#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y9o s SER 0 N 0.00 5.03 0.15 1.61 1.04 -1.26 -5.03 113.70 115.25 1y9o s SER 0 Ca 0.00 1.13 0.00 0.00 0.48 0.00 0.00 55.95 57.56 1y9o s SER 0 Cb 0.00 -1.87 0.00 0.00 0.10 0.00 0.00 66.02 64.25 1y9o s SER 0 CO 0.00 -1.60 0.00 0.23 0.98 0.00 0.00 173.24 172.85 1y9o n MET 1 N -3.18 0.00 -1.50 4.02 2.81 -1.26 -5.08 117.12 112.94 1y9o n MET 1 Ca 0.07 0.00 -0.33 0.00 -1.81 0.00 0.00 57.70 55.63 1y9o n MET 1 Cb 0.57 -0.26 0.08 0.00 -0.71 0.00 0.00 33.22 32.90 1y9o n MET 1 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 1y9o s LYS 2 N -2.00 2.40 0.14 0.03 -2.85 -1.26 -5.07 119.74 111.12 1y9o s LYS 2 Ca 0.00 1.44 -0.22 0.00 -1.00 0.00 0.00 55.97 56.19 1y9o s LYS 2 Cb 0.00 -1.90 0.06 0.00 -2.06 0.00 0.00 37.83 33.94 1y9o s LYS 2 CO 0.00 -1.57 0.55 0.21 0.10 0.00 0.00 175.35 174.64 1y9o s LYS 3 N -4.26 1.21 0.10 1.78 2.20 -1.26 -5.19 119.74 114.33 1y9o s LYS 3 Ca 0.67 -0.48 -0.25 0.00 -0.36 0.00 0.00 55.97 55.56 1y9o s LYS 3 Cb -0.22 0.55 0.07 0.00 -1.51 0.00 0.00 37.83 36.72 1y9o s LYS 3 CO 0.46 -0.51 0.63 -1.58 -0.36 0.00 0.00 175.35 174.00 1y9o s TRP 4 N -3.57 -0.56 0.24 4.03 0.52 -1.26 -5.19 118.94 113.15 1y9o s TRP 4 Ca 0.01 0.52 0.10 0.00 0.02 0.00 0.00 56.10 56.75 1y9o s TRP 4 Cb -0.00 0.52 -0.05 0.00 -1.15 0.00 0.00 33.47 32.79 1y9o s TRP 4 CO -0.11 -0.78 -0.17 -1.54 0.02 0.00 0.00 176.95 174.37 1y9o s SER 5 N -2.35 3.04 0.09 2.95 1.04 -1.26 -5.17 113.70 112.04 1y9o s SER 5 Ca -0.02 -1.03 -0.26 0.00 0.48 0.00 0.00 55.95 55.13 1y9o s SER 5 Cb -0.01 -0.21 0.08 0.00 0.10 0.00 0.00 66.02 65.98 1y9o s SER 5 CO -0.07 -0.07 0.75 -0.62 0.98 0.00 0.00 173.24 174.20 1y9o s ASP 6 N -3.41 -0.45 -0.11 7.02 2.15 -1.26 -5.11 116.67 115.49 1y9o s ASP 6 Ca 0.26 -0.03 -0.05 0.00 0.43 0.00 0.00 52.55 53.16 1y9o s ASP 6 Cb -0.03 0.50 0.02 0.00 -0.30 0.00 0.00 42.92 43.11 1y9o s ASP 6 CO 0.11 -0.82 0.10 0.41 -0.17 0.00 0.00 175.17 174.80 1y9o n THR 7 N -0.32 -7.93 -3.78 1.71 -1.04 -1.26 -5.11 114.28 96.55 1y9o n THR 7 Ca -0.12 1.33 -0.13 0.00 -2.04 0.00 0.00 64.05 63.09 1y9o n THR 7 Cb 0.63 -5.20 -0.10 0.00 -1.82 0.00 0.00 70.33 63.84 1y9o n THR 7 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1y9o s GLU 8 N -0.83 0.46 0.11 -2.82 2.12 -1.26 -5.11 118.70 111.37 1y9o s GLU 8 Ca -0.11 0.13 -0.31 0.00 0.36 0.00 0.00 54.97 55.03 1y9o s GLU 8 Cb 0.01 0.21 -0.08 0.00 0.26 0.00 0.00 34.13 34.53 1y9o s GLU 8 CO 0.41 -0.09 1.47 0.54 -0.54 0.00 0.00 175.26 177.05 1y9o s VAL 9 N -0.49 3.11 0.00 3.70 0.11 -1.26 -4.90 120.40 120.67 1y9o s VAL 9 Ca -0.06 0.75 0.00 0.00 -2.93 0.00 0.00 61.98 59.74 1y9o s VAL 9 Cb -0.04 -3.48 0.00 0.00 -1.53 0.00 0.00 36.38 31.33 1y9o s VAL 9 CO 0.02 0.05 0.00 2.22 -3.33 0.00 0.00 175.10 174.05 1y9o n PHE 10 N 4.27 0.00 -4.54 1.54 1.16 -1.26 -5.17 117.46 113.46 1y9o n PHE 10 Ca 0.13 0.00 -0.25 0.00 -1.87 0.00 0.00 57.45 55.46 1y9o n PHE 10 Cb 0.41 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.17 1y9o n PHE 10 CO 0.00 0.00 0.00 -1.83 -1.87 0.00 0.00 176.76 173.06 1y9o s GLU 11 N 0.92 1.81 0.36 3.97 -1.05 -1.26 -5.12 118.70 118.32 1y9o s GLU 11 Ca 0.00 -1.99 0.00 0.00 -0.15 0.00 0.00 54.97 52.83 1y9o s GLU 11 Cb 0.00 -1.38 0.00 0.00 -0.44 0.00 0.00 34.13 32.31 1y9o s GLU 11 CO 0.00 -0.05 0.00 -1.33 0.95 0.00 0.00 175.26 174.83 1y9o n MET 12 N -0.82 -2.23 -3.58 -4.83 2.81 -1.26 -5.08 117.12 102.13 1y9o n MET 12 Ca -0.04 1.69 -0.07 0.00 -1.81 0.00 0.00 57.70 57.47 1y9o n MET 12 Cb 0.66 -2.65 -0.04 0.00 -0.71 0.00 0.00 33.22 30.49 1y9o n MET 12 CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 1y9o s LEU 13 N -6.53 -0.27 -0.08 4.03 0.05 -1.26 -4.68 118.68 109.94 1y9o s LEU 13 Ca 0.00 0.18 -0.05 0.00 0.05 0.00 0.00 54.13 54.31 1y9o s LEU 13 Cb 0.00 1.67 -0.04 0.00 -2.05 0.00 0.00 46.19 45.77 1y9o s LEU 13 CO 0.00 -0.32 0.15 -0.75 -0.55 0.00 0.00 176.35 174.87 1y9o s LYS 14 N -1.76 3.41 -0.43 1.48 2.36 0.01 -4.63 119.74 120.18 1y9o s LYS 14 Ca 0.04 -0.21 -0.26 0.00 -2.55 0.00 0.00 55.97 52.98 1y9o s LYS 14 Cb -0.01 -3.14 0.02 0.00 -1.05 0.00 0.00 37.83 33.66 1y9o s LYS 14 CO -0.03 0.74 0.98 0.50 1.55 0.00 0.00 175.35 179.09 1y9o s ARG 15 N -1.31 3.68 -0.57 4.03 3.52 -1.26 -0.55 118.95 126.48 1y9o s ARG 15 Ca 0.19 0.40 -0.20 0.00 -0.13 0.00 0.00 55.73 55.98 1y9o s ARG 15 Cb -0.12 -3.88 0.07 0.00 -1.56 0.00 0.00 34.95 29.46 1y9o s ARG 15 CO 0.09 -1.17 0.75 0.00 -0.81 0.00 0.00 175.30 174.16 1y9o s MET 16 N 3.83 3.11 0.02 5.12 0.23 0.34 -2.93 119.30 129.02 1y9o s MET 16 Ca 0.40 -0.96 -0.30 0.00 -1.03 0.00 0.00 55.69 53.79 1y9o s MET 16 Cb -0.10 -4.18 -0.05 0.00 -1.53 0.00 0.00 34.83 28.97 1y9o s MET 16 CO 0.25 -1.48 1.26 -0.47 -2.03 0.00 0.00 175.02 172.55 1y9o s TYR 17 N 3.06 3.22 -0.25 3.16 5.04 -0.90 -2.77 117.35 127.91 1y9o s TYR 17 Ca 0.17 1.15 -0.02 0.00 -2.44 0.00 0.00 57.07 55.93 1y9o s TYR 17 Cb -0.20 -3.49 0.08 0.00 0.35 0.00 0.00 41.96 38.70 1y9o s TYR 17 CO 0.10 -1.62 0.05 0.00 -1.34 0.00 0.00 175.55 172.75 1y9o s ALA 18 N 1.70 1.31 -0.55 3.97 0.00 -0.09 -0.63 121.76 127.47 1y9o s ALA 18 Ca 0.59 -1.18 -0.20 0.00 0.00 0.00 0.00 51.96 51.18 1y9o s ALA 18 Cb -0.29 -1.39 0.07 0.00 0.00 0.00 0.00 23.12 21.51 1y9o s ALA 18 CO 0.26 -1.39 0.70 0.50 0.00 0.00 0.00 175.76 175.83 1y9o s ARG 19 N 1.72 3.11 -0.34 0.00 3.00 -1.25 -0.92 118.95 124.28 1y9o s ARG 19 Ca 0.03 -0.97 -0.11 0.00 -1.00 0.00 0.00 55.73 53.68 1y9o s ARG 19 Cb -0.17 -4.16 0.00 0.00 0.00 0.00 0.00 34.95 30.62 1y9o s ARG 19 CO -0.16 -1.40 0.19 0.08 0.00 0.00 0.00 175.30 174.01 1y9o s VAL 20 N 2.87 4.75 0.12 7.11 1.01 -0.17 -2.02 120.40 134.07 1y9o s VAL 20 Ca 0.16 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1y9o s VAL 20 Cb -0.20 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1y9o s VAL 20 CO 0.10 -0.04 0.25 -0.31 0.00 0.00 0.00 175.10 175.11 1y9o s TYR 21 N 1.62 3.47 0.00 5.22 1.51 -1.26 -1.65 117.35 126.26 1y9o s TYR 21 Ca 0.04 0.15 0.00 0.00 -1.01 0.00 0.00 57.07 56.25 1y9o s TYR 21 Cb -0.18 -1.68 0.00 0.00 -0.11 0.00 0.00 41.96 39.99 1y9o s TYR 21 CO 0.07 0.54 0.00 0.41 -1.11 0.00 0.00 175.55 175.46 1y9o n GLY 22 N -0.26 0.40 1.01 0.71 0.00 -1.11 -0.98 105.19 104.96 1y9o n GLY 22 Ca -0.06 -2.28 -0.02 0.00 0.00 0.00 0.00 46.02 43.66 1y9o n GLY 22 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1y9o n LEU 23 N 0.00 2.86 0.02 0.99 7.94 -0.50 -4.25 117.00 124.06 1y9o n LEU 23 Ca 0.00 -1.46 0.08 0.00 -1.11 0.00 0.00 56.01 53.52 1y9o n LEU 23 Cb 0.00 -0.54 0.34 0.00 0.53 0.00 0.00 43.42 43.75 1y9o n LEU 23 CO 0.00 0.48 0.75 1.33 -1.11 0.00 0.00 177.39 178.84 1y9o n VAL 24 N 0.19 0.97 -1.48 1.96 0.24 -1.26 -4.52 118.33 114.43 1y9o n VAL 24 Ca 0.07 0.24 -0.36 0.00 -2.04 0.00 0.00 64.34 62.25 1y9o n VAL 24 Cb 0.57 -1.02 0.08 0.00 -1.47 0.00 0.00 33.84 32.00 1y9o n VAL 24 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1y9o n GLN 25 N -1.61 0.71 0.00 7.34 3.00 -1.26 -3.79 117.38 121.77 1y9o n GLN 25 Ca 0.03 0.30 0.00 0.00 -0.01 0.00 0.00 57.00 57.32 1y9o n GLN 25 Cb 0.18 -2.33 0.00 0.00 0.00 0.00 0.00 30.24 28.09 1y9o n GLN 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1y9o n GLY 26 N 1.02 1.80 3.67 1.08 0.00 -1.26 -4.95 105.19 106.55 1y9o n GLY 26 Ca 0.14 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1y9o n GLY 26 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1y9o s VAL 27 N 0.00 2.45 -0.02 1.61 -7.23 -1.25 -4.88 120.40 111.08 1y9o s VAL 27 Ca 0.00 0.15 -0.05 0.00 -1.81 0.00 0.00 61.98 60.27 1y9o s VAL 27 Cb 0.00 -2.49 -0.21 0.00 0.56 0.00 0.00 36.38 34.24 1y9o s VAL 27 CO 0.00 -0.19 3.30 0.61 -0.31 0.00 0.00 175.10 178.51 1y9o n GLY 28 N -0.59 2.96 0.40 2.32 0.00 -1.26 -4.44 105.19 104.59 1y9o n GLY 28 Ca 0.07 -1.01 -0.15 0.00 0.00 0.00 0.00 46.02 44.92 1y9o n GLY 28 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1y9o h PHE 29 N 2.63 -0.93 0.00 1.61 3.57 -1.90 -0.94 116.94 120.98 1y9o h PHE 29 Ca 0.16 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1y9o h PHE 29 Cb 1.40 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 40.44 1y9o h PHE 29 CO 1.49 -0.58 -0.04 0.07 -2.23 0.00 0.00 178.31 177.03 1y9o h ARG 30 N -1.18 0.00 -0.03 1.11 0.11 -1.87 -1.38 114.38 111.14 1y9o h ARG 30 Ca -0.10 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.96 1y9o h ARG 30 Cb 0.77 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.85 1y9o h ARG 30 CO 0.17 0.04 -0.06 -0.22 0.10 0.00 0.00 179.97 180.00 1y9o h LYS 31 N 0.00 0.09 -0.43 0.08 3.11 -1.87 -2.20 116.57 115.35 1y9o h LYS 31 Ca -0.00 -0.06 0.04 0.00 -2.81 0.00 0.00 60.65 57.82 1y9o h LYS 31 Cb 0.11 0.01 -0.04 0.00 -1.00 0.00 0.00 32.23 31.31 1y9o h LYS 31 CO 0.01 0.63 0.19 0.35 -2.81 0.00 0.00 179.45 177.82 1y9o h PHE 32 N -0.43 0.36 -0.83 1.91 3.57 -0.19 0.12 116.94 121.45 1y9o h PHE 32 Ca 0.00 0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.63 1y9o h PHE 32 Cb 0.62 -0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.21 1y9o h PHE 32 CO 0.12 0.17 0.54 0.28 -2.23 0.00 0.00 178.31 177.18 1y9o h VAL 33 N 0.39 0.92 0.66 1.41 2.07 -1.37 -2.79 116.25 117.55 1y9o h VAL 33 Ca 0.19 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 1y9o h VAL 33 Cb 0.12 0.12 0.01 0.00 -1.52 0.00 0.00 31.29 30.02 1y9o h VAL 33 CO -0.15 0.13 -0.32 -0.61 0.02 0.00 0.00 177.57 176.64 1y9o h GLN 34 N 0.74 -0.86 -0.67 1.57 5.75 -0.17 -1.73 115.11 119.75 1y9o h GLN 34 Ca 0.39 0.06 0.10 0.00 -0.15 0.00 0.00 58.65 59.05 1y9o h GLN 34 Cb 0.51 0.19 -0.12 0.00 1.07 0.00 0.00 27.48 29.14 1y9o h GLN 34 CO -0.16 -0.54 -0.42 0.82 -2.65 0.00 0.00 178.83 175.88 1y9o h ILE 35 N -1.00 0.08 -0.12 2.39 1.08 -0.83 0.13 117.51 119.23 1y9o h ILE 35 Ca -0.09 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.34 1y9o h ILE 35 Cb 0.71 0.08 -0.00 0.00 -3.07 0.00 0.00 36.82 34.54 1y9o h ILE 35 CO 0.15 0.00 -0.06 0.45 -0.69 0.00 0.00 178.15 178.00 1y9o h HIS 36 N -0.17 0.30 -0.41 1.37 3.86 -1.60 -0.47 115.15 118.03 1y9o h HIS 36 Ca 0.21 -0.07 0.09 0.00 -1.16 0.00 0.00 60.37 59.43 1y9o h HIS 36 Cb 0.56 -0.07 -0.08 0.00 1.06 0.00 0.00 27.41 28.87 1y9o h HIS 36 CO -0.74 0.60 -0.15 0.00 0.86 0.00 0.00 177.93 178.50 1y9o h ALA 37 N 0.65 0.19 -0.23 2.45 0.00 -0.59 -0.15 119.26 121.59 1y9o h ALA 37 Ca 0.03 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1y9o h ALA 37 Cb 0.52 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1y9o h ALA 37 CO 0.02 -0.50 0.12 0.82 0.00 0.00 0.00 179.25 179.70 1y9o h ILE 38 N -0.06 1.12 -0.99 0.00 5.03 -0.75 0.48 117.51 122.34 1y9o h ILE 38 Ca 0.20 -0.33 0.10 0.00 -0.12 0.00 0.00 64.86 64.72 1y9o h ILE 38 Cb 0.37 0.93 -0.08 0.00 -3.03 0.00 0.00 36.82 35.01 1y9o h ILE 38 CO -0.46 0.12 0.63 -0.09 -0.68 0.00 0.00 178.15 177.66 1y9o h ARG 39 N 0.25 1.00 -0.02 2.37 1.12 -0.27 -2.24 114.38 116.58 1y9o h ARG 39 Ca 0.08 -0.06 0.00 0.00 -1.11 0.00 0.00 59.98 58.89 1y9o h ARG 39 Cb 0.08 -0.22 0.00 0.00 -0.01 0.00 0.00 29.97 29.82 1y9o h ARG 39 CO -0.01 0.66 -0.04 1.28 -3.11 0.00 0.00 179.97 178.74 1y9o n LEU 40 N -4.57 2.07 -2.49 3.80 4.77 -0.14 -4.99 117.00 115.45 1y9o n LEU 40 Ca 0.17 -0.69 -0.07 0.00 -0.03 0.00 0.00 56.01 55.40 1y9o n LEU 40 Cb 0.30 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.41 1y9o n LEU 40 CO 0.29 0.35 0.06 0.61 -1.33 0.00 0.00 177.39 177.37 1y9o n GLY 41 N 1.27 -0.41 3.45 -0.72 0.00 -0.41 -4.91 105.19 103.46 1y9o n GLY 41 Ca 0.16 0.21 -0.32 0.00 0.00 0.00 0.00 46.02 46.08 1y9o n GLY 41 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y9o s ILE 42 N -3.18 2.87 0.38 -0.61 -1.09 0.02 -4.96 121.20 114.63 1y9o s ILE 42 Ca 0.21 -0.92 0.07 0.00 -2.23 0.00 0.00 60.65 57.78 1y9o s ILE 42 Cb -0.03 -2.14 -0.01 0.00 -1.58 0.00 0.00 42.46 38.70 1y9o s ILE 42 CO 0.43 0.50 0.41 -0.54 -1.23 0.00 0.00 174.94 174.51 1y9o s LYS 43 N -0.96 2.76 0.00 2.79 1.02 -1.17 -4.43 119.74 119.74 1y9o s LYS 43 Ca 0.13 -1.31 0.00 0.00 0.02 0.00 0.00 55.97 54.81 1y9o s LYS 43 Cb -0.10 -2.56 0.00 0.00 -0.52 0.00 0.00 37.83 34.64 1y9o s LYS 43 CO 0.02 -0.07 0.00 0.41 -0.92 0.00 0.00 175.35 174.79 1y9o n GLY 44 N -1.57 0.08 3.64 -3.33 0.00 -0.26 -0.56 105.19 103.19 1y9o n GLY 44 Ca 0.02 -1.08 -0.08 0.00 0.00 0.00 0.00 46.02 44.88 1y9o n GLY 44 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1y9o s TYR 45 N -4.00 -0.37 -0.68 1.61 5.04 -1.22 -4.00 117.35 113.74 1y9o s TYR 45 Ca 0.00 0.89 -0.03 0.00 -2.44 0.00 0.00 57.07 55.49 1y9o s TYR 45 Cb 0.00 0.39 0.17 0.00 0.35 0.00 0.00 41.96 42.88 1y9o s TYR 45 CO 0.00 -0.18 0.51 0.00 -1.34 0.00 0.00 175.55 174.55 1y9o s ALA 46 N 0.18 3.71 -1.19 3.97 0.00 -0.29 -1.55 121.76 126.59 1y9o s ALA 46 Ca 0.04 -3.36 -0.11 0.00 0.00 0.00 0.00 51.96 48.53 1y9o s ALA 46 Cb -0.05 -2.75 0.21 0.00 0.00 0.00 0.00 23.12 20.53 1y9o s ALA 46 CO -0.09 -2.13 1.42 1.17 0.00 0.00 0.00 175.76 176.13 1y9o n LYS 47 N 3.34 3.53 -1.66 0.00 4.81 -0.56 -1.08 118.16 126.54 1y9o n LYS 47 Ca 0.10 -4.01 -0.39 0.00 -0.87 0.00 0.00 58.31 53.14 1y9o n LYS 47 Cb 0.38 -2.86 -0.04 0.00 0.02 0.00 0.00 35.03 32.53 1y9o n LYS 47 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1y9o n ASN 48 N 4.31 3.16 -4.68 3.14 2.85 -1.26 -3.69 115.26 119.08 1y9o n ASN 48 Ca 0.33 -2.74 -0.42 0.00 -0.11 0.00 0.00 54.58 51.64 1y9o n ASN 48 Cb 0.40 -1.44 -0.03 0.00 1.24 0.00 0.00 39.78 39.95 1y9o n ASN 48 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1y9o s LEU 49 N 4.46 4.41 -1.24 1.20 1.02 -1.26 -4.86 118.68 122.39 1y9o s LEU 49 Ca 0.59 2.74 -0.19 0.00 0.02 0.00 0.00 54.13 57.29 1y9o s LEU 49 Cb 0.09 -3.56 -0.00 0.00 0.02 0.00 0.00 46.19 42.74 1y9o s LEU 49 CO 0.09 -1.02 1.91 -0.81 0.02 0.00 0.00 176.35 176.54 1y9o n PRO 50 N 6.12 2.55 -0.97 1.29 -0.04 -1.26 -4.28 135.00 138.41 1y9o n PRO 50 Ca 0.18 -2.78 -0.01 0.00 -0.04 0.00 0.00 63.50 60.85 1y9o n PRO 50 Cb 0.39 -3.44 -0.02 0.00 -0.04 0.00 0.00 33.50 30.38 1y9o n PRO 50 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1y9o n ASP 51 N 9.24 -0.07 0.00 3.54 5.68 -1.26 -5.03 116.55 128.65 1y9o n ASP 51 Ca 0.49 -1.81 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 1y9o n ASP 51 Cb 0.44 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.41 1y9o n ASP 51 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1y9o n GLY 52 N 0.14 1.48 3.43 6.12 0.00 -1.26 -4.88 105.19 110.22 1y9o n GLY 52 Ca -0.08 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.47 1y9o n GLY 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y9o s SER 53 N 0.00 6.59 -0.19 1.61 1.04 -1.26 -2.75 113.70 118.74 1y9o s SER 53 Ca 0.00 -2.04 -0.16 0.00 0.48 0.00 0.00 55.95 54.24 1y9o s SER 53 Cb 0.00 -2.37 -0.04 0.00 0.10 0.00 0.00 66.02 63.71 1y9o s SER 53 CO 0.00 -1.02 0.39 0.54 0.98 0.00 0.00 173.24 174.13 1y9o s VAL 54 N 2.40 5.21 -0.02 5.02 0.11 -0.66 -4.69 120.40 127.77 1y9o s VAL 54 Ca 0.28 0.69 -0.11 0.00 -2.93 0.00 0.00 61.98 59.92 1y9o s VAL 54 Cb -0.08 -3.72 -0.05 0.00 -1.53 0.00 0.00 36.38 31.00 1y9o s VAL 54 CO -0.07 0.28 0.31 -1.83 -3.33 0.00 0.00 175.10 170.46 1y9o s GLU 55 N 1.15 3.71 -0.04 1.54 4.04 -1.24 -1.00 118.70 126.86 1y9o s GLU 55 Ca 0.19 0.15 0.06 0.00 0.04 0.00 0.00 54.97 55.41 1y9o s GLU 55 Cb -0.14 -3.16 -0.01 0.00 0.02 0.00 0.00 34.13 30.84 1y9o s GLU 55 CO 0.08 0.69 -0.21 0.08 -1.84 0.00 0.00 175.26 174.06 1y9o s VAL 56 N -1.15 1.67 -0.62 1.83 1.01 -0.10 -1.50 120.40 121.55 1y9o s VAL 56 Ca 0.23 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.39 1y9o s VAL 56 Cb -0.14 -1.41 0.33 0.00 0.00 0.00 0.00 36.38 35.15 1y9o s VAL 56 CO 0.12 0.47 0.99 1.33 0.00 0.00 0.00 175.10 178.02 1y9o n VAL 57 N 2.87 3.24 -1.64 2.92 0.24 -0.59 -0.91 118.33 124.45 1y9o n VAL 57 Ca -0.17 -5.58 -0.33 0.00 -2.04 0.00 0.00 64.34 56.22 1y9o n VAL 57 Cb 0.53 -1.48 0.06 0.00 -1.47 0.00 0.00 33.84 31.47 1y9o n VAL 57 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1y9o s ALA 58 N -3.44 2.43 -0.17 2.33 0.00 -1.12 -3.46 121.76 118.34 1y9o s ALA 58 Ca 0.47 0.48 -0.04 0.00 0.00 0.00 0.00 51.96 52.87 1y9o s ALA 58 Cb 0.26 -3.31 0.07 0.00 0.00 0.00 0.00 23.12 20.15 1y9o s ALA 58 CO -0.12 -1.38 0.17 -1.21 0.00 0.00 0.00 175.76 173.21 1y9o s GLU 59 N -4.29 0.12 0.08 0.00 2.02 0.28 -0.50 118.70 116.40 1y9o s GLU 59 Ca 0.65 0.19 0.02 0.00 0.02 0.00 0.00 54.97 55.86 1y9o s GLU 59 Cb -0.20 -1.19 -0.04 0.00 0.10 0.00 0.00 34.13 32.80 1y9o s GLU 59 CO 0.45 -0.58 -0.07 0.20 0.02 0.00 0.00 175.26 175.28 1y9o s GLY 60 N 2.26 0.67 0.00 -1.39 0.00 0.29 -3.07 107.32 106.08 1y9o s GLY 60 Ca 0.05 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.61 1y9o s GLY 60 CO -0.10 -1.25 0.00 -1.72 0.00 0.00 0.00 173.10 170.04 1y9o n TYR 61 N 0.44 0.00 0.00 1.90 4.02 -1.26 -0.81 117.16 121.45 1y9o n TYR 61 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 1y9o n TYR 61 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.91 1y9o n TYR 61 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1y9o n GLU 62 N 0.00 0.00 -0.04 -0.72 1.02 -1.26 -4.55 120.64 115.09 1y9o n GLU 62 Ca 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.06 1y9o n GLU 62 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.40 1y9o n GLU 62 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1y9o h GLU 63 N 0.00 -0.18 0.00 3.49 4.11 -1.98 0.11 114.58 120.12 1y9o h GLU 63 Ca 0.00 0.01 -0.07 0.00 0.07 0.00 0.00 59.36 59.38 1y9o h GLU 63 Cb 0.00 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1y9o h GLU 63 CO 0.00 -0.12 -0.31 0.00 0.07 0.00 0.00 179.01 178.65 1y9o h ALA 64 N 0.91 1.37 0.28 1.06 0.00 -1.91 -1.60 119.26 119.38 1y9o h ALA 64 Ca 0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1y9o h ALA 64 Cb 0.39 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1y9o h ALA 64 CO -0.34 0.39 -0.13 1.25 0.00 0.00 0.00 179.25 180.42 1y9o h LEU 65 N 0.00 -0.31 -0.92 0.00 5.85 -1.60 -2.49 115.31 115.84 1y9o h LEU 65 Ca -0.00 0.01 0.25 0.00 0.84 0.00 0.00 57.88 58.98 1y9o h LEU 65 Cb 0.59 0.08 -0.14 0.00 0.37 0.00 0.00 40.66 41.57 1y9o h LEU 65 CO 0.04 -0.18 0.39 0.77 -0.34 0.00 0.00 178.44 179.12 1y9o h SER 66 N -0.46 0.27 0.56 1.25 4.64 -0.77 0.15 113.55 119.18 1y9o h SER 66 Ca -0.04 0.18 -0.02 0.00 -0.47 0.00 0.00 61.79 61.44 1y9o h SER 66 Cb 0.28 0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 1y9o h SER 66 CO 0.06 -0.08 -0.37 0.11 -0.87 0.00 0.00 176.83 175.68 1y9o h LYS 67 N 0.32 -0.84 -0.69 4.77 6.56 -1.34 0.52 116.57 125.87 1y9o h LYS 67 Ca 0.60 0.06 0.07 0.00 -1.06 0.00 0.00 60.65 60.32 1y9o h LYS 67 Cb 1.22 0.19 -0.04 0.00 -0.57 0.00 0.00 32.23 33.03 1y9o h LYS 67 CO -0.59 -0.56 0.46 1.25 -2.06 0.00 0.00 179.45 177.94 1y9o h LEU 68 N -0.87 0.60 0.53 2.94 7.12 -0.79 -0.78 115.31 124.06 1y9o h LEU 68 Ca -0.07 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.91 1y9o h LEU 68 Cb 0.71 -0.12 0.01 0.00 -0.53 0.00 0.00 40.66 40.72 1y9o h LEU 68 CO 0.06 0.39 -0.25 -0.07 -0.13 0.00 0.00 178.44 178.43 1y9o h LEU 69 N 0.68 -0.60 -1.28 2.25 -0.00 -0.67 -3.09 115.31 112.60 1y9o h LEU 69 Ca 0.30 0.02 0.18 0.00 -0.00 0.00 0.00 57.88 58.39 1y9o h LEU 69 Cb 0.30 0.16 -0.08 0.00 -0.00 0.00 0.00 40.66 41.04 1y9o h LEU 69 CO -0.10 -0.35 0.60 -0.33 -0.00 0.00 0.00 178.44 178.26 1y9o h GLU 70 N -0.87 0.59 -0.16 1.13 5.08 -0.63 -0.17 114.58 119.56 1y9o h GLU 70 Ca -0.07 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1y9o h GLU 70 Cb 0.54 -0.13 -0.07 0.00 0.50 0.00 0.00 28.75 29.59 1y9o h GLU 70 CO 0.12 0.39 -0.54 -0.09 -1.00 0.00 0.00 179.01 177.89 1y9o h ARG 71 N 0.61 -0.55 0.73 2.33 9.65 -1.19 -2.71 114.38 123.25 1y9o h ARG 71 Ca 0.50 0.04 -0.04 0.00 -1.10 0.00 0.00 59.98 59.38 1y9o h ARG 71 Cb 0.96 0.12 0.01 0.00 -1.39 0.00 0.00 29.97 29.67 1y9o h ARG 71 CO -0.25 -0.36 -0.35 0.82 2.80 0.00 0.00 179.97 182.62 1y9o h ILE 72 N -0.57 0.00 -0.49 1.20 2.04 -0.93 -0.17 117.51 118.59 1y9o h ILE 72 Ca 0.04 -0.09 0.09 0.00 1.00 0.00 0.00 64.86 65.90 1y9o h ILE 72 Cb 0.67 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.68 1y9o h ILE 72 CO -0.45 0.00 0.01 0.07 0.00 0.00 0.00 178.15 177.78 1y9o h LYS 73 N -1.08 0.13 0.11 2.37 2.10 -1.69 -2.77 116.57 115.73 1y9o h LYS 73 Ca -0.10 -0.01 0.01 0.00 -2.00 0.00 0.00 60.65 58.55 1y9o h LYS 73 Cb 0.75 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 32.04 1y9o h LYS 73 CO 0.17 0.08 -0.11 0.37 -2.00 0.00 0.00 179.45 177.95 1y9o h GLN 74 N 0.13 -0.24 -3.55 0.07 -0.00 -1.37 -3.35 115.11 106.80 1y9o h GLN 74 Ca 0.25 0.02 -0.73 0.00 -0.00 0.00 0.00 58.65 58.18 1y9o h GLN 74 Cb 0.37 0.05 -0.32 0.00 0.00 0.00 0.00 27.48 27.58 1y9o h GLN 74 CO -0.40 -0.16 -0.09 0.20 0.00 0.00 0.00 178.83 178.38 1y9o s GLY 75 N -2.29 2.79 0.92 2.39 0.00 -0.09 -5.09 107.32 105.96 1y9o s GLY 75 Ca -0.14 -3.52 -0.11 0.00 0.00 0.00 0.00 44.72 40.95 1y9o s GLY 75 CO 0.66 1.19 1.09 2.56 0.00 0.00 0.00 173.10 178.60 1y9o s PRO 76 N -0.53 1.02 0.90 2.90 0.04 -1.17 -4.63 135.00 133.53 1y9o s PRO 76 Ca 0.22 1.05 -0.12 0.00 0.04 0.00 0.00 61.00 62.19 1y9o s PRO 76 Cb -0.13 -1.76 0.13 0.00 0.04 0.00 0.00 34.50 32.78 1y9o s PRO 76 CO -0.08 -2.47 1.09 -1.25 0.04 0.00 0.00 177.00 174.34 1y9o s PRO 77 N -4.79 1.20 -0.05 0.56 0.04 -1.26 -4.91 135.00 125.78 1y9o s PRO 77 Ca 0.65 0.80 -0.02 0.00 0.04 0.00 0.00 61.00 62.47 1y9o s PRO 77 Cb -0.20 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 1y9o s PRO 77 CO 0.58 -2.28 2.49 0.00 0.04 0.00 0.00 177.00 177.83 1y9o n ALA 78 N -3.91 4.88 -3.01 8.56 0.00 -1.26 -4.79 120.51 120.97 1y9o n ALA 78 Ca 0.07 -0.80 -0.09 0.00 0.00 0.00 0.00 53.44 52.62 1y9o n ALA 78 Cb 0.55 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.49 1y9o n ALA 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y9o s ALA 79 N 0.03 -0.19 -1.25 0.00 0.00 -1.26 -4.95 121.76 114.14 1y9o s ALA 79 Ca 0.24 -0.84 -0.20 0.00 0.00 0.00 0.00 51.96 51.17 1y9o s ALA 79 Cb 0.13 1.00 0.02 0.00 0.00 0.00 0.00 23.12 24.27 1y9o s ALA 79 CO -0.01 -0.77 1.80 -1.21 0.00 0.00 0.00 175.76 175.56 1y9o s GLU 80 N -3.99 3.47 0.00 0.00 8.01 -1.26 -4.88 118.70 120.05 1y9o s GLU 80 Ca 0.20 -1.68 -0.30 0.00 0.01 0.00 0.00 54.97 53.20 1y9o s GLU 80 Cb 0.01 -5.43 -0.08 0.00 -4.31 0.00 0.00 34.13 24.32 1y9o s GLU 80 CO 0.05 -2.84 1.86 0.54 0.01 0.00 0.00 175.26 174.88 1y9o s VAL 81 N 6.55 3.21 -0.19 2.63 0.11 -1.26 -1.41 120.40 130.04 1y9o s VAL 81 Ca 0.59 0.26 -0.23 0.00 -2.93 0.00 0.00 61.98 59.66 1y9o s VAL 81 Cb 0.02 -3.17 -0.21 0.00 -1.53 0.00 0.00 36.38 31.50 1y9o s VAL 81 CO 0.09 -0.02 0.34 -0.08 -3.33 0.00 0.00 175.10 172.10 1y9o h GLU 82 N 10.28 0.00 -0.11 1.54 4.57 -1.40 -3.46 114.58 125.99 1y9o h GLU 82 Ca -0.46 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 57.57 1y9o h GLU 82 Cb 1.22 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 29.67 1y9o h GLU 82 CO 0.95 1.00 -0.33 0.36 -1.18 0.00 0.00 179.01 179.80 1y9o n LYS 83 N -4.47 0.52 -1.84 1.92 2.85 -1.24 -4.99 118.16 110.90 1y9o n LYS 83 Ca -0.27 -1.39 -0.28 0.00 -1.05 0.00 0.00 58.31 55.32 1y9o n LYS 83 Cb 0.63 -1.00 -0.05 0.00 -0.65 0.00 0.00 35.03 33.97 1y9o n LYS 83 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1y9o s VAL 84 N 0.55 3.24 -0.88 0.58 0.11 -1.26 -4.28 120.40 118.46 1y9o s VAL 84 Ca 0.30 -0.07 -0.05 0.00 -2.93 0.00 0.00 61.98 59.22 1y9o s VAL 84 Cb 0.19 -3.57 0.22 0.00 -1.53 0.00 0.00 36.38 31.70 1y9o s VAL 84 CO -0.17 -0.54 0.79 -0.62 -3.33 0.00 0.00 175.10 171.23 1y9o s ASP 85 N 9.52 6.27 0.72 3.54 2.15 -0.86 -4.99 116.67 133.02 1y9o s ASP 85 Ca 0.80 -3.38 -0.11 0.00 0.43 0.00 0.00 52.55 50.29 1y9o s ASP 85 Cb -0.12 -2.01 0.03 0.00 -0.30 0.00 0.00 42.92 40.52 1y9o s ASP 85 CO 0.12 -0.30 1.08 -0.72 -0.17 0.00 0.00 175.17 175.18 1y9o s TYR 86 N -0.86 3.17 -0.17 -5.34 1.13 -1.26 -3.87 117.35 110.15 1y9o s TYR 86 Ca 0.25 1.16 -0.05 0.00 -1.41 0.00 0.00 57.07 57.02 1y9o s TYR 86 Cb -0.11 -3.02 0.06 0.00 -1.10 0.00 0.00 41.96 37.79 1y9o s TYR 86 CO -0.09 -1.32 0.08 -1.12 -2.51 0.00 0.00 175.55 170.58 1y9o s SER 87 N -4.11 2.42 0.05 -0.18 0.01 0.20 -4.93 113.70 107.16 1y9o s SER 87 Ca 0.59 -0.63 -0.30 0.00 1.31 0.00 0.00 55.95 56.91 1y9o s SER 87 Cb -0.13 -0.30 -0.09 0.00 0.21 0.00 0.00 66.02 65.71 1y9o s SER 87 CO 0.53 -0.34 1.96 0.12 0.41 0.00 0.00 173.24 175.92 1y9o s PHE 88 N 2.09 1.39 0.00 2.43 5.36 -1.26 -2.12 117.98 125.87 1y9o s PHE 88 Ca 0.02 -0.42 0.00 0.00 -0.96 0.00 0.00 56.93 55.57 1y9o s PHE 88 Cb -0.16 -4.25 0.00 0.00 -0.34 0.00 0.00 43.02 38.27 1y9o s PHE 88 CO -0.09 -5.52 0.00 0.43 -1.46 0.00 0.00 175.22 168.58 1y9o n SER 89 N 7.29 0.28 -4.16 6.13 7.64 -1.15 -4.95 113.62 124.70 1y9o n SER 89 Ca 0.20 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.95 1y9o n SER 89 Cb 0.41 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.50 1y9o n SER 89 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1y9o s GLU 90 N 1.77 0.80 -0.14 1.43 1.03 -1.25 -4.51 118.70 117.84 1y9o s GLU 90 Ca 0.00 -1.16 -0.28 0.00 0.03 0.00 0.00 54.97 53.56 1y9o s GLU 90 Cb 0.00 -0.41 -0.01 0.00 -0.80 0.00 0.00 34.13 32.91 1y9o s GLU 90 CO 0.00 0.05 0.96 1.52 -1.33 0.00 0.00 175.26 176.46 1y9o s TYR 91 N -2.64 3.46 -0.01 4.83 1.13 -1.26 -4.47 117.35 118.38 1y9o s TYR 91 Ca 0.05 1.48 -0.22 0.00 -1.41 0.00 0.00 57.07 56.97 1y9o s TYR 91 Cb -0.01 -3.15 -0.20 0.00 -1.10 0.00 0.00 41.96 37.49 1y9o s TYR 91 CO -0.01 -0.27 1.15 -0.22 -2.51 0.00 0.00 175.55 173.69 1y9o h LYS 92 N 7.21 0.26 -3.25 -3.49 1.63 -1.98 -3.48 116.57 113.47 1y9o h LYS 92 Ca -0.29 -0.21 -0.01 0.00 -0.85 0.00 0.00 60.65 59.28 1y9o h LYS 92 Cb 1.13 0.05 -0.10 0.00 -0.60 0.00 0.00 32.23 32.71 1y9o h LYS 92 CO 0.87 0.87 0.06 0.20 -3.45 0.00 0.00 179.45 178.00 1y9o s GLY 93 N -3.75 -0.15 -0.03 5.01 0.00 -1.26 -5.16 107.32 101.98 1y9o s GLY 93 Ca -0.15 -0.15 -0.20 0.00 0.00 0.00 0.00 44.72 44.22 1y9o s GLY 93 CO 0.75 -0.21 0.55 -1.83 0.00 0.00 0.00 173.10 172.37 1y9o s GLU 94 N -3.86 4.29 0.41 2.90 -1.05 -1.26 -5.03 118.70 115.09 1y9o s GLU 94 Ca 0.08 0.64 -0.24 0.00 -0.15 0.00 0.00 54.97 55.31 1y9o s GLU 94 Cb -0.01 -3.36 -0.09 0.00 -0.44 0.00 0.00 34.13 30.23 1y9o s GLU 94 CO -0.03 0.34 1.07 -0.06 0.95 0.00 0.00 175.26 177.52 1y9o s PHE 95 N -0.04 3.21 -1.00 4.83 0.40 -1.26 -4.96 117.98 119.16 1y9o s PHE 95 Ca 0.29 1.62 -0.24 0.00 -0.60 0.00 0.00 56.93 58.01 1y9o s PHE 95 Cb -0.17 -3.18 -0.04 0.00 0.51 0.00 0.00 43.02 40.14 1y9o s PHE 95 CO 0.15 -0.79 1.87 -1.83 0.70 0.00 0.00 175.22 175.33 1y9o s GLU 96 N -2.50 2.74 2.63 0.44 -1.05 -1.26 -4.51 118.70 115.19 1y9o s GLU 96 Ca 0.58 -0.68 0.00 0.00 -0.15 0.00 0.00 54.97 54.72 1y9o s GLU 96 Cb -0.23 -5.16 0.00 0.00 -0.44 0.00 0.00 34.13 28.29 1y9o s GLU 96 CO 0.29 -3.32 0.00 -0.25 0.95 0.00 0.00 175.26 172.94 1y9o n ASP 97 N 13.16 -2.13 -3.68 0.83 8.00 -1.26 -4.82 116.55 126.65 1y9o n ASP 97 Ca 0.41 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.66 1y9o n ASP 97 Cb 0.47 0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 41.40 1y9o n ASP 97 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1y9o s PHE 98 N 0.00 0.48 0.27 1.24 2.19 -1.26 -1.10 117.98 119.81 1y9o s PHE 98 Ca 0.00 -0.34 0.07 0.00 0.33 0.00 0.00 56.93 56.98 1y9o s PHE 98 Cb 0.00 -0.77 -0.06 0.00 -1.31 0.00 0.00 43.02 40.89 1y9o s PHE 98 CO 0.00 -0.45 -0.06 -2.00 1.83 0.00 0.00 175.22 174.54 1y9o s GLU 99 N 2.04 1.53 -0.02 10.12 2.12 -1.26 -4.92 118.70 128.32 1y9o s GLU 99 Ca 0.02 -1.77 0.02 0.00 0.36 0.00 0.00 54.97 53.60 1y9o s GLU 99 Cb -0.15 -1.13 -0.03 0.00 0.26 0.00 0.00 34.13 33.07 1y9o s GLU 99 CO -0.07 0.04 -0.03 0.95 -0.54 0.00 0.00 175.26 175.61 1y9o s THR 100 N -3.02 3.97 -1.56 -1.70 -4.23 -1.26 -1.14 115.64 106.70 1y9o s THR 100 Ca 0.29 -0.60 0.00 0.00 -1.18 0.00 0.00 61.69 60.20 1y9o s THR 100 Cb 0.04 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 71.15 1y9o s THR 100 CO 0.12 0.43 0.39 0.00 -0.54 0.00 0.00 174.62 175.02