#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 0.01 -2.54 2.61 -2.24 -1.26 -4.91 114.28 105.95 2k20 n THR 8 Ca 0.00 -0.09 -0.41 0.00 -2.27 0.00 0.00 64.05 61.28 2k20 n THR 8 Cb 0.00 0.37 -0.04 0.00 -2.10 0.00 0.00 70.33 68.56 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 -2.26 4.55 0.12 -0.78 0.52 -1.26 0.38 118.95 120.23 2k20 s ARG 9 Ca -0.01 1.66 -0.25 0.00 -0.52 0.00 0.00 55.73 56.61 2k20 s ARG 9 Cb 0.02 -3.34 0.07 0.00 0.52 0.00 0.00 34.95 32.23 2k20 s ARG 9 CO 0.16 -0.02 0.71 -1.83 0.02 0.00 0.00 175.30 174.33 2k20 s GLU 10 N 0.30 1.19 -0.02 3.54 -1.05 -0.53 -4.97 118.70 117.15 2k20 s GLU 10 Ca 0.52 -0.47 -0.02 0.00 -0.15 0.00 0.00 54.97 54.85 2k20 s GLU 10 Cb -0.27 0.52 -0.04 0.00 -0.44 0.00 0.00 34.13 33.90 2k20 s GLU 10 CO 0.32 -0.52 0.13 -0.06 0.95 0.00 0.00 175.26 176.07 2k20 s PHE 11 N -3.56 3.44 -0.11 4.83 0.40 -1.26 -1.92 117.98 119.80 2k20 s PHE 11 Ca 0.04 0.31 -0.09 0.00 -0.60 0.00 0.00 56.93 56.59 2k20 s PHE 11 Cb -0.01 -1.80 0.03 0.00 0.51 0.00 0.00 43.02 41.75 2k20 s PHE 11 CO -0.09 0.61 0.28 -0.48 0.70 0.00 0.00 175.22 176.24 2k20 s LEU 12 N -1.73 0.78 0.19 -0.37 0.05 0.10 -4.97 118.68 112.73 2k20 s LEU 12 Ca 0.24 0.56 -0.15 0.00 0.05 0.00 0.00 54.13 54.83 2k20 s LEU 12 Cb -0.12 0.92 -0.07 0.00 -2.05 0.00 0.00 46.19 44.86 2k20 s LEU 12 CO 0.15 -0.12 0.61 -0.89 -0.55 0.00 0.00 176.35 175.55 2k20 s THR 13 N 0.45 4.78 -0.09 5.48 2.01 -1.26 -0.01 115.64 126.99 2k20 s THR 13 Ca -0.02 0.91 -0.03 0.00 0.31 0.00 0.00 61.69 62.86 2k20 s THR 13 Cb -0.04 -3.74 0.04 0.00 0.01 0.00 0.00 72.50 68.77 2k20 s THR 13 CO -0.02 0.16 0.08 -0.36 -0.69 0.00 0.00 174.62 173.79 2k20 s PHE 14 N -1.57 0.08 -0.47 4.92 0.08 0.16 -4.90 117.98 116.27 2k20 s PHE 14 Ca 0.42 0.10 -0.24 0.00 0.12 0.00 0.00 56.93 57.33 2k20 s PHE 14 Cb -0.14 -0.53 0.03 0.00 -0.57 0.00 0.00 43.02 41.81 2k20 s PHE 14 CO 0.20 -0.31 0.86 -1.21 -0.10 0.00 0.00 175.22 174.66 2k20 s GLU 15 N 2.17 3.43 -0.44 0.44 8.01 -1.26 0.12 118.70 131.18 2k20 s GLU 15 Ca 0.04 -0.06 -0.09 0.00 0.01 0.00 0.00 54.97 54.87 2k20 s GLU 15 Cb -0.13 -3.96 0.09 0.00 -4.31 0.00 0.00 34.13 25.82 2k20 s GLU 15 CO -0.05 -1.23 0.29 0.08 0.01 0.00 0.00 175.26 174.36 2k20 s VAL 16 N 3.56 4.25 0.01 2.63 1.01 0.87 -4.89 120.40 127.84 2k20 s VAL 16 Ca 0.32 -1.51 -0.30 0.00 0.00 0.00 0.00 61.98 60.49 2k20 s VAL 16 Cb -0.12 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2k20 s VAL 16 CO 0.23 -0.59 1.17 -2.84 0.00 0.00 0.00 175.10 173.07 2k20 s PRO 17 N 1.41 4.41 -0.16 2.72 0.02 -1.26 -1.15 135.00 141.00 2k20 s PRO 17 Ca 0.04 1.69 0.14 0.00 0.02 0.00 0.00 61.00 62.89 2k20 s PRO 17 Cb -0.24 -3.45 0.39 0.00 0.02 0.00 0.00 34.50 31.22 2k20 s PRO 17 CO 0.01 -0.31 1.20 1.47 -0.33 0.00 0.00 177.00 179.04 2k20 n LEU 18 N 4.45 2.29 -0.66 -5.54 -0.00 -0.55 -4.51 117.00 112.48 2k20 n LEU 18 Ca 0.09 -3.39 0.51 0.00 -0.00 0.00 0.00 56.01 53.22 2k20 n LEU 18 Cb 0.47 -0.41 0.79 0.00 -0.00 0.00 0.00 43.42 44.27 2k20 n LEU 18 CO 0.55 1.13 1.43 -0.46 -0.00 0.00 0.00 177.39 180.03 2k20 n ASN 19 N -0.85 0.04 -0.03 1.45 6.94 -1.23 0.12 115.26 121.69 2k20 n ASN 19 Ca 0.16 1.06 -0.04 0.00 -0.02 0.00 0.00 54.58 55.74 2k20 n ASN 19 Cb 0.76 -0.53 -0.05 0.00 -2.36 0.00 0.00 39.78 37.60 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 -4.06 3.41 0.00 0.53 8.00 -1.26 -4.52 116.55 118.65 2k20 n ASP 20 Ca 0.44 -0.01 0.08 0.00 0.71 0.00 0.00 54.79 56.00 2k20 n ASP 20 Cb 1.92 0.45 0.35 0.00 -0.02 0.00 0.00 41.12 43.82 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 -2.37 0.00 -0.23 -2.24 2.88 0.35 -3.45 113.62 108.56 2k20 n SER 21 Ca -0.12 0.36 0.32 0.00 -1.33 0.00 0.00 58.87 58.10 2k20 n SER 21 Cb 0.69 -0.43 0.68 0.00 -0.75 0.00 0.00 64.21 64.40 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 2.66 0.00 1.33 0.46 0.00 0.68 0.92 103.07 109.13 2k20 h GLY 22 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.05 2k20 h GLY 22 CO 0.00 0.00 -1.46 1.76 0.00 0.00 0.00 176.54 176.84 2k20 h SER 23 N 0.00 0.21 -0.36 0.19 0.02 -1.84 -3.29 113.55 108.48 2k20 h SER 23 Ca 0.50 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 2k20 h SER 23 Cb 2.31 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 64.79 2k20 h SER 23 CO -0.01 1.25 0.00 0.00 -1.14 0.00 0.00 176.83 176.93 2k20 n ALA 24 N -2.58 2.53 0.00 3.77 0.00 0.30 -4.93 120.51 119.59 2k20 n ALA 24 Ca -0.13 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.63 2k20 n ALA 24 Cb 1.02 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.49 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 0.99 1.71 0.00 0.00 0.00 0.13 -3.38 105.19 104.65 2k20 n GLY 25 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -4.71 117.00 119.99 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 -0.11 1.75 3.42 -3.96 0.00 -1.22 0.18 105.19 105.25 2k20 n GLY 27 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.00 0.02 -0.22 1.61 -7.23 -1.26 0.13 120.40 111.45 2k20 s VAL 28 Ca 0.00 -0.18 -0.06 0.00 -1.81 0.00 0.00 61.98 59.93 2k20 s VAL 28 Cb 0.00 -0.88 -0.03 0.00 0.56 0.00 0.00 36.38 36.04 2k20 s VAL 28 CO 0.00 -0.10 0.03 -0.44 -0.31 0.00 0.00 175.10 174.28 2k20 s SER 29 N -1.32 4.97 0.15 4.85 0.01 0.14 -4.90 113.70 117.59 2k20 s SER 29 Ca -0.11 -0.19 0.05 0.00 1.31 0.00 0.00 55.95 57.01 2k20 s SER 29 Cb -0.02 -1.87 -0.04 0.00 0.21 0.00 0.00 66.02 64.31 2k20 s SER 29 CO 0.07 0.03 0.07 0.68 0.41 0.00 0.00 173.24 174.51 2k20 s VAL 30 N 1.20 4.22 -0.22 3.43 -7.23 -1.26 0.22 120.40 120.75 2k20 s VAL 30 Ca 0.04 -1.13 -0.12 0.00 -1.81 0.00 0.00 61.98 58.95 2k20 s VAL 30 Cb -0.14 -3.12 0.07 0.00 0.56 0.00 0.00 36.38 33.75 2k20 s VAL 30 CO 0.02 -0.05 0.55 -1.59 -0.31 0.00 0.00 175.10 173.71 2k20 s LYS 31 N -2.88 0.54 0.26 4.82 -2.85 -0.73 -4.78 119.74 114.12 2k20 s LYS 31 Ca 0.29 1.00 0.06 0.00 -1.00 0.00 0.00 55.97 56.33 2k20 s LYS 31 Cb -0.10 0.06 -0.03 0.00 -2.06 0.00 0.00 37.83 35.69 2k20 s LYS 31 CO 0.21 -0.15 0.26 0.20 0.10 0.00 0.00 175.35 175.97 2k20 s GLY 32 N 1.53 1.38 0.48 0.59 0.00 -1.25 -0.08 107.32 109.96 2k20 s GLY 32 Ca -0.10 -1.38 0.04 0.00 0.00 0.00 0.00 44.72 43.29 2k20 s GLY 32 CO -0.16 -1.40 0.15 -1.31 0.00 0.00 0.00 173.10 170.37 2k20 s ASN 33 N -3.90 4.29 0.17 1.64 0.02 -0.71 -4.97 114.94 111.48 2k20 s ASN 33 Ca 0.34 -1.38 0.10 0.00 -1.02 0.00 0.00 52.86 50.91 2k20 s ASN 33 Cb -0.08 0.13 -0.04 0.00 0.02 0.00 0.00 41.25 41.28 2k20 s ASN 33 CO 0.26 -0.79 -0.23 -0.13 0.02 0.00 0.00 177.10 176.23 2k20 s ARG 34 N -3.96 1.41 0.84 -0.60 0.52 -1.26 -0.59 118.95 115.31 2k20 s ARG 34 Ca 0.25 -1.43 -0.15 0.00 -0.52 0.00 0.00 55.73 53.87 2k20 s ARG 34 Cb 0.02 -1.72 -0.05 0.00 0.52 0.00 0.00 34.95 33.72 2k20 s ARG 34 CO 0.14 0.38 0.10 0.43 0.02 0.00 0.00 175.30 176.37 2k20 n SER 35 N 0.49 -2.92 0.06 0.23 7.64 0.31 -4.79 113.62 114.64 2k20 n SER 35 Ca -0.15 0.41 -0.13 0.00 1.01 0.00 0.00 58.87 60.02 2k20 n SER 35 Cb 0.55 -1.06 -0.09 0.00 -1.01 0.00 0.00 64.21 62.60 2k20 n SER 35 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2k20 h LYS 36 N -0.86 -0.16 0.09 1.43 6.56 -2.00 -3.34 116.57 118.28 2k20 h LYS 36 Ca -0.44 0.01 -0.00 0.00 -1.06 0.00 0.00 60.65 59.16 2k20 h LYS 36 Cb 1.33 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 33.02 2k20 h LYS 36 CO 0.35 0.21 -0.04 1.05 -2.06 0.00 0.00 179.45 178.96 2k20 h GLU 37 N -0.56 -0.11 0.00 3.15 4.11 -1.99 -3.47 114.58 115.70 2k20 h GLU 37 Ca -0.02 0.01 -0.48 0.00 0.07 0.00 0.00 59.36 58.94 2k20 h GLU 37 Cb 0.44 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.64 2k20 h GLU 37 CO 0.03 0.35 -0.33 0.27 0.07 0.00 0.00 179.01 179.40 2k20 n ASN 38 N -4.91 2.90 -2.03 3.06 0.23 -1.25 -5.03 115.26 108.22 2k20 n ASN 38 Ca -0.08 -2.60 -0.22 0.00 -0.53 0.00 0.00 54.58 51.15 2k20 n ASN 38 Cb 0.26 0.21 0.05 0.00 -2.08 0.00 0.00 39.78 38.21 2k20 n ASN 38 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 2k20 n HIS 39 N -1.04 1.99 -2.70 -2.53 8.25 -1.26 -2.82 115.22 115.11 2k20 n HIS 39 Ca -0.13 -2.25 -0.43 0.00 -0.26 0.00 0.00 57.72 54.65 2k20 n HIS 39 Cb 0.47 -1.10 -0.03 0.00 1.12 0.00 0.00 29.99 30.45 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 -2.36 3.20 -0.11 -1.41 0.00 -1.26 -4.65 121.76 115.17 2k20 s ALA 40 Ca 0.41 -0.60 -0.38 0.00 0.00 0.00 0.00 51.96 51.38 2k20 s ALA 40 Cb 0.32 -3.78 -0.16 0.00 0.00 0.00 0.00 23.12 19.50 2k20 s ALA 40 CO -0.02 -2.16 1.57 -0.25 0.00 0.00 0.00 175.76 174.91 2k20 n ASP 41 N 7.54 2.11 0.01 0.00 9.92 -1.26 0.11 116.55 134.98 2k20 n ASP 41 Ca 0.09 1.09 -0.17 0.00 -0.53 0.00 0.00 54.79 55.28 2k20 n ASP 41 Cb 0.49 -1.17 -0.14 0.00 -0.64 0.00 0.00 41.12 39.66 2k20 n ASP 41 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2k20 h LEU 42 N 6.11 0.30 0.00 0.64 3.38 -1.15 -3.45 115.31 121.13 2k20 h LEU 42 Ca -0.47 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 56.90 2k20 h LEU 42 Cb 1.32 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2k20 h LEU 42 CO 0.88 1.53 0.00 0.61 0.09 0.00 0.00 178.44 181.55 2k20 n GLY 43 N 1.80 -1.71 3.66 0.83 0.00 -1.25 -4.97 105.19 103.56 2k20 n GLY 43 Ca -0.24 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 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 -1.85 4.36 -0.01 -0.61 -0.00 -1.26 -1.74 121.20 120.08 2k20 s ILE 44 Ca 0.00 -0.22 0.07 0.00 -0.00 0.00 0.00 60.65 60.49 2k20 s ILE 44 Cb 0.00 -2.86 -0.02 0.00 -0.00 0.00 0.00 42.46 39.59 2k20 s ILE 44 CO 0.00 0.58 -0.21 -0.36 -0.00 0.00 0.00 174.94 174.95 2k20 s PHE 45 N -0.62 1.90 -0.35 1.37 0.40 0.88 -0.59 117.98 120.97 2k20 s PHE 45 Ca 0.10 -0.36 -0.30 0.00 -0.60 0.00 0.00 56.93 55.77 2k20 s PHE 45 Cb -0.12 -1.22 -0.08 0.00 0.51 0.00 0.00 43.02 42.11 2k20 s PHE 45 CO 0.02 -0.03 2.28 0.28 0.70 0.00 0.00 175.22 178.47 2k20 n VAL 46 N 2.54 0.19 -0.04 -0.44 0.31 -0.19 -1.77 118.33 118.92 2k20 n VAL 46 Ca -0.15 -0.44 -0.14 0.00 -0.01 0.00 0.00 64.34 63.60 2k20 n VAL 46 Cb 0.53 -2.21 -0.09 0.00 -0.91 0.00 0.00 33.84 31.16 2k20 n VAL 46 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2k20 h LYS 47 N 14.95 0.27 -1.48 5.55 1.63 0.23 0.92 116.57 138.64 2k20 h LYS 47 Ca -0.31 -0.18 0.12 0.00 -0.85 0.00 0.00 60.65 59.43 2k20 h LYS 47 Cb 1.28 0.02 -0.24 0.00 -0.60 0.00 0.00 32.23 32.70 2k20 h LYS 47 CO 1.04 0.78 0.16 0.45 -3.45 0.00 0.00 179.45 178.43 2k20 s SER 48 N -6.16 -0.73 -0.20 4.20 0.15 -0.89 -4.77 113.70 105.30 2k20 s SER 48 Ca -0.15 1.06 -0.22 0.00 0.70 0.00 0.00 55.95 57.34 2k20 s SER 48 Cb 0.04 1.65 -0.02 0.00 -1.71 0.00 0.00 66.02 65.98 2k20 s SER 48 CO 0.75 -0.15 0.71 -0.63 1.20 0.00 0.00 173.24 175.11 2k20 s ILE 49 N 2.16 4.95 -0.24 6.45 1.01 -1.26 0.23 121.20 134.51 2k20 s ILE 49 Ca -0.06 1.36 -0.29 0.00 0.00 0.00 0.00 60.65 61.66 2k20 s ILE 49 Cb -0.07 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 2k20 s ILE 49 CO -0.17 0.05 1.93 -0.63 0.00 0.00 0.00 174.94 176.11 2k20 s ILE 50 N 2.19 3.31 -0.74 2.92 1.09 0.34 -4.85 121.20 125.46 2k20 s ILE 50 Ca 0.32 0.33 -0.24 0.00 -1.10 0.00 0.00 60.65 59.96 2k20 s ILE 50 Cb -0.16 -3.38 -0.19 0.00 -1.06 0.00 0.00 42.46 37.68 2k20 s ILE 50 CO 0.10 -0.21 1.88 0.59 -0.10 0.00 0.00 174.94 177.20 2k20 n ASN 51 N 10.20 2.32 0.00 3.58 3.02 -1.26 -1.74 115.26 131.37 2k20 n ASN 51 Ca 0.24 -2.64 0.00 0.00 -0.03 0.00 0.00 54.58 52.15 2k20 n ASN 51 Cb 0.45 -1.17 0.00 0.00 -0.61 0.00 0.00 39.78 38.45 2k20 n ASN 51 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k20 n GLY 52 N 4.95 0.33 0.19 7.41 0.00 -1.26 -5.06 105.19 111.75 2k20 n GLY 52 Ca 0.48 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.48 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 -2.86 0.25 -0.02 0.00 -0.71 -4.69 105.19 97.15 2k20 n GLY 53 Ca 0.00 -1.38 -0.09 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.06 0.75 -0.29 4.61 0.00 0.17 -1.99 119.26 120.46 2k20 h ALA 54 Ca -0.02 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 2k20 h ALA 54 Cb 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2k20 h ALA 54 CO 0.01 0.66 -0.11 0.00 0.00 0.00 0.00 179.25 179.81 2k20 h ALA 55 N 0.97 0.40 -0.32 0.00 0.00 0.40 -0.87 119.26 119.86 2k20 h ALA 55 Ca 0.06 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2k20 h ALA 55 Cb 0.90 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2k20 h ALA 55 CO 0.08 0.26 -0.11 1.03 0.00 0.00 0.00 179.25 180.51 2k20 h SER 56 N 0.34 0.52 0.34 0.00 0.87 -1.70 -2.21 113.55 111.70 2k20 h SER 56 Ca 0.07 -0.13 -0.10 0.00 -1.23 0.00 0.00 61.79 60.39 2k20 h SER 56 Cb 0.61 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 2k20 h SER 56 CO 0.04 0.66 -0.44 0.11 -0.53 0.00 0.00 176.83 176.67 2k20 h LYS 57 N 0.49 0.14 -0.49 2.24 1.57 -1.17 -2.79 116.57 116.56 2k20 h LYS 57 Ca 0.09 -0.07 0.13 0.00 -1.87 0.00 0.00 60.65 58.93 2k20 h LYS 57 Cb 0.49 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 2k20 h LYS 57 CO 0.03 0.56 0.34 0.22 -0.57 0.00 0.00 179.45 180.03 2k20 h ASP 58 N 0.11 0.08 -0.34 0.86 3.58 -0.49 -3.45 116.42 116.76 2k20 h ASP 58 Ca 0.01 0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.31 2k20 h ASP 58 Cb 0.83 -0.01 -0.06 0.00 1.72 0.00 0.00 39.33 41.81 2k20 h ASP 58 CO 0.06 0.05 -0.13 0.61 -2.88 0.00 0.00 179.24 176.95 2k20 n GLY 59 N -1.60 0.88 0.04 -0.78 0.00 -1.06 -4.80 105.19 97.86 2k20 n GLY 59 Ca 0.08 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2k20 n GLY 59 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k20 n ARG 60 N -1.95 0.68 -4.09 1.61 1.85 -1.26 -5.06 116.66 108.44 2k20 n ARG 60 Ca -0.07 -0.80 -0.35 0.00 -1.00 0.00 0.00 57.85 55.63 2k20 n ARG 60 Cb 0.34 -0.63 -0.09 0.00 -1.05 0.00 0.00 32.46 31.03 2k20 n ARG 60 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2k20 s LEU 61 N -0.28 3.83 0.03 2.89 1.02 -1.26 -5.02 118.68 119.89 2k20 s LEU 61 Ca 0.01 0.15 0.03 0.00 0.02 0.00 0.00 54.13 54.34 2k20 s LEU 61 Cb 0.01 -1.94 -0.02 0.00 0.02 0.00 0.00 46.19 44.26 2k20 s LEU 61 CO 0.00 0.26 -0.10 -0.13 0.02 0.00 0.00 176.35 176.40 2k20 s ARG 62 N -0.17 0.68 0.56 1.70 3.00 -1.26 -4.93 118.95 118.53 2k20 s ARG 62 Ca 0.07 -0.62 -0.20 0.00 0.00 0.00 0.00 55.73 54.99 2k20 s ARG 62 Cb -0.12 -0.61 -0.05 0.00 0.00 0.00 0.00 34.95 34.18 2k20 s ARG 62 CO 0.01 0.15 1.21 0.08 0.00 0.00 0.00 175.30 176.75 2k20 s VAL 63 N -0.84 2.72 0.00 3.52 1.01 -1.26 -2.84 120.40 122.70 2k20 s VAL 63 Ca -0.02 0.47 0.00 0.00 0.00 0.00 0.00 61.98 62.43 2k20 s VAL 63 Cb -0.07 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2k20 s VAL 63 CO 0.01 -0.07 0.00 0.59 0.00 0.00 0.00 175.10 175.63 2k20 n ASN 64 N -1.28 0.00 -4.70 3.32 3.02 0.32 -4.88 115.26 111.05 2k20 n ASN 64 Ca 0.12 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.25 2k20 n ASN 64 Cb 0.49 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.63 2k20 n ASN 64 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2k20 s ASP 65 N -3.22 6.91 -0.06 6.41 1.11 -1.13 -4.51 116.67 122.19 2k20 s ASP 65 Ca 0.00 2.15 -0.24 0.00 0.18 0.00 0.00 52.55 54.63 2k20 s ASP 65 Cb 0.00 -2.57 -0.04 0.00 1.07 0.00 0.00 42.92 41.38 2k20 s ASP 65 CO 0.00 -0.62 0.74 -1.58 1.18 0.00 0.00 175.17 174.89 2k20 s GLN 66 N 1.55 4.46 0.13 8.23 2.00 -0.90 -1.03 119.66 134.09 2k20 s GLN 66 Ca 0.62 0.96 -0.29 0.00 -2.00 0.00 0.00 55.36 54.66 2k20 s GLN 66 Cb -0.32 -3.45 -0.06 0.00 0.80 0.00 0.00 33.01 29.97 2k20 s GLN 66 CO 0.28 0.05 0.91 -0.51 -0.50 0.00 0.00 175.29 175.52 2k20 s LEU 67 N 0.83 4.52 -0.01 3.68 1.43 0.24 -0.23 118.68 129.15 2k20 s LEU 67 Ca 0.40 1.75 0.01 0.00 -1.03 0.00 0.00 54.13 55.26 2k20 s LEU 67 Cb -0.18 -3.51 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 2k20 s LEU 67 CO 0.20 0.01 0.01 -0.38 0.23 0.00 0.00 176.35 176.41 2k20 n ILE 68 N 2.47 0.07 -3.53 -0.59 2.08 0.42 -4.53 119.36 115.75 2k20 n ILE 68 Ca 0.00 -0.04 -0.17 0.00 0.56 0.00 0.00 62.75 63.09 2k20 n ILE 68 Cb 0.49 -0.85 -0.06 0.00 -0.75 0.00 0.00 39.64 38.47 2k20 n ILE 68 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2k20 s ALA 69 N -2.03 -1.77 -0.03 -1.39 0.00 -0.61 0.60 121.76 116.53 2k20 s ALA 69 Ca -0.01 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.37 2k20 s ALA 69 Cb 0.00 -0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.00 2k20 s ALA 69 CO 0.04 -0.37 0.00 0.54 0.00 0.00 0.00 175.76 175.98 2k20 s VAL 70 N -0.99 0.16 -1.97 0.00 0.11 0.85 0.12 120.40 118.68 2k20 s VAL 70 Ca -0.10 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 2k20 s VAL 70 Cb -0.01 -0.26 0.00 0.00 -1.53 0.00 0.00 36.38 34.58 2k20 s VAL 70 CO 0.09 0.14 0.00 0.59 -3.33 0.00 0.00 175.10 172.59 2k20 n ASN 71 N 4.14 -5.79 0.00 3.54 3.02 0.28 -0.93 115.26 119.53 2k20 n ASN 71 Ca -0.27 0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 2k20 n ASN 71 Cb 0.50 -4.93 0.00 0.00 -0.61 0.00 0.00 39.78 34.75 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 -0.77 0.51 2.89 7.41 0.00 -1.26 -4.97 105.19 109.00 2k20 n GLY 72 Ca -0.23 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.61 2k20 n GLY 72 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k20 s GLU 73 N -1.74 1.41 0.63 1.61 2.02 -0.11 -5.12 118.70 117.39 2k20 s GLU 73 Ca 0.00 -0.75 -0.18 0.00 0.02 0.00 0.00 54.97 54.06 2k20 s GLU 73 Cb 0.00 -2.34 -0.03 0.00 0.10 0.00 0.00 34.13 31.86 2k20 s GLU 73 CO 0.00 -0.56 1.13 0.43 0.02 0.00 0.00 175.26 176.28 2k20 n SER 74 N 4.80 1.41 -0.00 -0.19 7.64 -1.26 -0.11 113.62 125.90 2k20 n SER 74 Ca -0.12 0.82 0.03 0.00 1.01 0.00 0.00 58.87 60.61 2k20 n SER 74 Cb 0.46 -1.47 -0.05 0.00 -1.01 0.00 0.00 64.21 62.13 2k20 n SER 74 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2k20 n LEU 75 N -1.33 0.00 0.19 -3.43 4.77 0.20 -4.58 117.00 112.83 2k20 n LEU 75 Ca 0.15 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.31 2k20 n LEU 75 Cb 0.48 0.00 0.82 0.00 -2.33 0.00 0.00 43.42 42.38 2k20 n LEU 75 CO 0.48 0.00 1.16 0.25 -1.33 0.00 0.00 177.39 177.95 2k20 h LEU 76 N 0.00 0.00 0.00 2.23 5.85 -1.82 0.28 115.31 121.84 2k20 h LEU 76 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2k20 h LEU 76 Cb 0.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 2k20 h LEU 76 CO 0.00 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.71 2k20 n GLY 77 N -1.39 -1.03 3.18 3.75 0.00 -1.26 -4.82 105.19 103.63 2k20 n GLY 77 Ca 0.03 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 2k20 n GLY 77 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k20 s LYS 78 N -2.22 0.89 1.40 1.61 -2.85 0.97 -5.13 119.74 114.41 2k20 s LYS 78 Ca 0.37 -1.38 -0.21 0.00 -1.00 0.00 0.00 55.97 53.75 2k20 s LYS 78 Cb 0.20 -0.19 0.36 0.00 -2.06 0.00 0.00 37.83 36.13 2k20 s LYS 78 CO 0.37 -0.05 0.93 0.00 0.10 0.00 0.00 175.35 176.70 2k20 s ALA 79 N -3.65 -0.86 0.00 0.59 0.00 -1.26 -4.60 121.76 111.98 2k20 s ALA 79 Ca 0.15 -0.67 -0.25 0.00 0.00 0.00 0.00 51.96 51.19 2k20 s ALA 79 Cb 0.06 -3.01 -0.15 0.00 0.00 0.00 0.00 23.12 20.02 2k20 s ALA 79 CO -0.03 -4.58 1.10 -0.91 0.00 0.00 0.00 175.76 171.34 2k20 h ASN 80 N -3.37 -0.57 -0.60 0.00 2.35 -1.88 0.29 115.58 111.80 2k20 h ASN 80 Ca -0.47 -0.06 0.05 0.00 -0.55 0.00 0.00 56.30 55.26 2k20 h ASN 80 Cb 1.34 0.15 -0.03 0.00 0.05 0.00 0.00 38.32 39.83 2k20 h ASN 80 CO 0.32 -0.19 0.40 0.06 -1.65 0.00 0.00 177.43 176.38 2k20 h GLN 81 N -1.03 0.64 -0.26 0.81 -0.00 -1.96 0.72 115.11 114.03 2k20 h GLN 81 Ca -0.07 -0.04 -0.13 0.00 -0.00 0.00 0.00 58.65 58.41 2k20 h GLN 81 Cb 0.60 -0.14 -0.00 0.00 -0.00 0.00 0.00 27.48 27.93 2k20 h GLN 81 CO 0.11 0.42 -0.35 1.49 -0.00 0.00 0.00 178.83 180.50 2k20 h GLU 82 N 0.66 0.69 -0.04 0.06 4.81 -1.90 -1.90 114.58 116.96 2k20 h GLU 82 Ca 0.25 -0.40 -0.11 0.00 -0.13 0.00 0.00 59.36 58.97 2k20 h GLU 82 Cb 0.17 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 2k20 h GLU 82 CO -0.07 1.02 -0.47 0.00 -0.73 0.00 0.00 179.01 178.76 2k20 h ALA 83 N 0.67 1.15 -0.07 2.92 0.00 0.81 -1.41 119.26 123.31 2k20 h ALA 83 Ca 0.03 -0.44 -0.16 0.00 0.00 0.00 0.00 54.91 54.35 2k20 h ALA 83 Cb 0.94 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2k20 h ALA 83 CO 0.08 0.61 -0.63 0.52 0.00 0.00 0.00 179.25 179.83 2k20 h MET 84 N 0.08 0.28 0.00 0.00 2.86 0.53 -1.57 114.93 117.11 2k20 h MET 84 Ca 0.00 -0.20 -0.15 0.00 -2.06 0.00 0.00 59.70 57.29 2k20 h MET 84 Cb 0.86 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.53 2k20 h MET 84 CO 0.07 0.82 -0.71 1.05 1.06 0.00 0.00 176.91 179.20 2k20 h GLU 85 N 0.20 0.00 -0.14 1.72 4.11 -1.12 -1.26 114.58 118.09 2k20 h GLU 85 Ca -0.01 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.23 2k20 h GLU 85 Cb 1.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 2k20 h GLU 85 CO 0.10 0.71 -0.68 1.15 0.07 0.00 0.00 179.01 180.37 2k20 h THR 86 N 0.00 1.33 0.07 -1.06 2.02 -1.06 -1.50 112.91 112.72 2k20 h THR 86 Ca -0.01 -1.97 -0.25 0.00 0.77 0.00 0.00 66.41 64.95 2k20 h THR 86 Cb 1.43 1.95 -0.00 0.00 -1.74 0.00 0.00 68.15 69.79 2k20 h THR 86 CO 0.09 0.61 -1.11 0.17 0.37 0.00 0.00 175.52 175.66 2k20 h LEU 87 N 0.41 0.37 0.20 2.58 8.10 -1.28 -0.70 115.31 124.99 2k20 h LEU 87 Ca -0.02 -0.36 -0.01 0.00 0.11 0.00 0.00 57.88 57.59 2k20 h LEU 87 Cb 1.26 -0.12 0.00 0.00 -0.44 0.00 0.00 40.66 41.36 2k20 h LEU 87 CO 0.13 1.24 -0.10 0.03 -4.11 0.00 0.00 178.44 175.63 2k20 h ARG 88 N 0.10 -0.26 -0.09 0.17 3.08 -1.18 0.96 114.38 117.16 2k20 h ARG 88 Ca -0.10 0.02 -0.16 0.00 0.07 0.00 0.00 59.98 59.81 2k20 h ARG 88 Cb 1.81 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.91 2k20 h ARG 88 CO 0.18 -0.12 -0.62 -0.09 -1.07 0.00 0.00 179.97 178.25 2k20 h ARG 89 N -0.34 0.34 0.00 0.04 1.12 -1.35 -0.37 114.38 113.82 2k20 h ARG 89 Ca -0.03 -0.24 -0.13 0.00 -1.11 0.00 0.00 59.98 58.48 2k20 h ARG 89 Cb 0.26 0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.24 2k20 h ARG 89 CO 0.04 0.85 -0.61 0.77 -3.11 0.00 0.00 179.97 177.92 2k20 h SER 90 N 0.25 0.00 1.11 -3.80 0.02 -0.92 -1.05 113.55 109.16 2k20 h SER 90 Ca -0.01 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 2k20 h SER 90 Cb 1.15 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 2k20 h SER 90 CO 0.10 0.61 -0.92 0.00 -1.14 0.00 0.00 176.83 175.48 2k20 h MET 91 N 0.00 0.00 -0.25 3.45 -0.00 0.11 1.51 114.93 119.75 2k20 h MET 91 Ca -0.01 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.64 2k20 h MET 91 Cb 1.10 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.67 2k20 h MET 91 CO 0.08 0.15 -0.02 0.45 -0.00 0.00 0.00 176.91 177.57 2k20 n SER 92 N -2.87 3.28 0.00 -0.10 2.88 -0.16 -2.81 113.62 113.84 2k20 n SER 92 Ca -0.02 -3.24 0.00 0.00 -1.33 0.00 0.00 58.87 54.28 2k20 n SER 92 Cb 0.66 -0.55 0.00 0.00 -0.75 0.00 0.00 64.21 63.56 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 -0.81 0.00 -0.01 2.46 5.66 -0.41 -4.85 114.28 116.32 2k20 n THR 93 Ca 0.24 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.27 2k20 n THR 93 Cb 0.90 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.60 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 -1.45 0.75 -0.05 1.09 1.02 -0.87 -3.77 120.64 117.37 2k20 n GLU 94 Ca 0.00 -0.07 -0.09 0.00 -0.02 0.00 0.00 57.16 56.97 2k20 n GLU 94 Cb 0.00 -1.24 -0.15 0.00 -0.02 0.00 0.00 31.44 30.03 2k20 n GLU 94 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k20 n GLY 95 N 2.03 -0.98 0.12 0.62 0.00 0.51 -4.30 105.19 103.18 2k20 n GLY 95 Ca -0.05 -0.14 -0.18 0.00 0.00 0.00 0.00 46.02 45.66 2k20 n GLY 95 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2k20 h ASN 96 N 0.00 0.40 -1.25 1.61 -0.00 -1.73 1.21 115.58 115.82 2k20 h ASN 96 Ca -0.37 -0.67 0.36 0.00 -0.00 0.00 0.00 56.30 55.62 2k20 h ASN 96 Cb 2.09 -0.13 -0.05 0.00 -0.00 0.00 0.00 38.32 40.22 2k20 h ASN 96 CO 0.06 1.57 1.01 0.07 -0.00 0.00 0.00 177.43 180.15 2k20 h LYS 97 N 0.07 0.00 0.00 6.67 5.09 -1.75 0.32 116.57 126.97 2k20 h LYS 97 Ca -0.31 0.00 -0.17 0.00 0.09 0.00 0.00 60.65 60.25 2k20 h LYS 97 Cb 2.04 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 34.34 2k20 h LYS 97 CO 0.14 0.00 -1.84 2.89 -2.09 0.00 0.00 179.45 178.55 2k20 n ARG 98 N -3.88 1.41 0.00 0.07 1.85 -1.25 -5.01 116.66 109.84 2k20 n ARG 98 Ca 0.27 -0.04 0.00 0.00 -1.00 0.00 0.00 57.85 57.08 2k20 n ARG 98 Cb 1.41 -1.34 0.00 0.00 -1.05 0.00 0.00 32.46 31.48 2k20 n ARG 98 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2k20 n GLY 99 N 2.03 1.03 3.62 2.89 0.00 0.11 -5.07 105.19 109.80 2k20 n GLY 99 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.08 0.65 -0.09 1.61 0.00 0.41 -1.48 119.30 120.32 2k20 s MET 100 Ca 0.00 0.66 0.03 0.00 0.00 0.00 0.00 55.69 56.38 2k20 s MET 100 Cb 0.00 0.31 -0.02 0.00 0.00 0.00 0.00 34.83 35.13 2k20 s MET 100 CO 0.00 -0.10 -0.16 -1.50 0.00 0.00 0.00 175.02 173.26 2k20 s ILE 101 N 0.08 2.82 0.22 3.16 2.07 -0.30 -4.53 121.20 124.72 2k20 s ILE 101 Ca 0.01 -0.78 -0.28 0.00 -1.41 0.00 0.00 60.65 58.19 2k20 s ILE 101 Cb -0.04 -2.13 -0.09 0.00 0.13 0.00 0.00 42.46 40.33 2k20 s ILE 101 CO -0.02 0.56 0.88 0.00 -1.91 0.00 0.00 174.94 174.44 2k20 s GLN 102 N -0.13 4.73 -0.17 3.50 1.03 -1.26 -0.09 119.66 127.26 2k20 s GLN 102 Ca -0.02 1.35 -0.03 0.00 0.04 0.00 0.00 55.36 56.71 2k20 s GLN 102 Cb -0.14 -3.24 0.05 0.00 0.03 0.00 0.00 33.01 29.72 2k20 s GLN 102 CO 0.04 0.52 0.03 -0.51 -2.54 0.00 0.00 175.29 172.83 2k20 s LEU 103 N -1.23 1.06 -0.40 2.60 1.02 0.33 -0.55 118.68 121.51 2k20 s LEU 103 Ca 0.40 -0.70 -0.21 0.00 0.02 0.00 0.00 54.13 53.63 2k20 s LEU 103 Cb -0.24 -0.56 0.01 0.00 0.02 0.00 0.00 46.19 45.42 2k20 s LEU 103 CO 0.29 -0.29 0.69 -0.63 0.02 0.00 0.00 176.35 176.43 2k20 s ILE 104 N 1.88 4.80 0.49 -0.59 1.01 0.12 0.37 121.20 129.28 2k20 s ILE 104 Ca 0.00 0.46 0.01 0.00 0.00 0.00 0.00 60.65 61.12 2k20 s ILE 104 Cb -0.16 -4.18 0.01 0.00 0.01 0.00 0.00 42.46 38.14 2k20 s ILE 104 CO -0.08 -0.49 0.06 1.33 0.00 0.00 0.00 174.94 175.77 2k20 n VAL 105 N 5.80 0.00 -3.76 2.92 0.24 0.98 0.16 118.33 124.67 2k20 n VAL 105 Ca -0.00 -2.26 -0.12 0.00 -2.04 0.00 0.00 64.34 59.91 2k20 n VAL 105 Cb 0.48 0.38 -0.12 0.00 -1.47 0.00 0.00 33.84 33.11 2k20 n VAL 105 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k20 s ALA 106 N -2.82 -0.62 0.33 2.33 0.00 0.69 0.02 121.76 121.69 2k20 s ALA 106 Ca 0.05 0.88 -0.05 0.00 0.00 0.00 0.00 51.96 52.84 2k20 s ALA 106 Cb -0.00 -0.54 0.02 0.00 0.00 0.00 0.00 23.12 22.60 2k20 s ALA 106 CO 0.03 -0.16 0.53 2.89 0.00 0.00 0.00 175.76 179.05 2k20 n ARG 107 N 3.59 0.76 -4.28 0.00 -4.01 -0.81 -2.12 116.66 109.79 2k20 n ARG 107 Ca -0.19 -2.42 -0.34 0.00 -1.04 0.00 0.00 57.85 53.86 2k20 n ARG 107 Cb 0.56 2.50 -0.12 0.00 -3.04 0.00 0.00 32.46 32.36 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 -2.55 3.74 -0.11 2.89 0.52 -1.26 -1.45 118.95 120.73 2k20 s ARG 108 Ca 0.23 -0.48 -0.29 0.00 -0.52 0.00 0.00 55.73 54.67 2k20 s ARG 108 Cb -0.02 -3.00 -0.06 0.00 0.52 0.00 0.00 34.95 32.39 2k20 s ARG 108 CO 0.17 0.23 1.93 0.42 0.02 0.00 0.00 175.30 178.07 2k20 s ILE 109 N 0.40 3.23 0.00 1.52 1.01 0.16 -4.92 121.20 122.60 2k20 s ILE 109 Ca -0.02 0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2k20 s ILE 109 Cb -0.14 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.11 2k20 s ILE 109 CO 0.02 -0.08 0.36 -0.24 0.00 0.00 0.00 174.94 175.00