#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgk n SER 2 N 0.00 2.89 0.03 1.61 2.88 -1.26 -4.90 113.62 114.87 1wgk n SER 2 Ca 0.00 1.20 0.00 0.00 -1.33 0.00 0.00 58.87 58.74 1wgk n SER 2 Cb 0.00 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 61.97 1wgk n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1wgk n SER 3 N 0.95 0.13 0.00 -3.46 7.64 -1.26 -5.14 113.62 112.47 1wgk n SER 3 Ca 0.05 0.11 0.00 0.00 1.01 0.00 0.00 58.87 60.04 1wgk n SER 3 Cb 0.36 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 1wgk n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgk n GLY 4 N 2.24 5.25 0.96 0.23 0.00 -1.26 -5.12 105.19 107.48 1wgk n GLY 4 Ca 0.00 -1.51 -0.01 0.00 0.00 0.00 0.00 46.02 44.50 1wgk n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wgk n SER 5 N 0.00 1.18 -4.69 1.61 7.64 -1.26 -5.04 113.62 113.07 1wgk n SER 5 Ca 0.00 0.16 -0.44 0.00 1.01 0.00 0.00 58.87 59.59 1wgk n SER 5 Cb 0.00 -0.37 -0.03 0.00 -1.01 0.00 0.00 64.21 62.80 1wgk n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wgk n SER 6 N -3.57 3.03 0.00 6.43 2.88 -1.26 -4.83 113.62 116.30 1wgk n SER 6 Ca -0.01 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 1wgk n SER 6 Cb 0.05 -1.47 0.00 0.00 -0.75 0.00 0.00 64.21 62.04 1wgk n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wgk n GLY 7 N 2.28 3.55 3.74 0.46 0.00 -1.26 -5.07 105.19 108.89 1wgk n GLY 7 Ca 0.11 -1.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 1wgk n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1wgk n MET 8 N -1.13 2.23 -3.22 1.61 -0.00 -1.26 -4.75 117.12 110.59 1wgk n MET 8 Ca 0.00 0.79 -0.19 0.00 -0.00 0.00 0.00 57.70 58.30 1wgk n MET 8 Cb 0.00 -2.51 -0.00 0.00 -0.00 0.00 0.00 33.22 30.71 1wgk n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1wgk s ALA 9 N -1.16 4.37 0.19 3.17 0.00 -1.26 -5.01 121.76 122.06 1wgk s ALA 9 Ca 0.58 -1.77 0.04 0.00 0.00 0.00 0.00 51.96 50.81 1wgk s ALA 9 Cb -0.49 -1.38 -0.03 0.00 0.00 0.00 0.00 23.12 21.21 1wgk s ALA 9 CO 0.60 -0.30 0.31 0.00 0.00 0.00 0.00 175.76 176.37 1wgk s ALA 10 N -2.42 3.93 0.05 0.00 0.00 -1.26 -4.43 121.76 117.63 1wgk s ALA 10 Ca 0.53 -1.12 -0.31 0.00 0.00 0.00 0.00 51.96 51.06 1wgk s ALA 10 Cb -0.07 -1.74 -0.07 0.00 0.00 0.00 0.00 23.12 21.25 1wgk s ALA 10 CO 0.31 0.42 1.41 -1.25 0.00 0.00 0.00 175.76 176.65 1wgk s PRO 11 N -3.52 4.29 0.10 0.00 0.04 -1.26 -4.17 135.00 130.47 1wgk s PRO 11 Ca 0.34 2.03 -0.01 0.00 0.04 0.00 0.00 61.00 63.40 1wgk s PRO 11 Cb -0.10 -3.46 -0.04 0.00 0.04 0.00 0.00 34.50 30.94 1wgk s PRO 11 CO 0.28 -0.53 0.28 -0.48 0.04 0.00 0.00 177.00 176.59 1wgk s LEU 12 N 1.93 4.32 0.05 -3.56 0.05 -0.14 -4.90 118.68 116.43 1wgk s LEU 12 Ca 0.65 0.38 0.09 0.00 0.05 0.00 0.00 54.13 55.29 1wgk s LEU 12 Cb -0.34 -3.08 -0.03 0.00 -2.05 0.00 0.00 46.19 40.69 1wgk s LEU 12 CO 0.28 0.12 -0.23 0.00 -0.55 0.00 0.00 176.35 175.97 1wgk s VAL 14 N -0.89 -0.01 -0.37 0.00 -7.23 0.87 -0.28 120.40 112.48 1wgk s VAL 14 Ca 0.13 0.03 -0.20 0.00 -1.81 0.00 0.00 61.98 60.14 1wgk s VAL 14 Cb -0.10 -0.10 0.01 0.00 0.56 0.00 0.00 36.38 36.74 1wgk s VAL 14 CO 0.04 0.01 0.60 -0.54 -0.31 0.00 0.00 175.10 174.91 1wgk s LYS 15 N 0.21 3.56 0.04 4.82 1.02 0.51 -0.90 119.74 129.01 1wgk s LYS 15 Ca -0.02 -0.11 -0.02 0.00 0.02 0.00 0.00 55.97 55.84 1wgk s LYS 15 Cb -0.02 -3.84 -0.04 0.00 -0.52 0.00 0.00 37.83 33.40 1wgk s LYS 15 CO -0.01 -0.78 0.22 0.08 -0.92 0.00 0.00 175.35 173.95 1wgk s VAL 16 N 2.64 5.38 -0.07 3.17 1.01 -0.39 -0.30 120.40 131.83 1wgk s VAL 16 Ca 0.22 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.94 1wgk s VAL 16 Cb -0.15 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.68 1wgk s VAL 16 CO 0.15 0.20 0.15 -0.70 0.00 0.00 0.00 175.10 174.91 1wgk s GLU 17 N -2.29 0.05 -0.09 2.72 2.12 -0.15 -0.32 118.70 120.74 1wgk s GLU 17 Ca 0.33 0.47 0.00 0.00 0.36 0.00 0.00 54.97 56.13 1wgk s GLU 17 Cb -0.13 -0.24 -0.03 0.00 0.26 0.00 0.00 34.13 33.99 1wgk s GLU 17 CO 0.24 -0.25 -0.08 -0.06 -0.54 0.00 0.00 175.26 174.57 1wgk s PHE 18 N 1.80 2.91 -0.02 5.30 0.40 -1.09 -1.20 117.98 126.09 1wgk s PHE 18 Ca -0.02 -0.11 -0.01 0.00 -0.60 0.00 0.00 56.93 56.19 1wgk s PHE 18 Cb -0.12 -1.75 0.02 0.00 0.51 0.00 0.00 43.02 41.68 1wgk s PHE 18 CO -0.06 0.21 0.04 0.20 0.70 0.00 0.00 175.22 176.32 1wgk s GLY 19 N -0.51 0.03 0.00 4.36 0.00 -0.90 -4.45 107.32 105.84 1wgk s GLY 19 Ca 0.08 0.25 0.00 0.00 0.00 0.00 0.00 44.72 45.04 1wgk s GLY 19 CO 0.02 0.44 0.00 0.61 0.00 0.00 0.00 173.10 174.17 1wgk n GLY 20 N 3.67 1.93 1.00 0.20 0.00 -1.26 -3.16 105.19 107.57 1wgk n GLY 20 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1wgk n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgk n GLY 21 N -0.35 2.96 0.40 -0.02 0.00 -1.26 -3.49 105.19 103.42 1wgk n GLY 21 Ca 0.00 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.23 1wgk n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgk h ALA 22 N 0.00 2.52 -1.08 4.61 0.00 -1.90 -0.96 119.26 122.45 1wgk h ALA 22 Ca 0.00 -0.02 0.29 0.00 0.00 0.00 0.00 54.91 55.18 1wgk h ALA 22 Cb 0.00 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.72 1wgk h ALA 22 CO 0.00 -0.70 0.69 1.05 0.00 0.00 0.00 179.25 180.30 1wgk h GLU 23 N 0.05 0.34 -0.66 0.00 4.11 -1.83 0.52 114.58 117.11 1wgk h GLU 23 Ca 0.30 -0.02 0.02 0.00 0.07 0.00 0.00 59.36 59.72 1wgk h GLU 23 Cb 1.12 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 1wgk h GLU 23 CO -0.02 0.22 0.43 -0.07 0.07 0.00 0.00 179.01 179.65 1wgk h LEU 24 N 0.35 0.72 0.00 3.06 3.38 -1.48 0.69 115.31 122.04 1wgk h LEU 24 Ca 0.63 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.59 1wgk h LEU 24 Cb 1.66 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1wgk h LEU 24 CO -0.32 0.52 0.00 0.18 0.09 0.00 0.00 178.44 178.90 1wgk n LEU 25 N -4.45 0.00 -3.63 1.67 4.77 0.18 -3.23 117.00 112.32 1wgk n LEU 25 Ca 0.07 0.44 -0.29 0.00 -0.03 0.00 0.00 56.01 56.20 1wgk n LEU 25 Cb 0.07 -0.44 -0.12 0.00 -2.33 0.00 0.00 43.42 40.61 1wgk n LEU 25 CO 0.35 -0.31 -0.24 -0.36 -1.33 0.00 0.00 177.39 175.50 1wgk s PHE 26 N -2.87 1.81 -0.11 -1.77 0.40 0.12 -3.48 117.98 112.08 1wgk s PHE 26 Ca 0.05 -2.40 0.00 0.00 -0.60 0.00 0.00 56.93 53.98 1wgk s PHE 26 Cb 0.06 -1.65 0.00 0.00 0.51 0.00 0.00 43.02 41.94 1wgk s PHE 26 CO 0.14 -0.77 0.00 -3.47 0.70 0.00 0.00 175.22 171.83 1wgk n ASP 27 N 3.27 -0.89 -3.75 1.36 -0.08 -1.25 -2.15 116.55 113.06 1wgk n ASP 27 Ca 0.15 0.29 -0.26 0.00 -1.51 0.00 0.00 54.79 53.46 1wgk n ASP 27 Cb 0.38 -1.03 0.00 0.00 2.34 0.00 0.00 41.12 42.81 1wgk n ASP 27 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1wgk n GLY 28 N -0.32 -1.15 3.11 0.27 0.00 -0.51 -4.98 105.19 101.61 1wgk n GLY 28 Ca -0.01 0.67 -0.09 0.00 0.00 0.00 0.00 46.02 46.58 1wgk n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wgk s VAL 29 N -2.82 0.13 -0.07 1.61 1.01 -0.91 -4.88 120.40 114.47 1wgk s VAL 29 Ca 0.04 -1.07 -0.02 0.00 0.00 0.00 0.00 61.98 60.93 1wgk s VAL 29 Cb -0.00 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 1wgk s VAL 29 CO 0.89 -0.59 0.12 0.11 0.00 0.00 0.00 175.10 175.63 1wgk h LYS 30 N 3.72 -0.08 -5.50 2.72 6.56 -1.91 -3.43 116.57 118.65 1wgk h LYS 30 Ca -0.32 0.01 -0.64 0.00 -1.06 0.00 0.00 60.65 58.63 1wgk h LYS 30 Cb 1.19 0.02 -0.12 0.00 -0.57 0.00 0.00 32.23 32.74 1wgk h LYS 30 CO 0.50 -0.06 -0.53 0.15 -2.06 0.00 0.00 179.45 177.45 1wgk s LYS 31 N -1.74 3.69 -0.15 3.15 1.02 -1.26 -2.66 119.74 121.79 1wgk s LYS 31 Ca -0.01 -0.27 -0.01 0.00 0.02 0.00 0.00 55.97 55.71 1wgk s LYS 31 Cb 0.00 -3.17 0.04 0.00 -0.52 0.00 0.00 37.83 34.17 1wgk s LYS 31 CO 0.04 0.50 -0.05 -1.01 -0.92 0.00 0.00 175.35 173.91 1wgk s HIS 32 N -0.27 1.58 -0.13 3.18 3.76 0.56 -4.99 115.29 118.98 1wgk s HIS 32 Ca 0.09 -0.95 -0.29 0.00 -0.15 0.00 0.00 55.06 53.76 1wgk s HIS 32 Cb -0.12 -1.26 -0.01 0.00 1.11 0.00 0.00 32.58 32.30 1wgk s HIS 32 CO 0.01 -0.58 1.13 -1.14 -0.85 0.00 0.00 174.74 173.31 1wgk s GLN 33 N 1.67 4.32 0.04 1.40 2.00 -1.26 -1.26 119.66 126.57 1wgk s GLN 33 Ca 0.02 1.53 0.07 0.00 -2.00 0.00 0.00 55.36 54.97 1wgk s GLN 33 Cb -0.14 -3.62 -0.03 0.00 0.80 0.00 0.00 33.01 30.01 1wgk s GLN 33 CO -0.08 -0.52 -0.17 0.08 -0.50 0.00 0.00 175.29 174.11 1wgk s VAL 34 N 2.69 2.89 -0.34 1.34 1.01 -0.07 -4.99 120.40 122.92 1wgk s VAL 34 Ca 0.51 -1.14 -0.00 0.00 0.00 0.00 0.00 61.98 61.35 1wgk s VAL 34 Cb -0.20 -2.22 0.11 0.00 0.00 0.00 0.00 36.38 34.07 1wgk s VAL 34 CO 0.15 0.35 0.15 0.00 0.00 0.00 0.00 175.10 175.75 1wgk s ALA 35 N -0.93 1.47 0.40 5.51 0.00 -1.26 -0.09 121.76 126.85 1wgk s ALA 35 Ca 0.15 -1.84 -0.24 0.00 0.00 0.00 0.00 51.96 50.03 1wgk s ALA 35 Cb -0.11 -1.65 -0.09 0.00 0.00 0.00 0.00 23.12 21.27 1wgk s ALA 35 CO 0.05 -1.83 1.04 -0.51 0.00 0.00 0.00 175.76 174.52 1wgk s LEU 36 N 1.30 4.15 1.02 0.00 1.43 0.26 -4.88 118.68 121.96 1wgk s LEU 36 Ca 0.13 2.03 -0.13 0.00 -1.03 0.00 0.00 54.13 55.13 1wgk s LEU 36 Cb -0.20 -4.18 0.20 0.00 0.03 0.00 0.00 46.19 42.04 1wgk s LEU 36 CO -0.17 -0.47 1.09 -2.16 0.23 0.00 0.00 176.35 174.88 1wgk s PRO 37 N -2.49 0.24 -0.12 1.29 0.04 -1.26 -0.97 135.00 131.73 1wgk s PRO 37 Ca 0.57 0.46 -0.05 0.00 0.04 0.00 0.00 61.00 62.02 1wgk s PRO 37 Cb -0.22 -1.72 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 1wgk s PRO 37 CO 0.27 -2.85 0.08 0.20 0.04 0.00 0.00 177.00 174.74 1wgk s GLY 38 N -3.47 2.00 0.36 0.56 0.00 -1.26 -4.42 107.32 101.09 1wgk s GLY 38 Ca 0.66 -0.72 -0.09 0.00 0.00 0.00 0.00 44.72 44.57 1wgk s GLY 38 CO 0.58 -0.34 0.62 -0.86 0.00 0.00 0.00 173.10 173.09 1wgk s GLN 39 N -0.67 2.06 0.23 2.90 -2.07 -1.26 -4.64 119.66 116.21 1wgk s GLN 39 Ca 0.12 -1.60 -0.07 0.00 -1.82 0.00 0.00 55.36 51.99 1wgk s GLN 39 Cb -0.12 0.53 0.22 0.00 -1.09 0.00 0.00 33.01 32.55 1wgk s GLN 39 CO 0.02 -0.91 1.83 1.05 -1.32 0.00 0.00 175.29 175.97 1wgk h GLU 40 N 2.06 1.21 -5.82 9.60 4.11 -1.95 -3.37 114.58 120.41 1wgk h GLU 40 Ca -0.30 -0.17 -0.64 0.00 0.07 0.00 0.00 59.36 58.32 1wgk h GLU 40 Cb 1.24 -0.22 -0.06 0.00 0.50 0.00 0.00 28.75 30.21 1wgk h GLU 40 CO 0.39 0.92 -0.37 -1.83 0.07 0.00 0.00 179.01 178.20 1wgk s GLU 41 N -5.71 3.63 0.53 1.06 1.03 -1.26 -5.03 118.70 112.94 1wgk s GLU 41 Ca -0.12 0.06 -0.20 0.00 0.03 0.00 0.00 54.97 54.74 1wgk s GLU 41 Cb 0.16 -3.17 -0.06 0.00 -0.80 0.00 0.00 34.13 30.26 1wgk s GLU 41 CO 0.83 0.72 1.14 -1.25 -1.33 0.00 0.00 175.26 175.37 1wgk s PRO 42 N -1.21 3.44 -0.45 -4.83 0.04 -1.26 -4.96 135.00 125.76 1wgk s PRO 42 Ca 0.21 1.65 -0.29 0.00 0.04 0.00 0.00 61.00 62.61 1wgk s PRO 42 Cb -0.14 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.33 1wgk s PRO 42 CO 0.10 -0.79 1.40 -1.58 0.04 0.00 0.00 177.00 176.17 1wgk s TRP 43 N -1.72 2.39 0.17 0.56 0.52 -1.26 -4.92 118.94 114.68 1wgk s TRP 43 Ca 0.71 0.63 0.04 0.00 0.02 0.00 0.00 56.10 57.50 1wgk s TRP 43 Cb -0.25 -4.34 -0.03 0.00 -1.15 0.00 0.00 33.47 27.70 1wgk s TRP 43 CO 0.29 -1.94 0.27 -0.51 0.02 0.00 0.00 176.95 175.07 1wgk s ASP 44 N 4.01 6.14 0.26 2.95 1.01 -1.26 -0.06 116.67 129.72 1wgk s ASP 44 Ca 0.59 0.07 -0.04 0.00 0.71 0.00 0.00 52.55 53.88 1wgk s ASP 44 Cb -0.12 -1.79 0.53 0.00 1.01 0.00 0.00 42.92 42.55 1wgk s ASP 44 CO 0.31 0.03 1.41 -0.38 0.21 0.00 0.00 175.17 176.75 1wgk n ILE 45 N -0.70 -0.38 0.00 0.77 2.08 -1.13 -0.84 119.36 119.16 1wgk n ILE 45 Ca -0.08 2.04 0.00 0.00 0.56 0.00 0.00 62.75 65.27 1wgk n ILE 45 Cb 0.55 -2.88 0.00 0.00 -0.75 0.00 0.00 39.64 36.56 1wgk n ILE 45 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 1wgk n ARG 46 N -5.41 0.00 -0.25 0.38 0.63 -1.26 -0.87 116.66 109.87 1wgk n ARG 46 Ca 0.17 0.88 0.01 0.00 -0.92 0.00 0.00 57.85 57.99 1wgk n ARG 46 Cb 0.55 -1.50 0.14 0.00 0.45 0.00 0.00 32.46 32.10 1wgk n ARG 46 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1wgk h ASN 47 N 0.00 0.53 -0.60 6.15 2.35 -1.51 -2.40 115.58 120.11 1wgk h ASN 47 Ca 0.00 0.05 0.11 0.00 -0.55 0.00 0.00 56.30 55.91 1wgk h ASN 47 Cb 0.00 -0.05 -0.12 0.00 0.05 0.00 0.00 38.32 38.21 1wgk h ASN 47 CO 0.00 0.31 -0.28 0.25 -1.65 0.00 0.00 177.43 176.06 1wgk h LEU 48 N 0.67 -0.99 -0.45 1.61 5.85 -0.06 -1.59 115.31 120.34 1wgk h LEU 48 Ca 0.35 0.22 0.06 0.00 0.84 0.00 0.00 57.88 59.35 1wgk h LEU 48 Cb 0.33 0.52 -0.09 0.00 0.37 0.00 0.00 40.66 41.79 1wgk h LEU 48 CO -0.24 -0.28 -0.52 -0.07 -0.34 0.00 0.00 178.44 176.98 1wgk h LEU 49 N -0.12 -1.76 -1.07 2.25 -0.00 -0.46 0.25 115.31 114.39 1wgk h LEU 49 Ca 0.26 0.24 0.37 0.00 -0.00 0.00 0.00 57.88 58.75 1wgk h LEU 49 Cb 0.53 0.74 -0.16 0.00 -0.00 0.00 0.00 40.66 41.78 1wgk h LEU 49 CO -0.67 -0.38 0.61 0.58 -0.00 0.00 0.00 178.44 178.57 1wgk h VAL 50 N -0.35 0.17 0.24 1.22 2.07 -1.32 1.13 116.25 119.40 1wgk h VAL 50 Ca 0.10 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 1wgk h VAL 50 Cb 0.59 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1wgk h VAL 50 CO -0.62 0.03 -0.12 -0.25 0.02 0.00 0.00 177.57 176.64 1wgk h TRP 51 N 0.17 -0.30 0.00 1.57 7.01 -0.41 -2.83 115.95 121.16 1wgk h TRP 51 Ca 0.79 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.78 1wgk h TRP 51 Cb 2.02 0.10 0.00 0.00 -2.10 0.00 0.00 29.16 29.18 1wgk h TRP 51 CO -0.01 -0.19 0.06 0.82 -2.79 0.00 0.00 178.44 176.33 1wgk h ILE 52 N -0.84 0.00 0.00 2.65 2.04 0.06 0.86 117.51 122.28 1wgk h ILE 52 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1wgk h ILE 52 Cb 0.25 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1wgk h ILE 52 CO 0.05 0.00 -0.69 0.11 0.00 0.00 0.00 178.15 177.63 1wgk h LYS 53 N 0.00 0.00 0.00 2.37 1.57 0.13 -0.37 116.57 120.27 1wgk h LYS 53 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wgk h LYS 53 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1wgk h LYS 53 CO 0.00 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.51 1wgk n LYS 54 N -2.14 0.00 0.13 3.15 5.02 0.12 -4.43 118.16 120.01 1wgk n LYS 54 Ca 0.03 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.19 1wgk n LYS 54 Cb 0.45 -0.24 -0.07 0.00 -0.02 0.00 0.00 35.03 35.15 1wgk n LYS 54 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1wgk h ASN 55 N 0.00 -1.14 0.32 4.39 2.35 0.27 -3.29 115.58 118.48 1wgk h ASN 55 Ca 0.00 0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.85 1wgk h ASN 55 Cb 0.00 0.41 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1wgk h ASN 55 CO 0.00 -0.44 -0.16 0.25 -1.65 0.00 0.00 177.43 175.43 1wgk h LEU 56 N -0.62 -0.37 -9.40 1.61 5.85 -1.69 -3.44 115.31 107.26 1wgk h LEU 56 Ca -0.02 -0.09 -0.54 0.00 0.84 0.00 0.00 57.88 58.07 1wgk h LEU 56 Cb 0.59 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.72 1wgk h LEU 56 CO -0.16 0.10 0.79 -0.22 -0.34 0.00 0.00 178.44 178.61 1wgk s LEU 57 N -9.08 4.33 -0.12 2.25 2.96 -0.15 -4.66 118.68 114.21 1wgk s LEU 57 Ca -0.09 2.12 0.14 0.00 -0.22 0.00 0.00 54.13 56.08 1wgk s LEU 57 Cb 0.01 -3.57 -0.20 0.00 0.50 0.00 0.00 46.19 42.93 1wgk s LEU 57 CO 0.31 -0.69 0.13 0.29 -1.32 0.00 0.00 176.35 175.07 1wgk n LYS 58 N 5.07 1.26 -1.67 1.98 4.76 -1.23 -3.76 118.16 124.58 1wgk n LYS 58 Ca 0.13 -0.04 -0.25 0.00 -2.87 0.00 0.00 58.31 55.27 1wgk n LYS 58 Cb 0.44 -1.39 0.18 0.00 -1.84 0.00 0.00 35.03 32.41 1wgk n LYS 58 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1wgk n GLU 59 N -2.43 -1.08 -1.83 1.97 -0.58 -1.26 -4.98 120.64 110.43 1wgk n GLU 59 Ca -0.19 -1.80 -0.42 0.00 -0.42 0.00 0.00 57.16 54.33 1wgk n GLU 59 Cb 0.85 -1.16 -0.02 0.00 -0.57 0.00 0.00 31.44 30.53 1wgk n GLU 59 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1wgk s ARG 60 N -5.49 4.16 -0.02 3.49 3.00 -1.26 -4.94 118.95 117.90 1wgk s ARG 60 Ca 0.65 2.50 -0.25 0.00 0.00 0.00 0.00 55.73 58.63 1wgk s ARG 60 Cb -0.02 -3.08 -0.19 0.00 0.00 0.00 0.00 34.95 31.66 1wgk s ARG 60 CO 0.45 -0.62 1.22 -1.00 0.00 0.00 0.00 175.30 175.35 1wgk h PRO 61 N 5.78 -0.07 -1.61 3.54 0.13 -1.85 -3.12 132.00 134.80 1wgk h PRO 61 Ca -0.45 0.00 0.47 0.00 -0.87 0.00 0.00 66.00 65.15 1wgk h PRO 61 Cb 1.21 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 1wgk h PRO 61 CO 0.86 0.40 1.17 1.05 -0.23 0.00 0.00 178.00 181.24 1wgk h GLU 62 N -0.56 0.00 0.08 0.86 4.11 -1.86 1.00 114.58 118.21 1wgk h GLU 62 Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 1wgk h GLU 62 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1wgk h GLU 62 CO 0.01 0.00 -0.04 -0.07 0.07 0.00 0.00 179.01 178.98 1wgk h LEU 63 N 0.00 -0.09 0.00 3.06 4.07 -1.94 -3.40 115.31 117.00 1wgk h LEU 63 Ca 0.76 -0.47 0.00 0.00 0.08 0.00 0.00 57.88 58.25 1wgk h LEU 63 Cb 3.09 0.02 0.00 0.00 1.08 0.00 0.00 40.66 44.85 1wgk h LEU 63 CO -0.01 0.46 -0.15 0.15 -1.08 0.00 0.00 178.44 177.81 1wgk h PHE 64 N -0.69 0.00 -4.32 1.13 3.57 -0.39 -3.48 116.94 112.76 1wgk h PHE 64 Ca -0.01 0.00 -0.56 0.00 3.53 0.00 0.00 57.97 60.93 1wgk h PHE 64 Cb 0.55 0.00 -0.29 0.00 2.79 0.00 0.00 35.95 39.01 1wgk h PHE 64 CO 0.10 0.00 -0.84 0.42 -2.23 0.00 0.00 178.31 175.77 1wgk s ILE 65 N -1.55 1.48 -0.19 1.41 1.01 0.31 -4.43 121.20 119.24 1wgk s ILE 65 Ca -0.04 -0.85 -0.05 0.00 0.00 0.00 0.00 60.65 59.71 1wgk s ILE 65 Cb 0.01 -1.24 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 1wgk s ILE 65 CO 0.06 0.38 -0.01 -1.10 0.00 0.00 0.00 174.94 174.27 1wgk s GLN 66 N -0.55 3.65 0.30 2.79 -0.21 -1.23 -2.60 119.66 121.82 1wgk s GLN 66 Ca 0.07 -0.51 0.00 0.00 0.02 0.00 0.00 55.36 54.94 1wgk s GLN 66 Cb -0.07 -3.04 0.00 0.00 1.00 0.00 0.00 33.01 30.90 1wgk s GLN 66 CO -0.00 0.09 0.00 0.41 -2.12 0.00 0.00 175.29 173.67 1wgk n GLY 67 N 4.00 -2.17 0.24 3.09 0.00 -1.26 -3.65 105.19 105.44 1wgk n GLY 67 Ca -0.17 -1.24 0.10 0.00 0.00 0.00 0.00 46.02 44.71 1wgk n GLY 67 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1wgk h ASP 68 N -0.97 0.00 -2.05 1.61 3.32 -1.95 -3.40 116.42 112.98 1wgk h ASP 68 Ca -0.03 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.54 1wgk h ASP 68 Cb 0.95 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.48 1wgk h ASP 68 CO 0.02 0.00 -0.44 -0.44 -1.72 0.00 0.00 179.24 176.66 1wgk s SER 69 N -3.78 5.84 0.32 6.45 0.01 -1.24 -4.55 113.70 116.74 1wgk s SER 69 Ca -0.02 -0.18 -0.27 0.00 1.31 0.00 0.00 55.95 56.79 1wgk s SER 69 Cb 0.05 -1.44 -0.09 0.00 0.21 0.00 0.00 66.02 64.75 1wgk s SER 69 CO 0.17 -0.19 1.02 0.68 0.41 0.00 0.00 173.24 175.34 1wgk s VAL 70 N -2.12 3.81 0.99 3.43 -7.23 -1.26 -3.55 120.40 114.48 1wgk s VAL 70 Ca 0.37 1.60 -0.15 0.00 -1.81 0.00 0.00 61.98 61.99 1wgk s VAL 70 Cb -0.08 -3.94 0.00 0.00 0.56 0.00 0.00 36.38 32.92 1wgk s VAL 70 CO 0.28 0.22 0.01 0.54 -0.31 0.00 0.00 175.10 175.83 1wgk n ARG 71 N 0.68 -0.46 0.00 4.82 1.74 -1.26 -4.76 116.66 117.43 1wgk n ARG 71 Ca 0.01 -0.11 0.05 0.00 -0.77 0.00 0.00 57.85 57.04 1wgk n ARG 71 Cb 0.48 -1.63 0.30 0.00 -1.02 0.00 0.00 32.46 30.60 1wgk n ARG 71 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1wgk n PRO 72 N -0.77 0.49 -0.00 5.56 -0.04 -1.26 -2.97 135.00 136.00 1wgk n PRO 72 Ca 0.04 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1wgk n PRO 72 Cb 0.57 -1.33 -0.00 0.00 -0.04 0.00 0.00 33.50 32.70 1wgk n PRO 72 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wgk n GLY 73 N -0.02 -0.01 3.62 0.55 0.00 -1.26 -4.99 105.19 103.07 1wgk n GLY 73 Ca 0.08 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1wgk n GLY 73 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wgk s ILE 74 N -2.01 3.33 -0.31 -0.61 -1.09 -1.16 -4.25 121.20 115.10 1wgk s ILE 74 Ca -0.01 0.36 -0.17 0.00 -2.23 0.00 0.00 60.65 58.60 1wgk s ILE 74 Cb 0.00 -3.38 -0.02 0.00 -1.58 0.00 0.00 42.46 37.48 1wgk s ILE 74 CO 0.01 -0.20 0.48 -0.76 -1.23 0.00 0.00 174.94 173.24 1wgk s LEU 75 N 6.53 4.21 0.10 2.97 1.43 0.67 -4.68 118.68 129.92 1wgk s LEU 75 Ca 0.85 0.16 0.01 0.00 -1.03 0.00 0.00 54.13 54.13 1wgk s LEU 75 Cb -0.29 -2.56 -0.04 0.00 0.03 0.00 0.00 46.19 43.33 1wgk s LEU 75 CO 0.34 -0.36 0.23 0.68 0.23 0.00 0.00 176.35 177.47 1wgk s VAL 76 N 2.28 5.31 -0.07 -1.59 -7.23 -1.26 0.19 120.40 118.03 1wgk s VAL 76 Ca 0.18 -0.55 -0.03 0.00 -1.81 0.00 0.00 61.98 59.77 1wgk s VAL 76 Cb -0.16 -3.65 0.04 0.00 0.56 0.00 0.00 36.38 33.17 1wgk s VAL 76 CO 0.11 0.03 0.14 -0.76 -0.31 0.00 0.00 175.10 174.31 1wgk s LEU 77 N -2.83 0.22 -0.27 1.32 1.43 0.37 -3.81 118.68 115.11 1wgk s LEU 77 Ca 0.34 0.27 -0.17 0.00 -1.03 0.00 0.00 54.13 53.55 1wgk s LEU 77 Cb -0.12 0.22 -0.03 0.00 0.03 0.00 0.00 46.19 46.29 1wgk s LEU 77 CO 0.28 -0.21 0.47 -0.63 0.23 0.00 0.00 176.35 176.48 1wgk s ILE 78 N 1.92 5.10 -1.63 -0.59 1.01 -0.08 -0.47 121.20 126.46 1wgk s ILE 78 Ca -0.00 0.75 -0.12 0.00 0.00 0.00 0.00 60.65 61.28 1wgk s ILE 78 Cb -0.12 -3.79 0.10 0.00 0.01 0.00 0.00 42.46 38.66 1wgk s ILE 78 CO -0.05 0.10 0.52 0.59 0.00 0.00 0.00 174.94 176.10 1wgk n ASN 79 N 5.48 -1.55 -2.80 3.58 3.02 0.68 -0.58 115.26 123.09 1wgk n ASN 79 Ca -0.06 -1.10 -0.13 0.00 -0.03 0.00 0.00 54.58 53.27 1wgk n ASN 79 Cb 0.50 -2.43 0.07 0.00 -0.61 0.00 0.00 39.78 37.31 1wgk n ASN 79 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1wgk n ASP 80 N -2.75 -2.22 -3.65 6.41 9.92 -1.26 -5.03 116.55 117.98 1wgk n ASP 80 Ca -0.09 -0.46 -0.02 0.00 -0.53 0.00 0.00 54.79 53.69 1wgk n ASP 80 Cb 0.57 -3.93 -0.05 0.00 -0.64 0.00 0.00 41.12 37.07 1wgk n ASP 80 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wgk s ALA 81 N -3.27 -1.98 -0.38 2.24 0.00 0.25 -5.12 121.76 113.50 1wgk s ALA 81 Ca 0.03 2.33 -0.44 0.00 0.00 0.00 0.00 51.96 53.87 1wgk s ALA 81 Cb -0.01 -1.70 -0.19 0.00 0.00 0.00 0.00 23.12 21.22 1wgk s ALA 81 CO 0.54 -0.82 1.57 -0.25 0.00 0.00 0.00 175.76 176.80 1wgk n ASP 82 N 5.24 1.39 0.08 0.00 9.92 -1.26 -0.90 116.55 131.01 1wgk n ASP 82 Ca -0.13 1.16 0.06 0.00 -0.53 0.00 0.00 54.79 55.34 1wgk n ASP 82 Cb 0.51 -0.96 0.31 0.00 -0.64 0.00 0.00 41.12 40.34 1wgk n ASP 82 CO 0.00 0.00 0.00 -2.67 0.13 0.00 0.00 177.20 174.66 1wgk n TRP 83 N 4.03 0.38 0.10 1.24 4.27 -1.25 -1.29 117.44 124.91 1wgk n TRP 83 Ca 0.28 0.19 -0.14 0.00 -3.89 0.00 0.00 57.50 53.94 1wgk n TRP 83 Cb 0.01 -0.80 -0.12 0.00 -1.36 0.00 0.00 31.31 29.04 1wgk n TRP 83 CO 0.00 0.00 0.00 0.93 -2.29 0.00 0.00 177.69 176.33 1wgk h GLU 84 N 0.00 0.26 0.00 -2.67 5.08 -1.89 0.32 114.58 115.68 1wgk h GLU 84 Ca 0.00 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1wgk h GLU 84 Cb 0.04 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1wgk h GLU 84 CO 0.00 1.17 0.00 -0.07 -1.00 0.00 0.00 179.01 179.11 1wgk h LEU 85 N 0.09 0.00 0.00 1.33 4.07 -1.54 -3.35 115.31 115.90 1wgk h LEU 85 Ca -0.11 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.85 1wgk h LEU 85 Cb 1.87 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.61 1wgk h LEU 85 CO 0.19 0.00 -0.48 0.18 -1.08 0.00 0.00 178.44 177.25 1wgk n LEU 86 N -2.81 1.30 0.00 1.67 4.77 -1.21 -5.07 117.00 115.65 1wgk n LEU 86 Ca 0.01 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1wgk n LEU 86 Cb 0.28 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1wgk n LEU 86 CO 0.25 -0.48 0.00 0.61 -1.33 0.00 0.00 177.39 176.44 1wgk n GLY 87 N 2.31 -1.15 0.00 -0.72 0.00 0.89 -4.75 105.19 101.78 1wgk n GLY 87 Ca -0.07 0.89 0.00 0.00 0.00 0.00 0.00 46.02 46.84 1wgk n GLY 87 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wgk n GLU 88 N 0.00 0.00 0.00 1.61 4.71 0.17 -0.60 120.64 126.52 1wgk n GLU 88 Ca 0.00 0.69 0.05 0.00 -0.01 0.00 0.00 57.16 57.89 1wgk n GLU 88 Cb 0.00 -1.05 -0.05 0.00 -1.01 0.00 0.00 31.44 29.33 1wgk n GLU 88 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1wgk n LEU 89 N -2.58 0.56 0.14 -4.62 4.77 -1.26 -4.42 117.00 109.59 1wgk n LEU 89 Ca 0.00 -0.53 0.12 0.00 -0.03 0.00 0.00 56.01 55.58 1wgk n LEU 89 Cb 0.00 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.32 1wgk n LEU 89 CO 0.00 0.13 0.66 0.44 -1.33 0.00 0.00 177.39 177.30 1wgk h ASP 90 N 0.12 0.00 -3.90 -1.43 3.32 -1.90 -3.39 116.42 109.24 1wgk h ASP 90 Ca 0.00 -0.03 -0.51 0.00 0.02 0.00 0.00 57.03 56.51 1wgk h ASP 90 Cb 0.26 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.85 1wgk h ASP 90 CO 0.00 0.02 0.51 -0.47 -1.72 0.00 0.00 179.24 177.57 1wgk s TYR 91 N -3.18 3.24 -0.31 4.55 6.14 0.23 -4.94 117.35 123.07 1wgk s TYR 91 Ca 0.07 1.59 -0.04 0.00 0.64 0.00 0.00 57.07 59.33 1wgk s TYR 91 Cb 0.09 -3.38 0.04 0.00 0.42 0.00 0.00 41.96 39.14 1wgk s TYR 91 CO 0.67 -1.10 0.04 -0.65 0.64 0.00 0.00 175.55 175.15 1wgk s GLN 92 N -1.99 2.54 0.54 4.97 -0.21 -1.26 -2.84 119.66 121.40 1wgk s GLN 92 Ca 0.52 -1.21 -0.21 0.00 0.02 0.00 0.00 55.36 54.48 1wgk s GLN 92 Cb -0.31 -3.29 -0.05 0.00 1.00 0.00 0.00 33.01 30.35 1wgk s GLN 92 CO 0.40 -0.63 1.23 -0.51 -2.12 0.00 0.00 175.29 173.67 1wgk s LEU 93 N 1.32 3.82 0.00 2.90 1.43 0.92 -4.94 118.68 124.13 1wgk s LEU 93 Ca -0.03 2.46 0.02 0.00 -1.03 0.00 0.00 54.13 55.54 1wgk s LEU 93 Cb -0.19 -4.40 -0.01 0.00 0.03 0.00 0.00 46.19 41.62 1wgk s LEU 93 CO 0.01 -1.37 0.06 0.00 0.23 0.00 0.00 176.35 175.28 1wgk n GLN 94 N -1.09 0.87 -2.13 1.70 1.13 -1.26 -4.27 117.38 112.33 1wgk n GLN 94 Ca 0.11 -2.57 -0.34 0.00 -1.94 0.00 0.00 57.00 52.26 1wgk n GLN 94 Cb 0.48 1.07 0.01 0.00 0.11 0.00 0.00 30.24 31.91 1wgk n GLN 94 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1wgk s ASP 95 N -2.90 5.65 -1.41 1.08 1.11 -1.26 -3.54 116.67 115.40 1wgk s ASP 95 Ca 0.08 2.04 -0.08 0.00 0.18 0.00 0.00 52.55 54.78 1wgk s ASP 95 Cb 0.00 -2.56 0.04 0.00 1.07 0.00 0.00 42.92 41.47 1wgk s ASP 95 CO 0.06 -1.26 0.91 0.00 1.18 0.00 0.00 175.17 176.06 1wgk n GLN 96 N -1.67 -5.70 -3.14 8.23 3.00 0.61 -4.89 117.38 113.83 1wgk n GLN 96 Ca 0.10 0.65 -0.18 0.00 -0.01 0.00 0.00 57.00 57.56 1wgk n GLN 96 Cb 0.52 -5.45 0.01 0.00 0.00 0.00 0.00 30.24 25.31 1wgk n GLN 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1wgk s ASP 97 N -3.74 5.43 -0.06 1.08 1.11 -1.10 -4.96 116.67 114.43 1wgk s ASP 97 Ca 0.39 -0.57 0.00 0.00 0.18 0.00 0.00 52.55 52.55 1wgk s ASP 97 Cb -0.19 -0.47 0.02 0.00 1.07 0.00 0.00 42.92 43.35 1wgk s ASP 97 CO 0.81 -0.84 -0.03 -0.44 1.18 0.00 0.00 175.17 175.85 1wgk s SER 98 N -4.35 1.32 -0.02 0.27 0.01 -1.26 -0.36 113.70 109.31 1wgk s SER 98 Ca 0.54 -0.13 0.07 0.00 1.31 0.00 0.00 55.95 57.73 1wgk s SER 98 Cb -0.08 -0.50 -0.02 0.00 0.21 0.00 0.00 66.02 65.64 1wgk s SER 98 CO 0.33 -0.11 -0.22 -0.63 0.41 0.00 0.00 173.24 173.01 1wgk s ILE 99 N 1.37 1.76 0.06 1.44 -1.09 0.59 -0.23 121.20 125.10 1wgk s ILE 99 Ca -0.04 -0.95 0.07 0.00 -2.23 0.00 0.00 60.65 57.50 1wgk s ILE 99 Cb -0.13 -1.47 -0.03 0.00 -1.58 0.00 0.00 42.46 39.25 1wgk s ILE 99 CO -0.03 0.50 -0.19 -0.22 -1.23 0.00 0.00 174.94 173.77 1wgk s LEU 100 N -0.50 2.22 -0.02 2.97 2.96 0.38 -0.98 118.68 125.71 1wgk s LEU 100 Ca 0.08 -0.57 0.00 0.00 -0.22 0.00 0.00 54.13 53.42 1wgk s LEU 100 Cb -0.09 -0.83 0.03 0.00 0.50 0.00 0.00 46.19 45.79 1wgk s LEU 100 CO -0.01 0.08 0.01 -0.36 -1.32 0.00 0.00 176.35 174.76 1wgk s PHE 101 N -0.97 0.19 -0.08 5.38 0.40 -0.34 -0.48 117.98 122.08 1wgk s PHE 101 Ca 0.05 0.05 0.05 0.00 -0.60 0.00 0.00 56.93 56.48 1wgk s PHE 101 Cb -0.09 -0.33 -0.00 0.00 0.51 0.00 0.00 43.02 43.11 1wgk s PHE 101 CO 0.03 -0.11 -0.24 0.42 0.70 0.00 0.00 175.22 176.02 1wgk s ILE 102 N 0.99 2.00 -0.30 0.64 -1.09 0.13 -2.12 121.20 121.45 1wgk s ILE 102 Ca -0.09 -1.01 -0.06 0.00 -2.23 0.00 0.00 60.65 57.26 1wgk s ILE 102 Cb -0.13 -1.72 0.02 0.00 -1.58 0.00 0.00 42.46 39.05 1wgk s ILE 102 CO -0.02 0.55 0.07 -0.55 -1.23 0.00 0.00 174.94 173.76 1wgk s SER 103 N 0.19 5.10 -0.01 3.58 0.15 -1.19 -0.24 113.70 121.28 1wgk s SER 103 Ca -0.14 -0.81 0.02 0.00 0.70 0.00 0.00 55.95 55.72 1wgk s SER 103 Cb -0.16 -1.86 0.02 0.00 -1.71 0.00 0.00 66.02 62.31 1wgk s SER 103 CO 0.07 -0.21 0.88 1.07 1.20 0.00 0.00 173.24 176.24 1wgk n THR 104 N 4.84 0.77 -3.31 6.45 5.66 -1.26 -4.04 114.28 123.38 1wgk n THR 104 Ca -0.14 -0.80 -0.46 0.00 -3.05 0.00 0.00 64.05 59.60 1wgk n THR 104 Cb 0.47 0.57 -0.05 0.00 -1.55 0.00 0.00 70.33 69.77 1wgk n THR 104 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1wgk s LEU 105 N -0.85 6.09 -1.54 1.09 1.98 -1.26 -4.41 118.68 119.77 1wgk s LEU 105 Ca 0.03 -1.72 -0.02 0.00 -2.89 0.00 0.00 54.13 49.52 1wgk s LEU 105 Cb 0.02 -2.21 0.00 0.00 0.66 0.00 0.00 46.19 44.66 1wgk s LEU 105 CO 0.00 -0.85 0.30 1.57 -1.89 0.00 0.00 176.35 175.49 1wgk n HIS 106 N 5.29 -1.41 0.00 5.38 -0.00 -1.26 -4.93 115.22 118.30 1wgk n HIS 106 Ca -0.14 0.26 0.00 0.00 -0.00 0.00 0.00 57.72 57.84 1wgk n HIS 106 Cb 0.41 -4.03 0.00 0.00 -0.00 0.00 0.00 29.99 26.37 1wgk n HIS 106 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1wgk n GLY 107 N -1.26 3.03 0.00 1.57 0.00 -1.26 -5.16 105.19 102.10 1wgk n GLY 107 Ca -0.16 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1wgk n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgk n GLY 108 N 2.79 0.88 3.34 -0.02 0.00 -1.23 -4.96 105.19 106.00 1wgk n GLY 108 Ca 0.00 -2.04 -0.36 0.00 0.00 0.00 0.00 46.02 43.62 1wgk n GLY 108 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wgk s SER 109 N -0.07 4.78 1.02 1.61 1.04 -1.26 -4.42 113.70 116.39 1wgk s SER 109 Ca 0.00 -0.53 -0.11 0.00 0.48 0.00 0.00 55.95 55.79 1wgk s SER 109 Cb 0.00 -1.82 0.17 0.00 0.10 0.00 0.00 66.02 64.47 1wgk s SER 109 CO 0.00 -0.10 0.38 0.61 0.98 0.00 0.00 173.24 175.11 1wgk n GLY 110 N 4.83 -2.81 3.77 7.32 0.00 -1.26 -4.93 105.19 112.12 1wgk n GLY 110 Ca -0.16 -0.91 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 1wgk n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wgk s PRO 111 N -3.40 3.45 -0.22 1.61 0.04 -1.26 -4.92 135.00 130.29 1wgk s PRO 111 Ca 0.29 1.65 -0.05 0.00 0.04 0.00 0.00 61.00 62.94 1wgk s PRO 111 Cb -0.05 -2.10 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 1wgk s PRO 111 CO 0.24 -0.78 3.11 -1.13 0.04 0.00 0.00 177.00 178.49 1wgk n SER 112 N -1.10 5.87 -3.84 6.66 3.41 -1.26 -4.76 113.62 118.59 1wgk n SER 112 Ca 0.11 -2.84 -0.31 0.00 -0.26 0.00 0.00 58.87 55.56 1wgk n SER 112 Cb 0.50 -1.31 -0.06 0.00 -0.26 0.00 0.00 64.21 63.08 1wgk n SER 112 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1wgk n SER 113 N 1.62 -1.04 -0.27 4.04 7.64 -1.26 -5.36 113.62 119.00 1wgk n SER 113 Ca 0.44 -0.96 0.15 0.00 1.01 0.00 0.00 58.87 59.51 1wgk n SER 113 Cb 0.72 -1.22 0.71 0.00 -1.01 0.00 0.00 64.21 63.41 1wgk n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64