#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ctk s SER 2 N 0.00 5.85 -0.29 1.61 0.15 -1.26 -4.99 113.70 114.78 2ctk s SER 2 Ca 0.00 -3.10 -0.06 0.00 0.70 0.00 0.00 55.95 53.50 2ctk s SER 2 Cb 0.00 -1.96 0.15 0.00 -1.71 0.00 0.00 66.02 62.50 2ctk s SER 2 CO 0.00 -0.36 0.60 -0.55 1.20 0.00 0.00 173.24 174.14 2ctk s SER 3 N 0.79 -1.13 -0.25 5.45 0.15 -1.26 -5.14 113.70 112.31 2ctk s SER 3 Ca 0.21 1.19 -0.12 0.00 0.70 0.00 0.00 55.95 57.93 2ctk s SER 3 Cb -0.14 2.14 -0.05 0.00 -1.71 0.00 0.00 66.02 66.26 2ctk s SER 3 CO -0.07 -0.24 0.21 -0.83 1.20 0.00 0.00 173.24 173.51 2ctk s GLY 4 N 2.85 1.96 -0.75 9.45 0.00 -1.26 -5.03 107.32 114.53 2ctk s GLY 4 Ca 0.06 -0.92 -0.25 0.00 0.00 0.00 0.00 44.72 43.61 2ctk s GLY 4 CO -0.19 0.58 1.22 -0.45 0.00 0.00 0.00 173.10 174.25 2ctk s SER 5 N 1.36 6.21 -0.13 1.64 0.15 -1.26 -4.95 113.70 116.71 2ctk s SER 5 Ca 0.09 -0.73 -0.04 0.00 0.70 0.00 0.00 55.95 55.97 2ctk s SER 5 Cb -0.15 -2.52 0.06 0.00 -1.71 0.00 0.00 66.02 61.70 2ctk s SER 5 CO 0.08 -1.69 0.11 -0.55 1.20 0.00 0.00 173.24 172.39 2ctk s SER 6 N 3.85 1.76 -0.09 5.45 0.15 -1.26 -5.14 113.70 118.42 2ctk s SER 6 Ca 0.33 -0.29 -0.15 0.00 0.70 0.00 0.00 55.95 56.54 2ctk s SER 6 Cb -0.09 -0.08 0.03 0.00 -1.71 0.00 0.00 66.02 64.17 2ctk s SER 6 CO 0.11 -0.31 0.38 -0.83 1.20 0.00 0.00 173.24 173.78 2ctk s GLY 7 N 2.19 -0.25 0.15 9.45 0.00 -1.26 -5.17 107.32 112.43 2ctk s GLY 7 Ca 0.03 0.81 0.11 0.00 0.00 0.00 0.00 44.72 45.67 2ctk s GLY 7 CO -0.08 0.62 -0.25 0.54 0.00 0.00 0.00 173.10 173.94 2ctk s LYS 8 N -0.48 1.42 -0.22 2.90 -0.14 -1.26 -5.14 119.74 116.82 2ctk s LYS 8 Ca -0.06 -1.41 -0.14 0.00 -1.36 0.00 0.00 55.97 53.00 2ctk s LYS 8 Cb -0.04 -1.81 0.06 0.00 -1.68 0.00 0.00 37.83 34.37 2ctk s LYS 8 CO 0.03 0.41 0.54 -1.83 -0.76 0.00 0.00 175.35 173.74 2ctk s GLU 9 N -2.32 0.57 -0.21 1.68 -1.05 -1.26 -5.14 118.70 110.97 2ctk s GLU 9 Ca 0.16 0.93 -0.04 0.00 -0.15 0.00 0.00 54.97 55.87 2ctk s GLU 9 Cb -0.09 0.13 0.10 0.00 -0.44 0.00 0.00 34.13 33.83 2ctk s GLU 9 CO 0.07 -0.13 0.24 0.00 0.95 0.00 0.00 175.26 176.39 2ctk s ALA 10 N 1.17 -0.34 -0.11 -0.84 0.00 -1.26 -5.14 121.76 115.25 2ctk s ALA 10 Ca -0.07 0.26 -0.07 0.00 0.00 0.00 0.00 51.96 52.08 2ctk s ALA 10 Cb -0.06 -1.38 0.04 0.00 0.00 0.00 0.00 23.12 21.72 2ctk s ALA 10 CO -0.11 -1.25 0.26 -1.17 0.00 0.00 0.00 175.76 173.49 2ctk s LEU 11 N 2.34 0.63 -0.14 0.00 2.96 -1.26 -5.14 118.68 118.07 2ctk s LEU 11 Ca 0.08 0.55 -0.00 0.00 -0.22 0.00 0.00 54.13 54.53 2ctk s LEU 11 Cb -0.16 0.84 0.03 0.00 0.50 0.00 0.00 46.19 47.40 2ctk s LEU 11 CO -0.14 -0.14 -0.08 -0.70 -1.32 0.00 0.00 176.35 173.97 2ctk s GLU 12 N 0.81 1.63 -0.09 1.98 2.56 -1.26 -5.11 118.70 119.22 2ctk s GLU 12 Ca -0.05 -0.39 -0.02 0.00 0.00 0.00 0.00 54.97 54.50 2ctk s GLU 12 Cb -0.07 -1.81 0.04 0.00 2.00 0.00 0.00 34.13 34.29 2ctk s GLU 12 CO -0.05 -0.31 0.05 0.00 -0.56 0.00 0.00 175.26 174.38 2ctk s ALA 13 N 1.64 0.48 -0.01 6.30 0.00 -1.26 -5.03 121.76 123.88 2ctk s ALA 13 Ca 0.04 -0.08 -0.24 0.00 0.00 0.00 0.00 51.96 51.67 2ctk s ALA 13 Cb -0.13 -0.79 -0.19 0.00 0.00 0.00 0.00 23.12 22.01 2ctk s ALA 13 CO -0.08 -0.68 1.28 -0.07 0.00 0.00 0.00 175.76 176.21 2ctk h LEU 14 N 8.38 0.10 -9.71 0.00 4.07 -2.04 -3.44 115.31 112.68 2ctk h LEU 14 Ca -0.15 -0.49 -0.52 0.00 0.08 0.00 0.00 57.88 56.80 2ctk h LEU 14 Cb 1.13 -0.03 0.02 0.00 1.08 0.00 0.00 40.66 42.86 2ctk h LEU 14 CO 0.23 0.58 0.56 0.54 -1.08 0.00 0.00 178.44 179.26 2ctk s VAL 15 N -4.23 3.44 0.64 1.22 0.11 -1.26 -4.95 120.40 115.37 2ctk s VAL 15 Ca -0.15 1.27 -0.11 0.00 -2.93 0.00 0.00 61.98 60.06 2ctk s VAL 15 Cb 0.02 -3.81 0.16 0.00 -1.53 0.00 0.00 36.38 31.22 2ctk s VAL 15 CO 0.70 0.23 0.57 -0.81 -3.33 0.00 0.00 175.10 172.45 2ctk n PRO 16 N 2.13 -2.12 -3.84 1.54 -0.04 -1.26 -4.87 135.00 126.54 2ctk n PRO 16 Ca 0.03 -0.91 -0.11 0.00 -0.04 0.00 0.00 63.50 62.48 2ctk n PRO 16 Cb 0.44 -0.85 -0.08 0.00 -0.04 0.00 0.00 33.50 32.97 2ctk n PRO 16 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2ctk s VAL 17 N -2.03 0.11 -0.21 0.52 -7.23 0.79 -4.85 120.40 107.50 2ctk s VAL 17 Ca 0.37 -0.87 -0.18 0.00 -1.81 0.00 0.00 61.98 59.49 2ctk s VAL 17 Cb -0.04 -0.90 -0.03 0.00 0.56 0.00 0.00 36.38 35.97 2ctk s VAL 17 CO 0.28 -0.48 0.52 -0.89 -0.31 0.00 0.00 175.10 174.22 2ctk s THR 18 N -2.53 5.10 0.40 5.32 2.01 -1.26 -1.93 115.64 122.76 2ctk s THR 18 Ca -0.05 0.94 0.08 0.00 0.31 0.00 0.00 61.69 62.96 2ctk s THR 18 Cb -0.01 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 2ctk s THR 18 CO -0.04 0.17 0.22 0.27 -0.69 0.00 0.00 174.62 174.55 2ctk s ILE 19 N 1.72 2.48 -0.14 1.82 -4.36 0.39 -4.93 121.20 118.19 2ctk s ILE 19 Ca 0.24 -1.61 0.02 0.00 -0.26 0.00 0.00 60.65 59.03 2ctk s ILE 19 Cb -0.15 -3.00 0.00 0.00 1.25 0.00 0.00 42.46 40.56 2ctk s ILE 19 CO 0.09 -0.02 -0.20 -1.61 0.24 0.00 0.00 174.94 173.44 2ctk s GLU 20 N -3.95 3.09 -0.07 0.37 2.02 -1.26 -1.94 118.70 116.96 2ctk s GLU 20 Ca 0.42 -0.82 0.03 0.00 0.02 0.00 0.00 54.97 54.62 2ctk s GLU 20 Cb 0.01 -2.47 -0.02 0.00 0.10 0.00 0.00 34.13 31.75 2ctk s GLU 20 CO 0.24 0.04 -0.14 0.08 0.02 0.00 0.00 175.26 175.49 2ctk s VAL 21 N 0.71 3.02 -0.53 2.63 1.01 0.93 -4.94 120.40 123.22 2ctk s VAL 21 Ca -0.09 -0.72 -0.27 0.00 0.00 0.00 0.00 61.98 60.89 2ctk s VAL 21 Cb -0.16 -2.20 0.03 0.00 0.00 0.00 0.00 36.38 34.05 2ctk s VAL 21 CO 0.01 0.57 1.10 -1.61 0.00 0.00 0.00 175.10 175.17 2ctk s GLU 22 N -0.46 3.54 -0.19 2.72 2.02 -1.26 -0.86 118.70 124.20 2ctk s GLU 22 Ca 0.06 0.24 -0.10 0.00 0.02 0.00 0.00 54.97 55.19 2ctk s GLU 22 Cb -0.12 -3.98 0.07 0.00 0.10 0.00 0.00 34.13 30.20 2ctk s GLU 22 CO 0.02 -1.51 0.46 0.08 0.02 0.00 0.00 175.26 174.33 2ctk s VAL 23 N 4.49 -0.19 0.26 2.63 1.01 0.52 -4.92 120.40 124.20 2ctk s VAL 23 Ca 0.41 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.19 2ctk s VAL 23 Cb -0.08 -0.69 -0.09 0.00 0.00 0.00 0.00 36.38 35.52 2ctk s VAL 23 CO 0.26 0.04 1.26 -2.16 0.00 0.00 0.00 175.10 174.51 2ctk s PRO 24 N 1.75 4.43 0.59 2.72 0.04 -1.26 -3.81 135.00 139.46 2ctk s PRO 24 Ca -0.08 2.05 0.36 0.00 0.04 0.00 0.00 61.00 63.37 2ctk s PRO 24 Cb -0.09 -3.16 1.97 0.00 0.04 0.00 0.00 34.50 33.26 2ctk s PRO 24 CO -0.14 -0.13 2.10 0.35 0.04 0.00 0.00 177.00 179.22 2ctk h PHE 25 N 4.41 0.00 0.00 0.56 3.04 -1.89 0.61 116.94 123.67 2ctk h PHE 25 Ca -0.46 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.49 2ctk h PHE 25 Cb 1.22 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.73 2ctk h PHE 25 CO 0.59 0.00 0.00 -0.44 -2.02 0.00 0.00 178.31 176.44 2ctk h ASP 26 N 0.00 0.00 0.00 0.41 3.32 -1.94 -2.81 116.42 115.40 2ctk h ASP 26 Ca 0.00 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.73 2ctk h ASP 26 Cb 0.16 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 2ctk h ASP 26 CO 0.00 0.00 -2.22 0.18 -1.72 0.00 0.00 179.24 175.48 2ctk n LEU 27 N -2.30 0.37 -0.38 1.55 4.77 0.20 -4.57 117.00 116.64 2ctk n LEU 27 Ca 0.01 -0.02 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 2ctk n LEU 27 Cb 0.19 0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 2ctk n LEU 27 CO 0.18 0.49 0.53 0.45 -1.33 0.00 0.00 177.39 177.71 2ctk h HIS 28 N 0.00 -1.50 -1.16 -1.77 3.86 -1.43 0.99 115.15 114.14 2ctk h HIS 28 Ca -0.48 0.11 0.37 0.00 -1.16 0.00 0.00 60.37 59.21 2ctk h HIS 28 Cb 2.05 0.78 -0.13 0.00 1.06 0.00 0.00 27.41 31.18 2ctk h HIS 28 CO 0.00 -0.39 0.72 0.07 0.86 0.00 0.00 177.93 179.19 2ctk h ARG 29 N -0.03 0.21 0.09 2.45 0.11 -1.81 0.73 114.38 116.13 2ctk h ARG 29 Ca 0.24 -0.01 -0.28 0.00 0.10 0.00 0.00 59.98 60.02 2ctk h ARG 29 Cb 0.51 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.53 2ctk h ARG 29 CO -0.93 0.14 -1.41 1.88 0.10 0.00 0.00 179.97 179.75 2ctk h TYR 30 N 0.21 0.35 0.49 4.08 0.05 0.53 -3.15 116.97 119.54 2ctk h TYR 30 Ca 0.75 -0.26 -0.02 0.00 0.05 0.00 0.00 58.73 59.25 2ctk h TYR 30 Cb 2.08 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 39.81 2ctk h TYR 30 CO -0.01 1.27 -0.23 0.28 -1.05 0.00 0.00 178.16 178.42 2ctk h VAL 31 N 0.05 0.34 0.36 -2.88 2.07 0.40 -3.33 116.25 113.26 2ctk h VAL 31 Ca -0.19 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.85 2ctk h VAL 31 Cb 1.97 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 2ctk h VAL 31 CO 0.16 0.06 -0.44 0.40 0.02 0.00 0.00 177.57 177.76 2ctk h ILE 32 N -1.01 0.00 0.00 4.57 2.04 -0.55 -3.24 117.51 119.32 2ctk h ILE 32 Ca -0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.79 2ctk h ILE 32 Cb 0.60 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2ctk h ILE 32 CO 0.11 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.87 2ctk n GLY 33 N -1.47 -2.73 0.16 5.37 0.00 -1.19 -3.30 105.19 102.02 2ctk n GLY 33 Ca -0.10 -2.18 -0.11 0.00 0.00 0.00 0.00 46.02 43.64 2ctk n GLY 33 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2ctk h GLN 34 N 2.61 0.34 -0.84 1.61 3.07 -1.93 -3.34 115.11 116.64 2ctk h GLN 34 Ca 0.00 -0.33 -0.43 0.00 0.09 0.00 0.00 58.65 57.98 2ctk h GLN 34 Cb 0.00 0.09 -0.41 0.00 0.08 0.00 0.00 27.48 27.23 2ctk h GLN 34 CO 0.00 1.01 -0.96 1.17 0.09 0.00 0.00 178.83 180.14 2ctk n LYS 35 N -3.76 2.58 -4.09 0.06 4.81 -1.26 -4.97 118.16 111.54 2ctk n LYS 35 Ca -0.05 -3.88 -0.33 0.00 -0.87 0.00 0.00 58.31 53.18 2ctk n LYS 35 Cb 0.78 -1.89 -0.07 0.00 0.02 0.00 0.00 35.03 33.86 2ctk n LYS 35 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ctk n GLY 36 N -0.52 -0.26 0.14 3.14 0.00 -1.24 -4.79 105.19 101.66 2ctk n GLY 36 Ca 0.26 0.09 -0.27 0.00 0.00 0.00 0.00 46.02 46.10 2ctk n GLY 36 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ctk n SER 37 N -2.14 1.96 -0.32 1.61 7.64 -1.21 -3.85 113.62 117.32 2ctk n SER 37 Ca -0.03 0.25 0.19 0.00 1.01 0.00 0.00 58.87 60.28 2ctk n SER 37 Cb 0.46 -0.75 0.39 0.00 -1.01 0.00 0.00 64.21 63.30 2ctk n SER 37 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2ctk h GLY 38 N -0.35 1.76 0.60 0.23 0.00 -1.78 -0.13 103.07 103.40 2ctk h GLY 38 Ca -0.65 -0.15 -0.08 0.00 0.00 0.00 0.00 47.33 46.45 2ctk h GLY 38 CO -0.33 -0.43 -0.29 -2.22 0.00 0.00 0.00 176.54 173.27 2ctk h ILE 39 N 0.29 1.47 -0.95 2.60 2.04 -1.65 -3.27 117.51 118.04 2ctk h ILE 39 Ca 0.65 -1.79 0.29 0.00 1.00 0.00 0.00 64.86 65.02 2ctk h ILE 39 Cb 1.41 2.49 -0.16 0.00 -0.74 0.00 0.00 36.82 39.82 2ctk h ILE 39 CO -0.62 0.50 0.31 0.03 0.00 0.00 0.00 178.15 178.37 2ctk h ARG 40 N -0.29 0.14 -0.80 2.37 3.08 -1.14 0.20 114.38 117.93 2ctk h ARG 40 Ca -0.03 -0.01 0.16 0.00 0.07 0.00 0.00 59.98 60.18 2ctk h ARG 40 Cb 0.98 -0.03 -0.15 0.00 0.08 0.00 0.00 29.97 30.84 2ctk h ARG 40 CO 0.06 0.09 -0.19 -0.22 -1.07 0.00 0.00 179.97 178.64 2ctk h LYS 41 N 0.15 0.00 0.59 0.04 3.64 -1.47 -0.32 116.57 119.19 2ctk h LYS 41 Ca 0.65 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 60.01 2ctk h LYS 41 Cb 1.46 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.29 2ctk h LYS 41 CO -0.73 0.00 -0.28 0.52 -2.27 0.00 0.00 179.45 176.69 2ctk h MET 42 N 0.00 -0.76 -1.96 1.90 2.86 -0.79 -0.38 114.93 115.80 2ctk h MET 42 Ca 0.39 0.05 0.57 0.00 -2.06 0.00 0.00 59.70 58.65 2ctk h MET 42 Cb 0.60 0.17 -0.08 0.00 0.06 0.00 0.00 31.60 32.35 2ctk h MET 42 CO -0.82 -0.51 1.41 -1.33 1.06 0.00 0.00 176.91 176.72 2ctk n MET 43 N -5.01 -0.00 0.00 1.72 2.81 -0.85 0.23 117.12 116.03 2ctk n MET 43 Ca -0.10 1.09 -0.14 0.00 -1.81 0.00 0.00 57.70 56.74 2ctk n MET 43 Cb 0.31 -2.50 -0.14 0.00 -0.71 0.00 0.00 33.22 30.18 2ctk n MET 43 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2ctk h ASP 44 N 0.00 0.20 -0.03 7.83 5.19 -0.95 0.03 116.42 128.68 2ctk h ASP 44 Ca 0.94 -0.39 -0.01 0.00 -0.62 0.00 0.00 57.03 56.94 2ctk h ASP 44 Cb 3.76 -0.06 -0.00 0.00 0.18 0.00 0.00 39.33 43.20 2ctk h ASP 44 CO -0.03 1.35 -0.04 1.05 -3.12 0.00 0.00 179.24 178.45 2ctk h GLU 45 N 0.03 0.08 -0.00 3.56 4.11 0.48 -3.24 114.58 119.60 2ctk h GLU 45 Ca -0.31 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.07 2ctk h GLU 45 Cb 2.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.27 2ctk h GLU 45 CO 0.10 0.56 -0.53 1.19 0.07 0.00 0.00 179.01 180.40 2ctk n PHE 46 N -4.78 0.00 -3.37 2.06 3.72 0.94 -4.97 117.46 111.07 2ctk n PHE 46 Ca -0.08 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.14 2ctk n PHE 46 Cb 0.28 -0.14 0.08 0.00 -0.94 0.00 0.00 39.48 38.76 2ctk n PHE 46 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2ctk n GLU 47 N -1.10 -6.47 -3.63 -1.08 1.02 -0.36 -4.91 120.64 104.11 2ctk n GLU 47 Ca 0.07 0.75 -0.18 0.00 -0.02 0.00 0.00 57.16 57.78 2ctk n GLU 47 Cb 0.35 -5.52 -0.05 0.00 -0.02 0.00 0.00 31.44 26.21 2ctk n GLU 47 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 2ctk n VAL 48 N -4.22 0.00 -3.86 2.62 0.24 -0.15 -4.95 118.33 108.02 2ctk n VAL 48 Ca -0.14 -1.55 -0.28 0.00 -2.04 0.00 0.00 64.34 60.32 2ctk n VAL 48 Cb 0.61 0.46 -0.16 0.00 -1.47 0.00 0.00 33.84 33.27 2ctk n VAL 48 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2ctk s ASN 49 N -2.70 3.03 -0.10 -1.34 -0.87 -0.74 -4.39 114.94 107.82 2ctk s ASN 49 Ca 0.08 -0.79 -0.14 0.00 -1.57 0.00 0.00 52.86 50.43 2ctk s ASN 49 Cb 0.00 -0.88 -0.05 0.00 -0.02 0.00 0.00 41.25 40.31 2ctk s ASN 49 CO 0.06 -0.23 0.34 -0.63 -2.57 0.00 0.00 177.10 174.07 2ctk s ILE 50 N 1.65 5.23 -0.10 0.60 1.01 -1.26 -0.22 121.20 128.11 2ctk s ILE 50 Ca -0.01 0.66 0.04 0.00 0.00 0.00 0.00 60.65 61.33 2ctk s ILE 50 Cb -0.16 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.65 2ctk s ILE 50 CO -0.07 0.46 -0.22 -1.00 0.00 0.00 0.00 174.94 174.11 2ctk s HIS 51 N -0.12 2.36 -0.09 3.97 3.76 0.15 -4.99 115.29 120.33 2ctk s HIS 51 Ca 0.20 -0.97 -0.01 0.00 -0.15 0.00 0.00 55.06 54.13 2ctk s HIS 51 Cb -0.14 -1.60 -0.03 0.00 1.11 0.00 0.00 32.58 31.92 2ctk s HIS 51 CO 0.08 -0.40 -0.05 0.08 -0.85 0.00 0.00 174.74 173.59 2ctk s VAL 52 N 0.42 3.86 0.30 -0.90 1.01 -1.26 -1.60 120.40 122.23 2ctk s VAL 52 Ca -0.18 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.10 2ctk s VAL 52 Cb -0.17 -2.61 -0.10 0.00 0.00 0.00 0.00 36.38 33.50 2ctk s VAL 52 CO 0.08 0.58 1.23 -2.16 0.00 0.00 0.00 175.10 174.83 2ctk s PRO 53 N -0.59 4.46 1.04 2.72 0.04 -1.26 -5.00 135.00 136.41 2ctk s PRO 53 Ca 0.09 2.05 -0.16 0.00 0.04 0.00 0.00 61.00 63.03 2ctk s PRO 53 Cb -0.12 -3.12 0.07 0.00 0.04 0.00 0.00 34.50 31.38 2ctk s PRO 53 CO 0.02 -0.04 0.19 0.00 0.04 0.00 0.00 177.00 177.21 2ctk n ALA 54 N 1.06 -3.44 0.13 8.56 0.00 -1.26 -4.83 120.51 120.73 2ctk n ALA 54 Ca -0.00 -0.98 -0.01 0.00 0.00 0.00 0.00 53.44 52.46 2ctk n ALA 54 Cb 0.43 -1.65 0.24 0.00 0.00 0.00 0.00 19.45 18.47 2ctk n ALA 54 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2ctk h PRO 55 N -1.84 0.10 -0.31 0.00 0.13 -1.99 -2.99 132.00 125.10 2ctk h PRO 55 Ca -0.49 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 64.53 2ctk h PRO 55 Cb 1.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 2ctk h PRO 55 CO 0.37 0.56 -0.05 1.05 -0.23 0.00 0.00 178.00 179.70 2ctk h GLU 56 N 0.08 0.50 0.00 0.86 4.11 -2.03 -2.07 114.58 116.04 2ctk h GLU 56 Ca 0.00 -0.12 -0.03 0.00 0.07 0.00 0.00 59.36 59.29 2ctk h GLU 56 Cb 0.88 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.06 2ctk h GLU 56 CO 0.07 0.57 -0.13 -0.07 0.07 0.00 0.00 179.01 179.51 2ctk h LEU 57 N 0.48 0.00 -2.45 3.06 3.38 -1.87 -3.47 115.31 114.44 2ctk h LEU 57 Ca 0.10 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.51 2ctk h LEU 57 Cb 0.39 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.98 2ctk h LEU 57 CO 0.02 0.13 -0.88 0.00 0.09 0.00 0.00 178.44 177.80 2ctk n GLN 58 N -3.18 -0.81 -3.77 1.13 10.64 -0.78 -4.90 117.38 115.71 2ctk n GLN 58 Ca 0.02 0.06 -0.32 0.00 -1.83 0.00 0.00 57.00 54.93 2ctk n GLN 58 Cb 0.49 -2.98 -0.05 0.00 -0.86 0.00 0.00 30.24 26.85 2ctk n GLN 58 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2ctk s SER 59 N -4.13 6.45 -0.21 2.61 0.15 -1.26 -4.97 113.70 112.34 2ctk s SER 59 Ca 0.09 0.49 0.15 0.00 0.70 0.00 0.00 55.95 57.38 2ctk s SER 59 Cb -0.05 -2.05 0.69 0.00 -1.71 0.00 0.00 66.02 62.90 2ctk s SER 59 CO 0.89 0.15 1.60 0.47 1.20 0.00 0.00 173.24 177.56 2ctk n ASP 60 N 0.49 4.86 -4.00 5.45 8.00 -1.26 -4.17 116.55 125.92 2ctk n ASP 60 Ca -0.06 -2.99 -0.31 0.00 0.71 0.00 0.00 54.79 52.13 2ctk n ASP 60 Cb 0.52 -0.62 -0.15 0.00 -0.02 0.00 0.00 41.12 40.84 2ctk n ASP 60 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2ctk s ILE 61 N -2.82 1.94 0.14 0.53 -1.09 -1.25 -0.36 121.20 118.30 2ctk s ILE 61 Ca 0.49 -1.67 -0.25 0.00 -2.23 0.00 0.00 60.65 56.99 2ctk s ILE 61 Cb 0.38 -2.20 -0.08 0.00 -1.58 0.00 0.00 42.46 38.99 2ctk s ILE 61 CO 0.12 -0.22 0.76 -0.63 -1.23 0.00 0.00 174.94 173.75 2ctk s ILE 62 N 1.17 4.44 -0.25 2.92 1.01 -0.04 -4.72 121.20 125.72 2ctk s ILE 62 Ca -0.03 1.66 -0.10 0.00 0.00 0.00 0.00 60.65 62.18 2ctk s ILE 62 Cb -0.19 -4.12 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 2ctk s ILE 62 CO -0.07 0.51 0.15 0.00 0.00 0.00 0.00 174.94 175.53 2ctk s ALA 63 N -1.01 3.49 -0.12 9.38 0.00 -0.63 -0.05 121.76 132.82 2ctk s ALA 63 Ca 0.36 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.34 2ctk s ALA 63 Cb -0.23 -2.31 -0.01 0.00 0.00 0.00 0.00 23.12 20.57 2ctk s ALA 63 CO 0.25 -0.35 -0.18 0.42 0.00 0.00 0.00 175.76 175.91 2ctk s ILE 64 N 1.36 2.60 -0.11 0.00 1.01 -0.82 0.31 121.20 125.56 2ctk s ILE 64 Ca 0.07 -0.82 -0.05 0.00 0.00 0.00 0.00 60.65 59.85 2ctk s ILE 64 Cb -0.15 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 2ctk s ILE 64 CO 0.07 0.54 0.07 -0.89 0.00 0.00 0.00 174.94 174.73 2ctk s THR 65 N 0.37 4.92 0.00 2.92 2.01 0.69 -0.46 115.64 126.10 2ctk s THR 65 Ca -0.14 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 61.85 2ctk s THR 65 Cb -0.17 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.22 2ctk s THR 65 CO 0.07 0.60 0.00 0.61 -0.69 0.00 0.00 174.62 175.20 2ctk n GLY 66 N 2.23 -0.55 3.74 4.40 0.00 -0.81 -1.79 105.19 112.41 2ctk n GLY 66 Ca -0.19 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.15 2ctk n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ctk s LEU 67 N 0.00 4.45 0.44 0.99 1.43 -1.26 -0.15 118.68 124.57 2ctk s LEU 67 Ca 0.00 2.37 0.37 0.00 -1.03 0.00 0.00 54.13 55.84 2ctk s LEU 67 Cb 0.00 -3.62 1.41 0.00 0.03 0.00 0.00 46.19 44.01 2ctk s LEU 67 CO 0.00 -0.43 1.33 0.00 0.23 0.00 0.00 176.35 177.49 2ctk n ALA 68 N 2.15 1.45 -0.01 4.21 0.00 -1.26 0.12 120.51 127.18 2ctk n ALA 68 Ca 0.04 0.63 -0.12 0.00 0.00 0.00 0.00 53.44 53.99 2ctk n ALA 68 Cb 0.43 -0.95 -0.10 0.00 0.00 0.00 0.00 19.45 18.84 2ctk n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ctk h ALA 69 N 1.04 -0.08 -0.46 0.00 0.00 -1.98 -3.11 119.26 114.67 2ctk h ALA 69 Ca 0.79 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 55.36 2ctk h ALA 69 Cb 2.93 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 20.73 2ctk h ALA 69 CO -0.16 -0.20 0.16 -0.91 0.00 0.00 0.00 179.25 178.15 2ctk h ASN 70 N -0.78 0.66 -0.99 0.00 4.21 0.53 -2.72 115.58 116.48 2ctk h ASN 70 Ca -0.01 -0.19 0.19 0.00 1.21 0.00 0.00 56.30 57.50 2ctk h ASN 70 Cb 0.63 -0.17 -0.10 0.00 -1.12 0.00 0.00 38.32 37.55 2ctk h ASN 70 CO 0.01 0.67 0.61 -0.07 -1.29 0.00 0.00 177.43 177.37 2ctk h LEU 71 N 0.61 0.74 0.14 1.61 3.38 -0.74 0.21 115.31 121.26 2ctk h LEU 71 Ca 0.15 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 2ctk h LEU 71 Cb 0.24 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2ctk h LEU 71 CO -0.01 0.27 -0.07 0.44 0.09 0.00 0.00 178.44 179.16 2ctk h ASP 72 N 0.72 -0.16 0.46 -0.43 5.19 -1.41 0.19 116.42 120.98 2ctk h ASP 72 Ca 0.56 -0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 56.86 2ctk h ASP 72 Cb 0.93 0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.48 2ctk h ASP 72 CO -0.35 -0.01 -0.22 0.03 -3.12 0.00 0.00 179.24 175.57 2ctk h ARG 73 N -0.30 -0.59 0.00 3.56 3.08 -1.15 -1.61 114.38 117.38 2ctk h ARG 73 Ca -0.02 0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.10 2ctk h ARG 73 Cb 0.24 0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.38 2ctk h ARG 73 CO 0.03 -0.31 -0.24 0.00 -1.07 0.00 0.00 179.97 178.38 2ctk h ALA 74 N -0.33 -0.33 -1.00 0.04 0.00 -0.68 -1.66 119.26 115.30 2ctk h ALA 74 Ca -0.06 -0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.00 2ctk h ALA 74 Cb 0.55 0.43 -0.10 0.00 0.00 0.00 0.00 17.79 18.67 2ctk h ALA 74 CO 0.10 -0.74 0.62 -0.22 0.00 0.00 0.00 179.25 179.01 2ctk h LYS 75 N -0.38 0.85 -0.89 0.00 3.64 -0.63 -0.15 116.57 119.01 2ctk h LYS 75 Ca 0.06 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2ctk h LYS 75 Cb 0.46 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 2ctk h LYS 75 CO -0.21 0.56 0.55 0.00 -2.27 0.00 0.00 179.45 178.08 2ctk h ALA 76 N 1.59 1.13 -0.10 5.00 0.00 -0.39 -1.51 119.26 124.97 2ctk h ALA 76 Ca 0.54 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.36 2ctk h ALA 76 Cb 0.70 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2ctk h ALA 76 CO -0.33 0.57 0.05 0.78 0.00 0.00 0.00 179.25 180.32 2ctk h GLY 77 N 1.22 0.16 0.98 0.00 0.00 -0.33 -2.45 103.07 102.64 2ctk h GLY 77 Ca 0.32 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2ctk h GLY 77 CO -0.06 0.08 0.06 -2.00 0.00 0.00 0.00 176.54 174.61 2ctk h LEU 78 N 0.03 0.11 -0.51 3.11 5.85 -1.26 -0.50 115.31 122.13 2ctk h LEU 78 Ca 0.03 -0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.83 2ctk h LEU 78 Cb 0.14 -0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.05 2ctk h LEU 78 CO -0.00 0.10 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.04 2ctk h LEU 79 N 0.10 -0.40 -0.95 2.25 3.38 -1.23 0.26 115.31 118.73 2ctk h LEU 79 Ca 0.03 0.15 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 2ctk h LEU 79 Cb 0.02 0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2ctk h LEU 79 CO -0.01 -0.14 -0.15 -0.33 0.09 0.00 0.00 178.44 177.90 2ctk h GLU 80 N 0.03 0.60 -0.16 1.13 5.08 -1.22 -2.23 114.58 117.82 2ctk h GLU 80 Ca 0.25 -0.19 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 2ctk h GLU 80 Cb 0.39 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2ctk h GLU 80 CO -0.50 0.73 -0.29 -0.09 -1.00 0.00 0.00 179.01 177.86 2ctk h ARG 81 N 0.54 0.30 -0.07 2.33 9.65 0.70 -1.48 114.38 126.36 2ctk h ARG 81 Ca 0.09 -0.11 -0.20 0.00 -1.10 0.00 0.00 59.98 58.66 2ctk h ARG 81 Cb 0.57 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 29.13 2ctk h ARG 81 CO 0.04 0.57 -0.80 0.28 2.80 0.00 0.00 179.97 182.86 2ctk h VAL 82 N 0.27 1.37 -0.10 0.20 2.07 -0.23 0.84 116.25 120.66 2ctk h VAL 82 Ca 0.04 -2.21 -0.16 0.00 0.82 0.00 0.00 66.70 65.19 2ctk h VAL 82 Cb 0.66 2.18 -0.01 0.00 -1.52 0.00 0.00 31.29 32.60 2ctk h VAL 82 CO 0.05 0.67 -0.64 0.11 0.02 0.00 0.00 177.57 177.77 2ctk h LYS 83 N 0.30 0.38 0.00 1.57 1.57 -1.20 -2.49 116.57 116.70 2ctk h LYS 83 Ca -0.05 -0.27 -0.18 0.00 -1.87 0.00 0.00 60.65 58.28 2ctk h LYS 83 Cb 1.40 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.73 2ctk h LYS 83 CO 0.14 0.89 -1.08 0.93 -0.57 0.00 0.00 179.45 179.76 2ctk h GLU 84 N 0.27 0.00 0.41 3.15 5.08 -1.27 -2.96 114.58 119.26 2ctk h GLU 84 Ca -0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2ctk h GLU 84 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2ctk h GLU 84 CO 0.11 0.58 -0.20 -0.07 -1.00 0.00 0.00 179.01 178.43 2ctk h LEU 85 N 0.00 -0.47 -0.44 1.33 3.38 -0.79 -3.17 115.31 115.16 2ctk h LEU 85 Ca -0.09 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2ctk h LEU 85 Cb 1.65 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.50 2ctk h LEU 85 CO 0.08 -0.04 0.24 0.06 0.09 0.00 0.00 178.44 178.86 2ctk h GLN 86 N -1.02 0.61 -0.95 1.13 3.07 -1.61 -2.09 115.11 114.25 2ctk h GLN 86 Ca -0.06 -0.07 0.28 0.00 0.09 0.00 0.00 58.65 58.89 2ctk h GLN 86 Cb 0.54 -0.12 -0.04 0.00 0.08 0.00 0.00 27.48 27.94 2ctk h GLN 86 CO 0.09 0.49 0.83 0.00 0.09 0.00 0.00 178.83 180.34 2ctk h ALA 87 N 1.09 2.81 -0.85 0.06 0.00 -1.61 0.30 119.26 121.06 2ctk h ALA 87 Ca 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2ctk h ALA 87 Cb 0.06 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ctk h ALA 87 CO -0.02 -1.32 0.00 0.39 0.00 0.00 0.00 179.25 178.29 2ctk n GLU 88 N -3.81 0.00 0.05 0.00 -0.58 -0.81 -1.63 120.64 113.86 2ctk n GLU 88 Ca 0.20 0.28 0.19 0.00 -0.42 0.00 0.00 57.16 57.41 2ctk n GLU 88 Cb 1.15 -0.74 0.53 0.00 -0.57 0.00 0.00 31.44 31.81 2ctk n GLU 88 CO 0.00 0.00 0.00 -0.56 -0.48 0.00 0.00 177.13 176.09 2ctk h GLN 89 N 0.00 0.00 0.04 3.49 3.07 -1.27 0.92 115.11 121.36 2ctk h GLN 89 Ca 0.00 0.00 -0.32 0.00 0.09 0.00 0.00 58.65 58.42 2ctk h GLN 89 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.52 2ctk h GLN 89 CO 0.00 0.00 -1.88 0.39 0.09 0.00 0.00 178.83 177.43 2ctk n GLU 90 N -3.22 0.68 -0.39 0.06 -0.58 0.10 -4.16 120.64 113.13 2ctk n GLU 90 Ca 0.11 0.26 0.31 0.00 -0.42 0.00 0.00 57.16 57.42 2ctk n GLU 90 Cb 0.98 -1.74 0.58 0.00 -0.57 0.00 0.00 31.44 30.69 2ctk n GLU 90 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2ctk h ASP 91 N 0.02 0.35 0.63 1.62 3.58 0.19 0.20 116.42 123.00 2ctk h ASP 91 Ca -0.36 0.15 -0.03 0.00 0.42 0.00 0.00 57.03 57.21 2ctk h ASP 91 Cb 2.04 0.12 0.01 0.00 1.72 0.00 0.00 39.33 43.22 2ctk h ASP 91 CO 0.07 -0.15 -0.30 0.03 -2.88 0.00 0.00 179.24 176.01 2ctk h ARG 92 N 0.18 -0.82 -0.18 0.28 3.08 -1.71 -1.91 114.38 113.30 2ctk h ARG 92 Ca 0.77 0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.92 2ctk h ARG 92 Cb 2.16 0.19 -0.01 0.00 0.08 0.00 0.00 29.97 32.39 2ctk h ARG 92 CO -0.48 -0.52 0.33 0.00 -1.07 0.00 0.00 179.97 178.23 2ctk h ALA 93 N -1.12 1.68 0.01 0.04 0.00 -1.24 -0.10 119.26 118.53 2ctk h ALA 93 Ca -0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2ctk h ALA 93 Cb 0.67 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2ctk h ALA 93 CO 0.14 -0.42 -0.00 1.25 0.00 0.00 0.00 179.25 180.22 2ctk h LEU 94 N 0.00 -0.01 -1.59 0.00 6.46 -0.87 -3.29 115.31 116.01 2ctk h LEU 94 Ca 0.08 -0.80 -0.05 0.00 -0.12 0.00 0.00 57.88 57.00 2ctk h LEU 94 Cb 0.75 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 2ctk h LEU 94 CO -0.00 0.82 -0.22 0.08 -0.62 0.00 0.00 178.44 178.50 2ctk h ARG 95 N -0.87 0.00 -4.73 1.25 0.11 -0.44 -3.39 114.38 106.32 2ctk h ARG 95 Ca -0.00 0.00 -0.70 0.00 0.10 0.00 0.00 59.98 59.37 2ctk h ARG 95 Cb 0.81 0.00 -0.20 0.00 1.11 0.00 0.00 29.97 31.70 2ctk h ARG 95 CO 0.00 0.22 -0.26 -1.54 0.10 0.00 0.00 179.97 178.49 2ctk s SER 96 N -6.54 6.17 0.22 0.08 1.04 -0.16 -5.04 113.70 109.47 2ctk s SER 96 Ca -0.03 -0.81 -0.03 0.00 0.48 0.00 0.00 55.95 55.57 2ctk s SER 96 Cb 0.14 -2.21 -0.03 0.00 0.10 0.00 0.00 66.02 64.02 2ctk s SER 96 CO 0.65 -0.58 0.20 0.72 0.98 0.00 0.00 173.24 175.22 2ctk s PHE 97 N 2.01 1.06 0.30 5.02 -0.12 -1.26 -4.75 117.98 120.23 2ctk s PHE 97 Ca 0.10 -1.28 -0.28 0.00 -0.05 0.00 0.00 56.93 55.41 2ctk s PHE 97 Cb -0.18 -0.43 -0.13 0.00 -0.63 0.00 0.00 43.02 41.64 2ctk s PHE 97 CO 0.12 -0.72 1.14 1.17 -0.05 0.00 0.00 175.22 176.87 2ctk n LYS 98 N -0.31 1.67 -1.70 1.99 4.81 -1.26 -4.74 118.16 118.61 2ctk n LYS 98 Ca 0.02 0.59 -0.66 0.00 -0.87 0.00 0.00 58.31 57.38 2ctk n LYS 98 Cb 0.65 -2.05 -0.10 0.00 0.02 0.00 0.00 35.03 33.55 2ctk n LYS 98 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2ctk n SER 99 N 1.12 1.04 -4.06 3.14 2.88 -1.26 -4.88 113.62 111.60 2ctk n SER 99 Ca 0.08 1.18 -0.34 0.00 -1.33 0.00 0.00 58.87 58.46 2ctk n SER 99 Cb 0.33 -0.90 -0.09 0.00 -0.75 0.00 0.00 64.21 62.81 2ctk n SER 99 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ctk s GLY 100 N 2.47 2.89 0.00 0.46 0.00 -1.26 -4.89 107.32 106.99 2ctk s GLY 100 Ca 1.02 -3.68 0.13 0.00 0.00 0.00 0.00 44.72 42.19 2ctk s GLY 100 CO 0.77 1.14 1.21 -1.55 0.00 0.00 0.00 173.10 174.66 2ctk n PRO 101 N 2.56 0.49 -0.83 2.90 -0.04 -1.26 -4.81 135.00 134.01 2ctk n PRO 101 Ca 0.17 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.34 2ctk n PRO 101 Cb 0.37 -1.42 0.23 0.00 -0.04 0.00 0.00 33.50 32.64 2ctk n PRO 101 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2ctk s SER 102 N -1.92 1.25 0.44 3.54 1.04 -1.26 -4.97 113.70 111.82 2ctk s SER 102 Ca 0.20 1.16 -0.24 0.00 0.48 0.00 0.00 55.95 57.54 2ctk s SER 102 Cb 0.09 -1.78 -0.08 0.00 0.10 0.00 0.00 66.02 64.35 2ctk s SER 102 CO 0.15 -3.98 1.20 -0.44 0.98 0.00 0.00 173.24 171.15 2ctk s SER 103 N -3.14 6.24 0.00 7.02 0.01 -1.26 -5.28 113.70 117.28 2ctk s SER 103 Ca 0.68 2.41 0.00 0.00 1.31 0.00 0.00 55.95 60.35 2ctk s SER 103 Cb -0.19 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.42 2ctk s SER 103 CO 0.60 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.98