#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k20 n THR 8 N 0.00 3.25 -3.74 2.61 -2.24 -1.26 -4.94 114.28 107.96 2k20 n THR 8 Ca 0.00 -2.54 -0.37 0.00 -2.27 0.00 0.00 64.05 58.88 2k20 n THR 8 Cb 0.00 -1.29 -0.07 0.00 -2.10 0.00 0.00 70.33 66.87 2k20 n THR 8 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2k20 s ARG 9 N -2.78 3.81 0.01 -0.78 0.52 -1.26 -0.99 118.95 117.48 2k20 s ARG 9 Ca 0.49 -0.04 -0.05 0.00 -0.52 0.00 0.00 55.73 55.62 2k20 s ARG 9 Cb 0.38 -3.29 -0.01 0.00 0.52 0.00 0.00 34.95 32.56 2k20 s ARG 9 CO -0.07 0.57 0.08 -1.83 0.02 0.00 0.00 175.30 174.07 2k20 s GLU 10 N -0.48 0.45 0.09 3.54 -1.05 -0.82 -5.00 118.70 115.44 2k20 s GLU 10 Ca 0.15 -0.52 -0.04 0.00 -0.15 0.00 0.00 54.97 54.41 2k20 s GLU 10 Cb -0.13 0.18 -0.05 0.00 -0.44 0.00 0.00 34.13 33.69 2k20 s GLU 10 CO 0.04 -0.10 0.31 -0.06 0.95 0.00 0.00 175.26 176.40 2k20 s PHE 11 N -1.58 3.52 -0.21 4.83 0.40 -1.26 -2.03 117.98 121.65 2k20 s PHE 11 Ca -0.14 0.51 -0.02 0.00 -0.60 0.00 0.00 56.93 56.68 2k20 s PHE 11 Cb -0.07 -1.96 0.06 0.00 0.51 0.00 0.00 43.02 41.56 2k20 s PHE 11 CO -0.00 0.52 0.01 -0.51 0.70 0.00 0.00 175.22 175.94 2k20 s LEU 12 N -2.36 1.55 -0.14 -0.37 1.43 0.13 -4.96 118.68 113.97 2k20 s LEU 12 Ca 0.36 -0.92 -0.13 0.00 -1.03 0.00 0.00 54.13 52.41 2k20 s LEU 12 Cb -0.13 -0.75 -0.05 0.00 0.03 0.00 0.00 46.19 45.30 2k20 s LEU 12 CO 0.23 -0.29 0.27 -0.89 0.23 0.00 0.00 176.35 175.90 2k20 s THR 13 N 1.74 5.31 0.24 5.49 2.01 -1.26 -1.45 115.64 127.72 2k20 s THR 13 Ca -0.02 0.50 0.01 0.00 0.31 0.00 0.00 61.69 62.49 2k20 s THR 13 Cb -0.18 -3.59 -0.04 0.00 0.01 0.00 0.00 72.50 68.71 2k20 s THR 13 CO -0.08 0.46 0.19 -0.36 -0.69 0.00 0.00 174.62 174.14 2k20 s PHE 14 N 0.01 1.29 -0.19 4.92 0.08 0.12 -4.96 117.98 119.24 2k20 s PHE 14 Ca 0.16 -1.43 -0.01 0.00 0.12 0.00 0.00 56.93 55.77 2k20 s PHE 14 Cb -0.13 -0.57 0.05 0.00 -0.57 0.00 0.00 43.02 41.81 2k20 s PHE 14 CO 0.05 -0.73 -0.03 -1.21 -0.10 0.00 0.00 175.22 173.20 2k20 s GLU 15 N -3.94 1.26 -0.35 0.44 8.01 -1.26 0.03 118.70 122.89 2k20 s GLU 15 Ca 0.39 -0.63 -0.10 0.00 0.01 0.00 0.00 54.97 54.64 2k20 s GLU 15 Cb 0.05 -2.20 0.02 0.00 -4.31 0.00 0.00 34.13 27.70 2k20 s GLU 15 CO 0.16 -0.54 0.18 0.08 0.01 0.00 0.00 175.26 175.15 2k20 s VAL 16 N 1.63 4.44 -0.07 2.63 1.01 0.83 -4.89 120.40 125.97 2k20 s VAL 16 Ca -0.02 -0.80 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 2k20 s VAL 16 Cb -0.17 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 2k20 s VAL 16 CO -0.07 -0.15 0.92 -2.16 0.00 0.00 0.00 175.10 173.64 2k20 s PRO 17 N 1.54 4.46 -0.18 2.72 0.05 -1.26 -0.46 135.00 141.88 2k20 s PRO 17 Ca 0.02 1.27 0.13 0.00 0.05 0.00 0.00 61.00 62.47 2k20 s PRO 17 Cb -0.19 -3.50 0.40 0.00 0.05 0.00 0.00 34.50 31.26 2k20 s PRO 17 CO 0.06 -0.16 1.20 1.47 0.05 0.00 0.00 177.00 179.63 2k20 n LEU 18 N 4.43 2.47 -0.61 -3.56 -0.00 0.62 -4.45 117.00 115.90 2k20 n LEU 18 Ca 0.05 -3.60 0.47 0.00 -0.00 0.00 0.00 56.01 52.94 2k20 n LEU 18 Cb 0.50 -0.46 0.74 0.00 -0.00 0.00 0.00 43.42 44.20 2k20 n LEU 18 CO 0.51 1.23 1.33 -0.46 -0.00 0.00 0.00 177.39 180.00 2k20 n ASN 19 N -1.00 0.06 -0.04 1.45 6.94 -1.19 0.12 115.26 121.60 2k20 n ASN 19 Ca 0.17 1.04 -0.05 0.00 -0.02 0.00 0.00 54.58 55.72 2k20 n ASN 19 Cb 0.73 -0.52 -0.06 0.00 -2.36 0.00 0.00 39.78 37.57 2k20 n ASN 19 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2k20 n ASP 20 N -4.03 3.12 0.00 0.53 8.00 -1.26 -4.50 116.55 118.41 2k20 n ASP 20 Ca 0.41 -0.02 0.07 0.00 0.71 0.00 0.00 54.79 55.96 2k20 n ASP 20 Cb 1.79 0.39 0.35 0.00 -0.02 0.00 0.00 41.12 43.63 2k20 n ASP 20 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2k20 n SER 21 N -2.47 0.00 -0.35 -2.24 2.88 0.66 -3.52 113.62 108.58 2k20 n SER 21 Ca -0.15 0.26 0.37 0.00 -1.33 0.00 0.00 58.87 58.02 2k20 n SER 21 Cb 0.73 -0.38 0.72 0.00 -0.75 0.00 0.00 64.21 64.53 2k20 n SER 21 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2k20 h GLY 22 N 2.50 0.00 1.28 0.46 0.00 0.72 0.97 103.07 109.01 2k20 h GLY 22 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 2k20 h GLY 22 CO 0.00 0.00 -1.50 0.23 0.00 0.00 0.00 176.54 175.27 2k20 h SER 23 N 0.00 0.28 -0.30 0.19 0.87 -1.84 -3.29 113.55 109.46 2k20 h SER 23 Ca 0.60 -0.40 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 2k20 h SER 23 Cb 2.63 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 64.50 2k20 h SER 23 CO -0.01 1.33 0.00 0.00 -0.53 0.00 0.00 176.83 177.63 2k20 n ALA 24 N -2.62 2.46 0.00 6.23 0.00 0.30 -4.93 120.51 121.96 2k20 n ALA 24 Ca -0.15 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.72 2k20 n ALA 24 Cb 1.03 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.48 2k20 n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k20 n GLY 25 N 1.05 1.66 0.00 0.00 0.00 0.70 -3.36 105.19 105.24 2k20 n GLY 25 Ca 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2k20 n GLY 25 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2k20 n LEU 26 N 0.00 0.00 0.00 0.99 7.94 -1.23 -4.69 117.00 120.01 2k20 n LEU 26 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2k20 n LEU 26 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2k20 n LEU 26 CO 0.00 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 176.89 2k20 n GLY 27 N -0.35 0.91 3.70 -3.96 0.00 -1.21 0.20 105.19 104.48 2k20 n GLY 27 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 2k20 n GLY 27 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k20 s VAL 28 N -1.32 0.00 -0.17 1.61 -7.23 -1.26 0.12 120.40 112.16 2k20 s VAL 28 Ca 0.00 -0.86 0.00 0.00 -1.81 0.00 0.00 61.98 59.31 2k20 s VAL 28 Cb 0.00 -1.80 0.04 0.00 0.56 0.00 0.00 36.38 35.18 2k20 s VAL 28 CO 0.00 -0.02 -0.09 -0.94 -0.31 0.00 0.00 175.10 173.74 2k20 s SER 29 N -2.90 2.89 0.01 4.85 1.04 0.28 -4.85 113.70 115.02 2k20 s SER 29 Ca 0.11 -0.65 0.04 0.00 0.48 0.00 0.00 55.95 55.92 2k20 s SER 29 Cb -0.04 -1.06 -0.03 0.00 0.10 0.00 0.00 66.02 64.99 2k20 s SER 29 CO 0.02 -0.14 -0.07 0.68 0.98 0.00 0.00 173.24 174.72 2k20 s VAL 30 N 1.54 3.60 -0.02 5.02 -7.23 -1.26 0.15 120.40 122.20 2k20 s VAL 30 Ca 0.02 -0.81 0.01 0.00 -1.81 0.00 0.00 61.98 59.38 2k20 s VAL 30 Cb -0.15 -2.57 0.02 0.00 0.56 0.00 0.00 36.38 34.24 2k20 s VAL 30 CO -0.09 0.38 -0.01 -1.59 -0.31 0.00 0.00 175.10 173.49 2k20 s LYS 31 N -1.45 0.24 0.02 4.82 -2.85 -0.93 -4.87 119.74 114.71 2k20 s LYS 31 Ca 0.17 0.01 -0.02 0.00 -1.00 0.00 0.00 55.97 55.14 2k20 s LYS 31 Cb -0.11 -0.35 -0.04 0.00 -2.06 0.00 0.00 37.83 35.27 2k20 s LYS 31 CO 0.08 -0.06 0.19 0.20 0.10 0.00 0.00 175.35 175.86 2k20 s GLY 32 N 0.57 2.18 -0.07 0.59 0.00 -1.26 -1.08 107.32 108.26 2k20 s GLY 32 Ca -0.06 -0.79 0.03 0.00 0.00 0.00 0.00 44.72 43.90 2k20 s GLY 32 CO -0.01 -0.72 -0.15 -1.31 0.00 0.00 0.00 173.10 170.92 2k20 s ASN 33 N -2.15 2.01 -0.00 1.64 0.01 -0.83 -4.96 114.94 110.66 2k20 s ASN 33 Ca 0.30 -0.34 -0.04 0.00 -0.71 0.00 0.00 52.86 52.07 2k20 s ASN 33 Cb -0.13 -0.90 -0.04 0.00 0.41 0.00 0.00 41.25 40.59 2k20 s ASN 33 CO 0.22 0.06 0.21 0.00 -1.51 0.00 0.00 177.10 176.09 2k20 s ARG 34 N 0.55 3.48 0.05 -0.60 1.70 -1.26 0.13 118.95 123.01 2k20 s ARG 34 Ca -0.14 -0.24 -0.38 0.00 -0.47 0.00 0.00 55.73 54.50 2k20 s ARG 34 Cb -0.16 -3.08 -0.18 0.00 -0.57 0.00 0.00 34.95 30.96 2k20 s ARG 34 CO 0.04 0.66 1.18 0.43 -1.08 0.00 0.00 175.30 176.53 2k20 n SER 35 N 0.98 0.76 0.29 -2.89 7.64 0.30 -4.69 113.62 116.01 2k20 n SER 35 Ca -0.11 1.14 0.19 0.00 1.01 0.00 0.00 58.87 61.10 2k20 n SER 35 Cb 0.53 -1.06 0.84 0.00 -1.01 0.00 0.00 64.21 63.51 2k20 n SER 35 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 2k20 h LYS 36 N 3.63 0.00 0.00 1.43 -0.00 -1.96 0.88 116.57 120.56 2k20 h LYS 36 Ca -0.48 0.00 -0.29 0.00 -0.00 0.00 0.00 60.65 59.87 2k20 h LYS 36 Cb 1.38 0.00 -0.05 0.00 -0.00 0.00 0.00 32.23 33.57 2k20 h LYS 36 CO 0.71 0.00 -2.05 -0.85 -0.00 0.00 0.00 179.45 177.25 2k20 n GLU 37 N -3.06 0.44 0.09 0.07 0.28 -1.26 -4.60 120.64 112.60 2k20 n GLU 37 Ca -0.00 0.14 0.12 0.00 -0.16 0.00 0.00 57.16 57.25 2k20 n GLU 37 Cb 0.23 -1.29 0.14 0.00 1.43 0.00 0.00 31.44 31.95 2k20 n GLU 37 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2k20 h ASN 38 N -0.29 0.00 -1.17 -1.84 2.35 -1.94 -3.47 115.58 109.23 2k20 h ASN 38 Ca -0.44 -0.11 -0.40 0.00 -0.55 0.00 0.00 56.30 54.80 2k20 h ASN 38 Cb 1.55 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 39.78 2k20 h ASN 38 CO -0.16 0.06 -0.38 1.41 -1.65 0.00 0.00 177.43 176.71 2k20 n HIS 39 N -2.39 -0.12 -3.76 1.19 8.25 0.30 -4.89 115.22 113.80 2k20 n HIS 39 Ca 0.03 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.12 2k20 n HIS 39 Cb 0.48 -3.34 -0.07 0.00 1.12 0.00 0.00 29.99 28.18 2k20 n HIS 39 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2k20 s ALA 40 N -2.76 3.76 0.01 -1.41 0.00 -1.25 -4.63 121.76 115.47 2k20 s ALA 40 Ca 0.00 -0.62 -0.37 0.00 0.00 0.00 0.00 51.96 50.97 2k20 s ALA 40 Cb 0.00 -2.12 -0.15 0.00 0.00 0.00 0.00 23.12 20.84 2k20 s ALA 40 CO 0.00 0.35 1.52 -0.40 0.00 0.00 0.00 175.76 177.24 2k20 n ASP 41 N 2.83 2.25 0.05 0.00 5.68 -1.26 0.11 116.55 126.21 2k20 n ASP 41 Ca -0.17 1.09 0.11 0.00 -0.50 0.00 0.00 54.79 55.32 2k20 n ASP 41 Cb 0.53 -1.24 -0.06 0.00 -1.14 0.00 0.00 41.12 39.21 2k20 n ASP 41 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2k20 n LEU 42 N 3.70 0.49 0.00 -2.12 4.77 0.34 -4.79 117.00 119.39 2k20 n LEU 42 Ca 0.20 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2k20 n LEU 42 Cb 0.21 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2k20 n LEU 42 CO 0.68 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 2k20 n GLY 43 N 1.23 2.88 3.69 -0.72 0.00 -1.23 -4.94 105.19 106.10 2k20 n GLY 43 Ca -0.01 -1.96 -0.35 0.00 0.00 0.00 0.00 46.02 43.70 2k20 n GLY 43 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k20 s ILE 44 N -2.02 5.07 0.06 -0.61 -0.00 -1.26 -1.96 121.20 120.48 2k20 s ILE 44 Ca 0.00 0.07 0.06 0.00 -0.00 0.00 0.00 60.65 60.78 2k20 s ILE 44 Cb 0.00 -3.29 -0.04 0.00 -0.00 0.00 0.00 42.46 39.13 2k20 s ILE 44 CO 0.00 0.47 -0.12 -0.36 -0.00 0.00 0.00 174.94 174.93 2k20 s PHE 45 N 0.23 2.71 -0.37 1.37 0.40 -0.24 -0.28 117.98 121.80 2k20 s PHE 45 Ca 0.06 -0.16 -0.27 0.00 -0.60 0.00 0.00 56.93 55.96 2k20 s PHE 45 Cb -0.12 -1.49 -0.06 0.00 0.51 0.00 0.00 43.02 41.87 2k20 s PHE 45 CO -0.00 0.35 2.30 0.08 0.70 0.00 0.00 175.22 178.65 2k20 s VAL 46 N -1.06 3.03 0.08 -0.44 1.01 -0.41 -2.19 120.40 120.41 2k20 s VAL 46 Ca 0.18 0.02 -0.14 0.00 0.00 0.00 0.00 61.98 62.04 2k20 s VAL 46 Cb -0.11 -3.05 -0.22 0.00 0.00 0.00 0.00 36.38 33.00 2k20 s VAL 46 CO 0.09 -0.04 1.21 0.50 0.00 0.00 0.00 175.10 176.86 2k20 h LYS 47 N 17.38 0.72 -1.40 2.72 1.63 0.10 -2.25 116.57 135.48 2k20 h LYS 47 Ca -0.32 -0.74 0.13 0.00 -0.85 0.00 0.00 60.65 58.87 2k20 h LYS 47 Cb 1.25 0.20 -0.26 0.00 -0.60 0.00 0.00 32.23 32.83 2k20 h LYS 47 CO 1.07 1.32 0.30 -1.12 -3.45 0.00 0.00 179.45 177.57 2k20 s SER 48 N -7.26 -0.57 -0.25 4.20 0.01 -0.80 -4.92 113.70 104.11 2k20 s SER 48 Ca -0.10 0.87 -0.16 0.00 1.31 0.00 0.00 55.95 57.87 2k20 s SER 48 Cb 0.07 1.40 -0.03 0.00 0.21 0.00 0.00 66.02 67.67 2k20 s SER 48 CO 0.92 -0.13 0.42 -0.63 0.41 0.00 0.00 173.24 174.23 2k20 s ILE 49 N 1.77 5.15 -0.24 1.44 1.01 -1.26 1.00 121.20 130.06 2k20 s ILE 49 Ca -0.07 0.69 -0.29 0.00 0.00 0.00 0.00 60.65 60.98 2k20 s ILE 49 Cb -0.05 -3.74 -0.06 0.00 0.01 0.00 0.00 42.46 38.62 2k20 s ILE 49 CO -0.16 0.16 2.23 -0.38 0.00 0.00 0.00 174.94 176.79 2k20 n ILE 50 N 4.95 0.31 -1.15 2.92 -0.00 0.32 -4.81 119.36 121.90 2k20 n ILE 50 Ca -0.07 -0.45 -0.38 0.00 -0.00 0.00 0.00 62.75 61.85 2k20 n ILE 50 Cb 0.51 -2.48 -0.09 0.00 -0.00 0.00 0.00 39.64 37.58 2k20 n ILE 50 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.55 176.09 2k20 n ASN 51 N 11.67 1.99 0.00 4.38 0.23 -1.26 -1.58 115.26 130.69 2k20 n ASN 51 Ca 0.31 -2.60 0.00 0.00 -0.53 0.00 0.00 54.58 51.76 2k20 n ASN 51 Cb 0.43 -1.10 0.00 0.00 -2.08 0.00 0.00 39.78 37.03 2k20 n ASN 51 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2k20 n GLY 52 N 5.08 0.26 0.00 4.83 0.00 -1.26 -5.07 105.19 109.04 2k20 n GLY 52 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.49 2k20 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k20 n GLY 53 N 0.00 -2.17 0.23 -0.02 0.00 -0.62 -4.70 105.19 97.91 2k20 n GLY 53 Ca 0.00 -1.45 -0.13 0.00 0.00 0.00 0.00 46.02 44.45 2k20 n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k20 h ALA 54 N -2.00 0.49 -0.50 4.61 0.00 0.21 -1.77 119.26 120.30 2k20 h ALA 54 Ca 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 2k20 h ALA 54 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2k20 h ALA 54 CO 0.00 0.47 0.20 0.00 0.00 0.00 0.00 179.25 179.93 2k20 h ALA 55 N 0.76 0.65 -0.16 0.00 0.00 -1.31 0.14 119.26 119.33 2k20 h ALA 55 Ca 0.07 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 2k20 h ALA 55 Cb 0.81 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2k20 h ALA 55 CO 0.07 0.25 -0.38 1.03 0.00 0.00 0.00 179.25 180.22 2k20 h SER 56 N 0.67 0.37 0.45 0.00 0.87 -1.71 -2.75 113.55 111.45 2k20 h SER 56 Ca 0.17 -0.15 -0.14 0.00 -1.23 0.00 0.00 61.79 60.44 2k20 h SER 56 Cb 0.19 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2k20 h SER 56 CO -0.01 0.72 -0.62 0.11 -0.53 0.00 0.00 176.83 176.50 2k20 h LYS 57 N 0.30 0.16 0.00 2.24 1.57 -0.91 -2.88 116.57 117.04 2k20 h LYS 57 Ca 0.03 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 2k20 h LYS 57 Cb 0.80 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 2k20 h LYS 57 CO 0.06 0.73 -0.13 0.22 -0.57 0.00 0.00 179.45 179.76 2k20 h ASP 58 N 0.12 0.00 -3.03 0.86 3.58 -0.44 -3.46 116.42 114.05 2k20 h ASP 58 Ca -0.01 0.00 -0.40 0.00 0.42 0.00 0.00 57.03 57.04 2k20 h ASP 58 Cb 1.12 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.14 2k20 h ASP 58 CO 0.09 0.13 -0.51 0.61 -2.88 0.00 0.00 179.24 176.68 2k20 n GLY 59 N -0.66 -0.43 0.00 -0.78 0.00 -1.09 -4.81 105.19 97.43 2k20 n GLY 59 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2k20 n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k20 n ARG 60 N -2.98 2.11 -2.37 1.61 1.74 -1.26 -5.06 116.66 110.45 2k20 n ARG 60 Ca -0.24 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.50 2k20 n ARG 60 Cb 0.68 -0.88 -0.01 0.00 -1.02 0.00 0.00 32.46 31.23 2k20 n ARG 60 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2k20 s LEU 61 N -3.64 3.78 -0.12 0.55 1.02 -1.26 -5.06 118.68 113.96 2k20 s LEU 61 Ca 0.00 2.06 -0.09 0.00 0.02 0.00 0.00 54.13 56.13 2k20 s LEU 61 Cb 0.00 -4.57 0.04 0.00 0.02 0.00 0.00 46.19 41.68 2k20 s LEU 61 CO 0.00 -1.04 0.29 -0.13 0.02 0.00 0.00 176.35 175.50 2k20 s ARG 62 N -3.29 0.31 -0.70 1.70 3.00 -1.26 -4.96 118.95 113.75 2k20 s ARG 62 Ca 0.70 0.49 -0.26 0.00 0.00 0.00 0.00 55.73 56.67 2k20 s ARG 62 Cb -0.21 0.06 -0.07 0.00 0.00 0.00 0.00 34.95 34.73 2k20 s ARG 62 CO 0.24 -0.09 2.16 0.08 0.00 0.00 0.00 175.30 177.69 2k20 s VAL 63 N 0.65 3.21 0.00 3.52 1.01 -1.26 -1.96 120.40 125.56 2k20 s VAL 63 Ca -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.89 2k20 s VAL 63 Cb -0.05 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.83 2k20 s VAL 63 CO -0.04 -0.47 0.00 -0.46 0.00 0.00 0.00 175.10 174.13 2k20 n ASN 64 N 15.37 0.00 -4.73 3.32 0.23 -0.84 -4.95 115.26 123.66 2k20 n ASN 64 Ca 0.36 0.00 -0.40 0.00 -0.53 0.00 0.00 54.58 54.01 2k20 n ASN 64 Cb 0.49 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.15 2k20 n ASN 64 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2k20 s ASP 65 N 0.00 7.17 -0.31 0.53 1.01 -0.83 -4.76 116.67 119.49 2k20 s ASP 65 Ca 0.00 1.41 -0.21 0.00 0.71 0.00 0.00 52.55 54.46 2k20 s ASP 65 Cb 0.00 -2.47 -0.01 0.00 1.01 0.00 0.00 42.92 41.45 2k20 s ASP 65 CO 0.00 -0.10 0.65 -1.58 0.21 0.00 0.00 175.17 174.35 2k20 s GLN 66 N 0.51 3.90 0.16 8.23 2.00 -0.36 -1.29 119.66 132.81 2k20 s GLN 66 Ca 0.41 0.32 -0.30 0.00 -2.00 0.00 0.00 55.36 53.79 2k20 s GLN 66 Cb -0.20 -3.73 -0.08 0.00 0.80 0.00 0.00 33.01 29.81 2k20 s GLN 66 CO 0.22 -0.59 1.24 -0.51 -0.50 0.00 0.00 175.29 175.16 2k20 s LEU 67 N 2.65 4.42 0.00 3.68 1.43 0.61 0.11 118.68 131.58 2k20 s LEU 67 Ca 0.26 2.24 0.00 0.00 -1.03 0.00 0.00 54.13 55.60 2k20 s LEU 67 Cb -0.15 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.47 2k20 s LEU 67 CO 0.12 -0.45 0.00 -0.38 0.23 0.00 0.00 176.35 175.87 2k20 n ILE 68 N 2.93 0.00 -3.83 -0.59 5.41 0.27 -4.37 119.36 119.18 2k20 n ILE 68 Ca 0.06 0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.72 2k20 n ILE 68 Cb 0.44 0.06 -0.04 0.00 -0.71 0.00 0.00 39.64 39.40 2k20 n ILE 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2k20 s ALA 69 N -1.82 -0.83 -0.26 -1.39 0.00 -0.56 -0.01 121.76 116.90 2k20 s ALA 69 Ca 0.00 -0.41 -0.13 0.00 0.00 0.00 0.00 51.96 51.42 2k20 s ALA 69 Cb 0.00 0.91 0.09 0.00 0.00 0.00 0.00 23.12 24.12 2k20 s ALA 69 CO 0.00 -0.87 0.62 0.54 0.00 0.00 0.00 175.76 176.05 2k20 s VAL 70 N -3.92 -0.34 -0.83 0.00 0.11 -0.78 -1.96 120.40 112.68 2k20 s VAL 70 Ca 0.13 0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.21 2k20 s VAL 70 Cb -0.02 -0.92 0.00 0.00 -1.53 0.00 0.00 36.38 33.91 2k20 s VAL 70 CO 0.02 0.01 0.00 0.59 -3.33 0.00 0.00 175.10 172.40 2k20 n ASN 71 N 4.72 -4.90 0.00 3.54 3.02 0.11 -1.80 115.26 119.95 2k20 n ASN 71 Ca -0.17 0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 2k20 n ASN 71 Cb 0.55 -3.09 0.00 0.00 -0.61 0.00 0.00 39.78 36.63 2k20 n ASN 71 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k20 n GLY 72 N -0.76 0.83 3.04 7.41 0.00 -1.26 -4.91 105.19 109.54 2k20 n GLY 72 Ca -0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 2k20 n GLY 72 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k20 s GLU 73 N -0.82 2.06 0.54 1.61 -1.05 -0.75 -5.11 118.70 115.18 2k20 s GLU 73 Ca 0.00 -1.32 -0.22 0.00 -0.15 0.00 0.00 54.97 53.28 2k20 s GLU 73 Cb 0.00 -2.85 -0.05 0.00 -0.44 0.00 0.00 34.13 30.78 2k20 s GLU 73 CO 0.00 -0.61 1.36 0.43 0.95 0.00 0.00 175.26 177.39 2k20 n SER 74 N 4.46 2.73 0.00 0.83 7.64 -1.26 -1.86 113.62 126.16 2k20 n SER 74 Ca -0.12 0.99 0.00 0.00 1.01 0.00 0.00 58.87 60.75 2k20 n SER 74 Cb 0.42 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.05 2k20 n SER 74 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k20 n LEU 75 N -0.90 1.36 0.26 -3.43 -0.00 0.99 -4.68 117.00 110.60 2k20 n LEU 75 Ca 0.10 -1.36 0.09 0.00 -0.00 0.00 0.00 56.01 54.84 2k20 n LEU 75 Cb 0.44 0.00 0.68 0.00 -0.00 0.00 0.00 43.42 44.54 2k20 n LEU 75 CO 0.54 0.34 1.04 0.25 -0.00 0.00 0.00 177.39 179.56 2k20 h LEU 76 N 0.00 0.00 -0.64 1.47 5.85 -1.86 -1.46 115.31 118.66 2k20 h LEU 76 Ca 0.00 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 2k20 h LEU 76 Cb 0.25 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2k20 h LEU 76 CO 0.00 0.05 -0.37 1.23 -0.34 0.00 0.00 178.44 179.01 2k20 h GLY 77 N 0.19 0.00 -2.48 3.75 0.00 -1.91 -3.45 103.07 99.17 2k20 h GLY 77 Ca -0.00 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.89 2k20 h GLY 77 CO 0.01 0.00 -0.23 -1.59 0.00 0.00 0.00 176.54 174.73 2k20 s LYS 78 N -3.38 3.00 0.94 4.80 -2.85 -0.55 -5.09 119.74 116.60 2k20 s LYS 78 Ca 0.02 -0.87 -0.12 0.00 -1.00 0.00 0.00 55.97 54.00 2k20 s LYS 78 Cb 0.09 -2.70 0.16 0.00 -2.06 0.00 0.00 37.83 33.32 2k20 s LYS 78 CO 0.69 -0.16 1.09 0.00 0.10 0.00 0.00 175.35 177.07 2k20 s ALA 79 N -2.37 1.20 0.10 0.59 0.00 -1.26 -4.67 121.76 115.34 2k20 s ALA 79 Ca 0.49 -0.00 -0.32 0.00 0.00 0.00 0.00 51.96 52.12 2k20 s ALA 79 Cb -0.10 -3.23 -0.13 0.00 0.00 0.00 0.00 23.12 19.66 2k20 s ALA 79 CO 0.34 -2.66 1.59 -0.91 0.00 0.00 0.00 175.76 174.12 2k20 h ASN 80 N -1.77 -1.16 -0.63 0.00 2.35 -1.91 0.59 115.58 113.05 2k20 h ASN 80 Ca -0.51 0.11 0.08 0.00 -0.55 0.00 0.00 56.30 55.43 2k20 h ASN 80 Cb 1.29 0.40 -0.04 0.00 0.05 0.00 0.00 38.32 40.02 2k20 h ASN 80 CO 0.52 -0.54 0.42 0.06 -1.65 0.00 0.00 177.43 176.24 2k20 h GLN 81 N -0.79 0.50 -0.28 0.81 -0.00 -1.96 0.39 115.11 113.78 2k20 h GLN 81 Ca -0.02 -0.03 -0.17 0.00 -0.00 0.00 0.00 58.65 58.43 2k20 h GLN 81 Cb 0.73 -0.11 -0.00 0.00 -0.00 0.00 0.00 27.48 28.09 2k20 h GLN 81 CO -0.12 0.33 -0.49 0.93 -0.00 0.00 0.00 178.83 179.48 2k20 h GLU 82 N 0.52 0.79 -0.40 0.06 4.39 -1.70 -1.34 114.58 116.90 2k20 h GLU 82 Ca 0.28 -0.47 -0.14 0.00 0.34 0.00 0.00 59.36 59.38 2k20 h GLU 82 Cb 0.43 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 2k20 h GLU 82 CO -0.09 1.10 -0.29 0.00 -1.16 0.00 0.00 179.01 178.57 2k20 h ALA 83 N 0.82 0.58 0.00 3.43 0.00 0.21 0.27 119.26 124.56 2k20 h ALA 83 Ca 0.03 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 2k20 h ALA 83 Cb 1.07 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2k20 h ALA 83 CO 0.11 0.61 -0.30 0.52 0.00 0.00 0.00 179.25 180.18 2k20 h MET 84 N 0.72 0.00 0.15 0.00 2.86 -0.24 -0.45 114.93 117.97 2k20 h MET 84 Ca 0.08 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.43 2k20 h MET 84 Cb 0.87 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.54 2k20 h MET 84 CO 0.08 0.30 -1.28 1.49 1.06 0.00 0.00 176.91 178.56 2k20 h GLU 85 N 0.00 0.33 -0.43 1.72 4.57 -0.93 -1.51 114.58 118.32 2k20 h GLU 85 Ca -0.00 -0.55 -0.07 0.00 -1.18 0.00 0.00 59.36 57.56 2k20 h GLU 85 Cb 0.55 0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 29.32 2k20 h GLU 85 CO 0.04 1.26 -0.03 1.15 -1.18 0.00 0.00 179.01 180.25 2k20 h THR 86 N 0.09 1.24 0.09 0.32 2.02 0.09 0.13 112.91 116.89 2k20 h THR 86 Ca -0.15 -0.99 -0.26 0.00 0.77 0.00 0.00 66.41 65.78 2k20 h THR 86 Cb 2.00 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 69.35 2k20 h THR 86 CO 0.22 0.34 -1.15 0.17 0.37 0.00 0.00 175.52 175.47 2k20 h LEU 87 N 0.67 0.40 0.06 2.58 8.10 -1.14 -0.90 115.31 125.08 2k20 h LEU 87 Ca 0.13 -0.40 -0.00 0.00 0.11 0.00 0.00 57.88 57.71 2k20 h LEU 87 Cb 0.45 -0.13 0.00 0.00 -0.44 0.00 0.00 40.66 40.55 2k20 h LEU 87 CO 0.02 1.29 -0.03 0.03 -4.11 0.00 0.00 178.44 175.64 2k20 h ARG 88 N 0.10 -0.08 -0.17 0.17 3.08 -0.88 0.35 114.38 116.94 2k20 h ARG 88 Ca -0.11 0.01 -0.18 0.00 0.07 0.00 0.00 59.98 59.76 2k20 h ARG 88 Cb 1.86 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.93 2k20 h ARG 88 CO 0.19 0.05 -0.63 0.07 -1.07 0.00 0.00 179.97 178.58 2k20 h ARG 89 N -0.20 0.63 0.00 0.04 -0.00 -0.84 0.06 114.38 114.07 2k20 h ARG 89 Ca -0.01 -0.44 -0.07 0.00 -0.00 0.00 0.00 59.98 59.46 2k20 h ARG 89 Cb 0.17 0.07 -0.01 0.00 -0.00 0.00 0.00 29.97 30.20 2k20 h ARG 89 CO 0.01 1.06 -0.34 0.77 -0.00 0.00 0.00 179.97 181.48 2k20 h SER 90 N 0.46 0.00 0.52 0.08 0.02 -1.03 0.05 113.55 113.66 2k20 h SER 90 Ca -0.01 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.65 2k20 h SER 90 Cb 1.21 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.71 2k20 h SER 90 CO 0.12 0.34 -1.66 0.00 -1.14 0.00 0.00 176.83 174.49 2k20 h MET 91 N 0.00 0.01 -0.51 3.45 -0.00 -0.17 0.88 114.93 118.59 2k20 h MET 91 Ca -0.00 -0.01 -0.13 0.00 -0.00 0.00 0.00 59.70 59.56 2k20 h MET 91 Cb 0.62 0.01 -0.08 0.00 -0.00 0.00 0.00 31.60 32.15 2k20 h MET 91 CO 0.04 0.55 0.11 0.45 -0.00 0.00 0.00 176.91 178.06 2k20 n SER 92 N -3.08 4.20 0.00 -0.10 2.88 -0.00 -2.69 113.62 114.82 2k20 n SER 92 Ca -0.16 -3.23 0.00 0.00 -1.33 0.00 0.00 58.87 54.15 2k20 n SER 92 Cb 1.04 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 2k20 n SER 92 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2k20 n THR 93 N -0.39 0.00 0.00 2.46 5.66 -0.01 -4.94 114.28 117.07 2k20 n THR 93 Ca 0.32 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 61.31 2k20 n THR 93 Cb 1.16 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.93 2k20 n THR 93 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2k20 n GLU 94 N -0.61 0.10 0.07 1.09 1.02 -0.98 -4.38 120.64 116.95 2k20 n GLU 94 Ca 0.00 0.04 0.10 0.00 -0.02 0.00 0.00 57.16 57.28 2k20 n GLU 94 Cb 0.00 -0.54 0.56 0.00 -0.02 0.00 0.00 31.44 31.45 2k20 n GLU 94 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2k20 h GLY 95 N -0.19 0.28 1.69 0.62 0.00 0.58 -1.11 103.07 104.95 2k20 h GLY 95 Ca 0.00 -0.09 -0.17 0.00 0.00 0.00 0.00 47.33 47.07 2k20 h GLY 95 CO 0.00 0.07 -0.68 -0.57 0.00 0.00 0.00 176.54 175.37 2k20 h ASN 96 N 0.23 0.36 -1.04 0.19 -0.00 -1.70 0.69 115.58 114.32 2k20 h ASN 96 Ca 0.15 -0.22 0.35 0.00 -0.00 0.00 0.00 56.30 56.58 2k20 h ASN 96 Cb 0.31 -0.11 -0.15 0.00 -0.00 0.00 0.00 38.32 38.37 2k20 h ASN 96 CO -0.03 0.93 0.60 0.11 -0.00 0.00 0.00 177.43 179.04 2k20 h LYS 97 N 0.22 0.22 0.00 6.67 1.57 -1.40 0.47 116.57 124.33 2k20 h LYS 97 Ca -0.02 -0.01 -0.21 0.00 -1.87 0.00 0.00 60.65 58.54 2k20 h LYS 97 Cb 1.22 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 33.44 2k20 h LYS 97 CO 0.11 0.15 -1.94 0.54 -0.57 0.00 0.00 179.45 177.73 2k20 n ARG 98 N -5.04 0.66 0.00 3.15 3.00 -1.21 -4.98 116.66 112.23 2k20 n ARG 98 Ca 0.34 0.04 0.00 0.00 -0.01 0.00 0.00 57.85 58.21 2k20 n ARG 98 Cb 1.10 -1.63 0.00 0.00 0.00 0.00 0.00 32.46 31.93 2k20 n ARG 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k20 n GLY 99 N 1.51 1.04 3.54 -0.13 0.00 0.17 -5.03 105.19 106.28 2k20 n GLY 99 Ca -0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 2k20 n GLY 99 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2k20 s MET 100 N -0.14 0.81 0.04 1.61 0.23 0.24 -0.27 119.30 121.82 2k20 s MET 100 Ca 0.00 0.77 0.05 0.00 -1.03 0.00 0.00 55.69 55.48 2k20 s MET 100 Cb 0.00 0.39 -0.04 0.00 -1.53 0.00 0.00 34.83 33.66 2k20 s MET 100 CO 0.00 -0.13 -0.11 -1.50 -2.03 0.00 0.00 175.02 171.25 2k20 s ILE 101 N 0.05 3.34 0.09 3.16 2.07 0.39 -4.31 121.20 126.00 2k20 s ILE 101 Ca -0.02 -1.03 -0.22 0.00 -1.41 0.00 0.00 60.65 57.97 2k20 s ILE 101 Cb -0.04 -2.48 -0.07 0.00 0.13 0.00 0.00 42.46 40.01 2k20 s ILE 101 CO 0.02 0.30 0.67 -1.58 -1.91 0.00 0.00 174.94 172.44 2k20 s GLN 102 N -1.66 4.38 -0.02 3.50 -0.44 -1.26 -0.12 119.66 124.04 2k20 s GLN 102 Ca 0.18 0.92 0.04 0.00 -2.50 0.00 0.00 55.36 54.00 2k20 s GLN 102 Cb -0.11 -3.28 -0.01 0.00 -1.64 0.00 0.00 33.01 27.97 2k20 s GLN 102 CO 0.09 0.53 -0.15 -0.51 0.50 0.00 0.00 175.29 175.75 2k20 s LEU 103 N -0.83 1.99 -0.20 3.68 2.01 0.10 0.03 118.68 125.47 2k20 s LEU 103 Ca 0.33 -0.27 -0.00 0.00 0.01 0.00 0.00 54.13 54.19 2k20 s LEU 103 Cb -0.21 -0.78 0.05 0.00 0.01 0.00 0.00 46.19 45.27 2k20 s LEU 103 CO 0.22 0.17 -0.05 -0.63 1.01 0.00 0.00 176.35 177.06 2k20 s ILE 104 N -0.25 1.28 0.46 -0.59 1.01 -0.83 0.14 121.20 122.43 2k20 s ILE 104 Ca 0.04 -0.89 0.03 0.00 0.00 0.00 0.00 60.65 59.83 2k20 s ILE 104 Cb -0.07 -1.51 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 2k20 s ILE 104 CO -0.00 0.02 0.02 0.68 0.00 0.00 0.00 174.94 175.66 2k20 s VAL 105 N 1.53 1.29 -0.08 2.92 -7.23 -0.53 0.98 120.40 119.28 2k20 s VAL 105 Ca -0.02 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.05 2k20 s VAL 105 Cb -0.17 -2.42 0.02 0.00 0.56 0.00 0.00 36.38 34.38 2k20 s VAL 105 CO -0.07 0.00 0.26 0.00 -0.31 0.00 0.00 175.10 174.98 2k20 s ALA 106 N -2.90 -0.66 0.33 1.32 0.00 0.30 0.20 121.76 120.35 2k20 s ALA 106 Ca 0.17 0.65 -0.03 0.00 0.00 0.00 0.00 51.96 52.74 2k20 s ALA 106 Cb 0.04 -0.35 0.01 0.00 0.00 0.00 0.00 23.12 22.83 2k20 s ALA 106 CO 0.09 -0.15 0.49 2.89 0.00 0.00 0.00 175.76 179.08 2k20 n ARG 107 N 2.65 0.71 -4.02 0.00 -4.01 -0.86 -1.22 116.66 109.91 2k20 n ARG 107 Ca -0.14 -2.49 -0.34 0.00 -1.04 0.00 0.00 57.85 53.84 2k20 n ARG 107 Cb 0.58 2.49 -0.06 0.00 -3.04 0.00 0.00 32.46 32.42 2k20 n ARG 107 CO 0.00 0.00 0.00 1.03 -3.04 0.00 0.00 177.63 175.62 2k20 s ARG 108 N -2.63 3.24 -0.03 2.89 3.00 -1.26 -1.94 118.95 122.22 2k20 s ARG 108 Ca 0.25 -0.36 -0.24 0.00 0.00 0.00 0.00 55.73 55.38 2k20 s ARG 108 Cb -0.01 -2.99 -0.18 0.00 0.00 0.00 0.00 34.95 31.77 2k20 s ARG 108 CO 0.18 0.68 1.06 0.82 0.00 0.00 0.00 175.30 178.04 2k20 h ILE 109 N 3.29 1.01 0.00 1.52 2.04 -1.46 -3.49 117.51 120.43 2k20 h ILE 109 Ca -0.50 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 64.28 2k20 h ILE 109 Cb 1.19 1.63 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 2k20 h ILE 109 CO 0.63 0.24 0.00 -0.24 0.00 0.00 0.00 178.15 178.78