#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i91 s VAL 10 N 0.00 5.00 0.07 1.55 1.01 -1.26 -5.09 120.40 121.69 3i91 s VAL 10 Ca 0.00 0.05 0.02 0.00 0.00 0.00 0.00 61.98 62.05 3i91 s VAL 10 Cb 0.00 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 3i91 s VAL 10 CO 0.00 0.43 -0.07 -0.36 0.00 0.00 0.00 175.10 175.09 3i91 s PHE 11 N 0.58 0.80 0.12 5.22 0.08 -1.26 -5.13 117.98 118.38 3i91 s PHE 11 Ca 0.05 -0.71 -0.31 0.00 0.12 0.00 0.00 56.93 56.08 3i91 s PHE 11 Cb -0.12 -0.47 -0.09 0.00 -0.57 0.00 0.00 43.02 41.77 3i91 s PHE 11 CO 0.01 -0.11 1.65 0.00 -0.10 0.00 0.00 175.22 176.66 3i91 s ALA 12 N -2.50 3.74 -0.09 5.36 0.00 -1.26 -5.00 121.76 122.01 3i91 s ALA 12 Ca 0.01 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.28 3i91 s ALA 12 Cb -0.02 -3.68 -0.03 0.00 0.00 0.00 0.00 23.12 19.39 3i91 s ALA 12 CO -0.02 -1.00 -0.07 0.00 0.00 0.00 0.00 175.76 174.67 3i91 s ALA 13 N 2.06 2.93 -0.09 0.00 0.00 -1.26 -1.39 121.76 124.01 3i91 s ALA 13 Ca 0.73 -0.88 -0.18 0.00 0.00 0.00 0.00 51.96 51.63 3i91 s ALA 13 Cb -0.42 -1.28 -0.28 0.00 0.00 0.00 0.00 23.12 21.14 3i91 s ALA 13 CO 0.32 0.47 0.64 1.49 0.00 0.00 0.00 175.76 178.69 3i91 h GLU 14 N 5.66 0.25 -1.95 0.00 4.57 -0.76 -3.44 114.58 118.92 3i91 h GLU 14 Ca -0.43 -0.42 0.10 0.00 -1.18 0.00 0.00 59.36 57.43 3i91 h GLU 14 Cb 1.18 0.16 -0.18 0.00 -0.16 0.00 0.00 28.75 29.74 3i91 h GLU 14 CO 0.54 1.20 0.53 0.00 -1.18 0.00 0.00 179.01 180.10 3i91 s ALA 15 N -2.46 -1.88 -0.19 2.92 0.00 -1.13 -5.02 121.76 114.01 3i91 s ALA 15 Ca -0.18 1.28 -0.16 0.00 0.00 0.00 0.00 51.96 52.89 3i91 s ALA 15 Cb 0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 3i91 s ALA 15 CO 0.78 -0.53 0.40 -0.51 0.00 0.00 0.00 175.76 175.90 3i91 s LEU 16 N -1.91 4.18 -0.16 0.00 1.43 -1.26 -0.49 118.68 120.47 3i91 s LEU 16 Ca 0.02 0.56 0.03 0.00 -1.03 0.00 0.00 54.13 53.71 3i91 s LEU 16 Cb -0.01 -2.53 -0.23 0.00 0.03 0.00 0.00 46.19 43.45 3i91 s LEU 16 CO -0.04 -0.05 0.21 0.18 0.23 0.00 0.00 176.35 176.88 3i91 n LEU 17 N 4.28 2.02 -3.88 1.79 4.77 0.60 -4.81 117.00 121.76 3i91 n LEU 17 Ca -0.08 0.12 -0.09 0.00 -0.03 0.00 0.00 56.01 55.92 3i91 n LEU 17 Cb 0.51 -0.58 -0.05 0.00 -2.33 0.00 0.00 43.42 40.96 3i91 n LEU 17 CO 0.40 0.74 0.13 -0.54 -1.33 0.00 0.00 177.39 176.79 3i91 s LYS 18 N -2.55 1.31 0.05 3.23 1.02 -1.25 -4.98 119.74 116.58 3i91 s LYS 18 Ca -0.21 -1.07 0.07 0.00 0.02 0.00 0.00 55.97 54.78 3i91 s LYS 18 Cb 0.07 0.45 -0.03 0.00 -0.52 0.00 0.00 37.83 37.81 3i91 s LYS 18 CO 0.74 -0.52 -0.19 0.50 -0.92 0.00 0.00 175.35 174.96 3i91 s ARG 19 N -3.94 1.20 0.21 1.68 3.52 -1.26 -1.00 118.95 119.36 3i91 s ARG 19 Ca 0.15 -0.93 -0.07 0.00 -0.13 0.00 0.00 55.73 54.75 3i91 s ARG 19 Cb 0.01 -1.31 -0.02 0.00 -1.56 0.00 0.00 34.95 32.07 3i91 s ARG 19 CO 0.00 0.32 0.30 -0.98 -0.81 0.00 0.00 175.30 174.14 3i91 s ARG 20 N -1.31 1.34 -0.14 5.12 1.70 0.20 -5.00 118.95 120.85 3i91 s ARG 20 Ca 0.05 -1.39 0.00 0.00 -0.47 0.00 0.00 55.73 53.93 3i91 s ARG 20 Cb -0.09 0.37 -0.01 0.00 -0.57 0.00 0.00 34.95 34.66 3i91 s ARG 20 CO 0.02 -0.50 -0.15 0.42 -1.08 0.00 0.00 175.30 174.01 3i91 s ILE 21 N -4.07 2.77 -0.05 4.99 -1.09 -1.26 -1.06 121.20 121.43 3i91 s ILE 21 Ca 0.28 -0.75 -0.00 0.00 -2.23 0.00 0.00 60.65 57.95 3i91 s ILE 21 Cb 0.03 -2.16 0.03 0.00 -1.58 0.00 0.00 42.46 38.78 3i91 s ILE 21 CO 0.09 0.52 -0.01 -0.13 -1.23 0.00 0.00 174.94 174.17 3i91 s ARG 22 N 0.59 0.62 -1.55 2.79 1.81 -0.18 -4.83 118.95 118.20 3i91 s ARG 22 Ca -0.09 0.03 -0.12 0.00 -1.72 0.00 0.00 55.73 53.83 3i91 s ARG 22 Cb -0.16 -0.83 0.09 0.00 -0.45 0.00 0.00 34.95 33.61 3i91 s ARG 22 CO 0.03 -0.20 0.82 0.36 -0.68 0.00 0.00 175.30 175.64 3i91 n LYS 23 N 4.58 -4.46 -1.22 3.54 0.00 -1.26 -1.87 118.16 117.48 3i91 n LYS 23 Ca -0.17 0.51 -0.07 0.00 -0.00 0.00 0.00 58.31 58.57 3i91 n LYS 23 Cb 0.50 -5.21 -0.03 0.00 -0.00 0.00 0.00 35.03 30.29 3i91 n LYS 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3i91 n GLY 24 N -1.63 0.95 3.07 2.58 0.00 -1.26 -5.01 105.19 103.89 3i91 n GLY 24 Ca -0.03 -0.66 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 3i91 n GLY 24 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3i91 s ARG 25 N -2.57 0.61 0.01 1.61 1.70 -0.78 -5.14 118.95 114.39 3i91 s ARG 25 Ca 0.00 -0.68 -0.23 0.00 -0.47 0.00 0.00 55.73 54.35 3i91 s ARG 25 Cb 0.00 -0.48 -0.05 0.00 -0.57 0.00 0.00 34.95 33.85 3i91 s ARG 25 CO 0.00 0.11 0.69 1.41 -1.08 0.00 0.00 175.30 176.43 3i91 s MET 26 N -1.27 4.42 0.08 3.89 -2.45 -1.26 -1.01 119.30 121.71 3i91 s MET 26 Ca -0.05 0.91 0.04 0.00 -1.25 0.00 0.00 55.69 55.34 3i91 s MET 26 Cb -0.08 -3.37 -0.03 0.00 1.25 0.00 0.00 34.83 32.60 3i91 s MET 26 CO 0.01 0.28 -0.11 -1.21 1.05 0.00 0.00 175.02 175.04 3i91 s GLU 27 N 0.02 0.81 0.02 4.11 2.02 -0.23 -1.49 118.70 123.96 3i91 s GLU 27 Ca 0.36 -1.06 0.06 0.00 0.02 0.00 0.00 54.97 54.34 3i91 s GLU 27 Cb -0.19 -0.59 -0.02 0.00 0.10 0.00 0.00 34.13 33.43 3i91 s GLU 27 CO 0.20 0.11 -0.18 0.71 0.02 0.00 0.00 175.26 176.12 3i91 s TYR 28 N -2.00 1.56 -0.45 1.61 2.02 0.61 -0.63 117.35 120.07 3i91 s TYR 28 Ca 0.02 -0.34 -0.24 0.00 -0.37 0.00 0.00 57.07 56.14 3i91 s TYR 28 Cb -0.06 -0.95 0.02 0.00 -0.40 0.00 0.00 41.96 40.57 3i91 s TYR 28 CO 0.01 0.04 0.85 -1.17 -1.57 0.00 0.00 175.55 173.71 3i91 s LEU 29 N -0.89 4.12 -0.20 -1.29 2.96 -0.17 -0.56 118.68 122.65 3i91 s LEU 29 Ca 0.06 0.05 -0.18 0.00 -0.22 0.00 0.00 54.13 53.84 3i91 s LEU 29 Cb -0.08 -3.09 -0.03 0.00 0.50 0.00 0.00 46.19 43.49 3i91 s LEU 29 CO 0.01 -0.96 0.49 -0.69 -1.32 0.00 0.00 176.35 173.87 3i91 s VAL 30 N 3.50 5.13 -0.23 1.68 1.01 0.28 -0.30 120.40 131.47 3i91 s VAL 30 Ca 0.34 0.89 -0.20 0.00 0.00 0.00 0.00 61.98 63.00 3i91 s VAL 30 Cb -0.11 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 3i91 s VAL 30 CO 0.24 0.20 0.61 -0.75 0.00 0.00 0.00 175.10 175.40 3i91 s LYS 31 N 1.52 4.14 0.03 2.72 2.36 0.36 -2.56 119.74 128.31 3i91 s LYS 31 Ca 0.23 0.53 -0.16 0.00 -2.55 0.00 0.00 55.97 54.02 3i91 s LYS 31 Cb -0.15 -3.62 -0.06 0.00 -1.05 0.00 0.00 37.83 32.95 3i91 s LYS 31 CO 0.09 -0.33 0.45 -1.58 1.55 0.00 0.00 175.35 175.54 3i91 s TRP 32 N 2.22 3.74 0.20 4.03 0.52 -1.26 -0.07 118.94 128.32 3i91 s TRP 32 Ca 0.26 1.06 -0.32 0.00 0.02 0.00 0.00 56.10 57.12 3i91 s TRP 32 Cb -0.16 -2.34 -0.12 0.00 -1.15 0.00 0.00 33.47 29.70 3i91 s TRP 32 CO 0.09 0.62 1.73 1.17 0.02 0.00 0.00 176.95 180.58 3i91 n LYS 33 N 1.72 2.79 -0.71 4.98 4.81 -0.48 -2.37 118.16 128.89 3i91 n LYS 33 Ca -0.13 1.01 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 3i91 n LYS 33 Cb 0.52 -2.86 0.00 0.00 0.02 0.00 0.00 35.03 32.71 3i91 n LYS 33 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i91 n GLY 34 N 3.99 0.84 3.39 3.14 0.00 -1.26 -4.91 105.19 110.38 3i91 n GLY 34 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3i91 n GLY 34 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3i91 s TRP 35 N -3.30 2.31 0.93 1.61 0.52 -1.00 -5.13 118.94 114.89 3i91 s TRP 35 Ca 0.00 -0.38 -0.12 0.00 0.02 0.00 0.00 56.10 55.62 3i91 s TRP 35 Cb 0.00 -1.25 0.15 0.00 -1.15 0.00 0.00 33.47 31.21 3i91 s TRP 35 CO 0.00 0.33 1.10 -1.54 0.02 0.00 0.00 176.95 176.87 3i91 s SER 36 N -2.04 3.28 0.57 2.95 1.04 -1.26 -4.59 113.70 113.65 3i91 s SER 36 Ca 0.14 1.23 0.28 0.00 0.48 0.00 0.00 55.95 58.08 3i91 s SER 36 Cb -0.10 -1.90 1.50 0.00 0.10 0.00 0.00 66.02 65.62 3i91 s SER 36 CO 0.06 -2.73 1.98 -0.61 0.98 0.00 0.00 173.24 172.93 3i91 h GLN 37 N -1.61 0.00 -0.59 4.02 5.75 -1.98 -2.24 115.11 118.45 3i91 h GLN 37 Ca -0.51 0.00 0.13 0.00 -0.15 0.00 0.00 58.65 58.11 3i91 h GLN 37 Cb 1.31 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.83 3i91 h GLN 37 CO 0.58 0.00 0.41 -0.22 -2.65 0.00 0.00 178.83 176.95 3i91 h LYS 38 N 0.00 0.25 -0.19 1.69 3.64 -2.02 -1.90 116.57 118.05 3i91 h LYS 38 Ca 0.20 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 3i91 h LYS 38 Cb 0.96 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 3i91 h LYS 38 CO -0.00 0.17 0.00 0.66 -2.27 0.00 0.00 179.45 178.00 3i91 n TYR 39 N -4.44 0.23 -1.73 1.91 4.02 -0.85 -4.96 117.16 111.34 3i91 n TYR 39 Ca 0.10 -0.16 -0.39 0.00 -0.01 0.00 0.00 57.90 57.44 3i91 n TYR 39 Cb 0.48 -0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.83 3i91 n TYR 39 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3i91 n SER 40 N 1.01 2.61 -4.28 7.72 7.64 -0.72 -4.89 113.62 122.71 3i91 n SER 40 Ca 0.13 1.01 -0.24 0.00 1.01 0.00 0.00 58.87 60.78 3i91 n SER 40 Cb 0.46 -1.55 -0.12 0.00 -1.01 0.00 0.00 64.21 61.98 3i91 n SER 40 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3i91 s THR 41 N -1.28 1.69 -0.10 0.44 -4.23 -1.06 -4.92 115.64 106.19 3i91 s THR 41 Ca 0.69 -1.54 -0.26 0.00 -1.18 0.00 0.00 61.69 59.40 3i91 s THR 41 Cb -0.44 -1.54 -0.02 0.00 1.34 0.00 0.00 72.50 71.84 3i91 s THR 41 CO 0.52 -0.08 0.83 0.26 -0.54 0.00 0.00 174.62 175.61 3i91 s TRP 42 N -1.19 3.52 -0.03 3.99 0.52 -1.26 -0.56 118.94 123.93 3i91 s TRP 42 Ca 0.06 1.36 0.05 0.00 0.02 0.00 0.00 56.10 57.59 3i91 s TRP 42 Cb -0.10 -2.98 -0.01 0.00 -1.15 0.00 0.00 33.47 29.24 3i91 s TRP 42 CO 0.04 -0.09 -0.19 -1.21 0.02 0.00 0.00 176.95 175.52 3i91 s GLU 43 N 1.48 1.75 0.68 4.98 0.41 0.28 -4.93 118.70 123.35 3i91 s GLU 43 Ca 0.41 -0.68 -0.17 0.00 -0.41 0.00 0.00 54.97 54.13 3i91 s GLU 43 Cb -0.18 -1.59 -0.00 0.00 -1.78 0.00 0.00 34.13 30.58 3i91 s GLU 43 CO 0.18 0.34 1.10 -0.35 -0.49 0.00 0.00 175.26 176.04 3i91 n PRO 44 N 2.85 0.75 0.03 0.39 -0.04 -1.26 -0.29 135.00 137.44 3i91 n PRO 44 Ca -0.16 0.31 0.09 0.00 -0.04 0.00 0.00 63.50 63.70 3i91 n PRO 44 Cb 0.53 -2.34 0.52 0.00 -0.04 0.00 0.00 33.50 32.18 3i91 n PRO 44 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3i91 h GLU 45 N 0.08 0.32 0.00 0.54 4.22 -1.62 -0.47 114.58 117.65 3i91 h GLU 45 Ca -0.49 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 58.93 3i91 h GLU 45 Cb 1.34 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3i91 h GLU 45 CO 0.50 0.21 0.00 -0.85 -2.18 0.00 0.00 179.01 176.68 3i91 n GLU 46 N -4.48 0.16 0.06 1.92 0.00 -1.26 -1.06 120.64 115.98 3i91 n GLU 46 Ca 0.04 0.37 0.13 0.00 0.00 0.00 0.00 57.16 57.70 3i91 n GLU 46 Cb 0.22 -1.80 0.48 0.00 0.00 0.00 0.00 31.44 30.34 3i91 n GLU 46 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3i91 n ASN 47 N -2.11 0.42 -4.51 -1.84 4.13 -0.19 -4.64 115.26 106.53 3i91 n ASN 47 Ca 0.03 0.55 -0.42 0.00 1.68 0.00 0.00 54.58 56.42 3i91 n ASN 47 Cb 0.23 -0.66 -0.03 0.00 -1.54 0.00 0.00 39.78 37.78 3i91 n ASN 47 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3i91 s ILE 48 N -3.08 4.00 0.05 2.41 -1.09 -0.23 -4.86 121.20 118.39 3i91 s ILE 48 Ca 0.10 0.05 -0.14 0.00 -2.23 0.00 0.00 60.65 58.44 3i91 s ILE 48 Cb 0.14 -4.81 -0.31 0.00 -1.58 0.00 0.00 42.46 35.90 3i91 s ILE 48 CO 0.51 -1.68 1.09 -0.07 -1.23 0.00 0.00 174.94 173.55 3i91 h LEU 49 N 12.27 0.81 -8.61 2.97 3.38 -1.85 -3.42 115.31 120.85 3i91 h LEU 49 Ca -0.28 -0.79 -0.66 0.00 0.09 0.00 0.00 57.88 56.24 3i91 h LEU 49 Cb 1.06 -0.26 -0.16 0.00 0.09 0.00 0.00 40.66 41.39 3i91 h LEU 49 CO 1.24 1.60 0.04 -0.62 0.09 0.00 0.00 178.44 180.79 3i91 s ASP 50 N -7.44 6.30 0.40 -0.43 -1.08 -1.26 -4.93 116.67 108.23 3i91 s ASP 50 Ca -0.09 -0.34 0.27 0.00 -0.52 0.00 0.00 52.55 51.87 3i91 s ASP 50 Cb 0.05 -2.30 1.43 0.00 -1.46 0.00 0.00 42.92 40.65 3i91 s ASP 50 CO 0.93 -0.70 1.83 0.00 0.52 0.00 0.00 175.17 177.75 3i91 h ALA 51 N 8.78 1.00 -0.48 3.66 0.00 -2.02 -1.45 119.26 128.76 3i91 h ALA 51 Ca -0.26 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.72 3i91 h ALA 51 Cb 1.10 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 3i91 h ALA 51 CO 0.86 0.00 0.32 0.00 0.00 0.00 0.00 179.25 180.43 3i91 h ARG 52 N 0.00 0.35 -0.63 0.00 3.08 -1.98 -0.66 114.38 114.55 3i91 h ARG 52 Ca 0.00 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 3i91 h ARG 52 Cb 0.06 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 3i91 h ARG 52 CO 0.00 0.23 0.09 -0.07 -1.07 0.00 0.00 179.97 179.15 3i91 h LEU 53 N 0.36 0.99 -0.42 3.04 3.38 -1.67 -0.56 115.31 120.43 3i91 h LEU 53 Ca 0.21 -0.23 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 3i91 h LEU 53 Cb 0.39 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3i91 h LEU 53 CO -0.05 0.99 -0.28 -0.07 0.09 0.00 0.00 178.44 179.12 3i91 h LEU 54 N 0.97 0.98 -0.61 1.67 3.38 -1.34 -2.62 115.31 117.74 3i91 h LEU 54 Ca 0.19 -0.43 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 3i91 h LEU 54 Cb 0.43 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3i91 h LEU 54 CO 0.01 1.20 0.30 0.00 0.09 0.00 0.00 178.44 180.04 3i91 h ALA 55 N 0.81 0.79 -0.51 1.53 0.00 -1.00 -1.61 119.26 119.28 3i91 h ALA 55 Ca 0.09 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3i91 h ALA 55 Cb 0.86 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3i91 h ALA 55 CO 0.08 0.34 -0.07 0.00 0.00 0.00 0.00 179.25 179.59 3i91 h ALA 56 N 1.13 0.91 -0.52 0.00 0.00 -1.08 -0.32 119.26 119.39 3i91 h ALA 56 Ca 0.21 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3i91 h ALA 56 Cb 0.11 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3i91 h ALA 56 CO -0.03 0.63 0.27 0.35 0.00 0.00 0.00 179.25 180.48 3i91 h PHE 57 N 0.82 0.73 -0.64 0.00 3.57 -1.06 -2.68 116.94 117.68 3i91 h PHE 57 Ca 0.14 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 3i91 h PHE 57 Cb 0.59 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 3i91 h PHE 57 CO 0.04 0.55 0.18 0.93 -2.23 0.00 0.00 178.31 177.77 3i91 h GLU 58 N 0.69 0.98 -0.20 1.11 4.39 -0.82 -2.39 114.58 118.34 3i91 h GLU 58 Ca 0.18 -0.20 0.06 0.00 0.34 0.00 0.00 59.36 59.74 3i91 h GLU 58 Cb 0.07 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 3i91 h GLU 58 CO -0.03 0.85 0.16 1.49 -1.16 0.00 0.00 179.01 180.33 3i91 h GLU 59 N 0.94 0.00 -0.02 2.33 4.57 -0.74 -3.51 114.58 118.15 3i91 h GLU 59 Ca 0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 3i91 h GLU 59 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 3i91 h GLU 59 CO -0.01 0.00 0.00 2.89 -1.18 0.00 0.00 179.01 180.71