.00 1.24 0.00 0.00 39.78 40.07 1i02 n ASN 55 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 1i02 n THR 56 N 3.68 0.00 -3.56 -0.44 5.66 -0.72 -4.88 114.28 114.02 1i02 n THR 56 Ca 0.38 -0.55 -0.39 0.00 -3.05 0.00 0.00 64.05 60.44 1i02 n THR 56 Cb 0.38 0.35 -0.11 0.00 -1.55 0.00 0.00 70.33 69.41 1i02 n THR 56 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1i02 s ASP 57 N -1.70 6.01 -1.10 1.09 1.11 -1.26 -4.46 116.67 116.35 1i02 s ASP 57 Ca 0.09 -0.28 -0.03 0.00 0.18 0.00 0.00 52.55 52.51 1i02 s ASP 57 Cb -0.00 -2.12 -0.03 0.00 1.07 0.00 0.00 42.92 41.83 1i02 s ASP 57 CO 0.06 -0.17 0.94 -1.14 1.18 0.00 0.00 175.17 176.05 1i02 n ARG 58 N 5.08 -4.61 -1.19 8.23 3.00 -0.49 -4.92 116.66 121.77 1i02 n ARG 58 Ca -0.13 0.83 -0.16 0.00 -0.00 0.00 0.00 57.85 58.39 1i02 n ARG 58 Cb 0.50 -5.75 0.14 0.00 0.00 0.00 0.00 32.46 27.36 1i02 n ARG 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63