#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f7k s ILE 2 N 0.00 3.49 -0.04 0.00 1.01 -1.26 -4.86 121.20 119.53 3f7k s ILE 2 Ca 0.00 1.46 0.07 0.00 0.00 0.00 0.00 60.65 62.18 3f7k s ILE 2 Cb 0.00 -3.93 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 3f7k s ILE 2 CO 0.00 0.33 -0.25 -1.00 0.00 0.00 0.00 174.94 174.02 3f7k s HIS 3 N -0.99 2.39 0.17 3.97 3.76 -1.26 -1.45 115.29 121.88 3f7k s HIS 3 Ca 0.46 -0.60 0.01 0.00 -0.15 0.00 0.00 55.06 54.78 3f7k s HIS 3 Cb -0.32 -1.55 -0.05 0.00 1.11 0.00 0.00 32.58 31.77 3f7k s HIS 3 CO 0.41 -0.14 0.02 0.00 -0.85 0.00 0.00 174.74 174.17 3f7k s ALA 4 N -0.35 1.28 0.04 -1.40 0.00 0.13 -1.59 121.76 119.87 3f7k s ALA 4 Ca 0.02 -1.58 -0.09 0.00 0.00 0.00 0.00 51.96 50.30 3f7k s ALA 4 Cb -0.12 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.63 3f7k s ALA 4 CO 0.02 -0.36 0.20 0.54 0.00 0.00 0.00 175.76 176.15 3f7k s VAL 5 N -3.73 0.11 -0.11 0.00 0.11 0.13 -1.22 120.40 115.69 3f7k s VAL 5 Ca 0.25 -0.92 -0.05 0.00 -2.93 0.00 0.00 61.98 58.33 3f7k s VAL 5 Cb 0.06 -0.95 0.05 0.00 -1.53 0.00 0.00 36.38 34.02 3f7k s VAL 5 CO 0.04 -0.51 0.25 0.00 -3.33 0.00 0.00 175.10 171.55 3f7k s VAL 7 N 1.79 4.43 -0.11 0.00 1.01 -1.26 -0.94 120.40 125.31 3f7k s VAL 7 Ca -0.04 -0.22 -0.19 0.00 0.00 0.00 0.00 61.98 61.53 3f7k s VAL 7 Cb -0.11 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 3f7k s VAL 7 CO -0.08 0.27 0.50 -0.76 0.00 0.00 0.00 175.10 175.02 3f7k s LEU 8 N 1.62 4.28 -0.04 3.92 1.43 0.32 -4.01 118.68 126.21 3f7k s LEU 8 Ca 0.06 0.86 -0.18 0.00 -1.03 0.00 0.00 54.13 53.84 3f7k s LEU 8 Cb -0.16 -2.74 0.04 0.00 0.03 0.00 0.00 46.19 43.36 3f7k s LEU 8 CO 0.05 -0.01 0.40 -0.54 0.23 0.00 0.00 176.35 176.48 3f7k s LYS 9 N 0.61 0.72 0.00 1.70 1.02 -0.54 -3.21 119.74 120.05 3f7k s LYS 9 Ca 0.27 0.02 0.00 0.00 0.02 0.00 0.00 55.97 56.28 3f7k s LYS 9 Cb -0.15 0.33 0.00 0.00 -0.52 0.00 0.00 37.83 37.49 3f7k s LYS 9 CO 0.11 -0.19 0.00 0.41 -0.92 0.00 0.00 175.35 174.76 3f7k n GLY 10 N 1.44 1.99 2.46 -3.33 0.00 -1.25 -1.32 105.19 105.17 3f7k n GLY 10 Ca -0.20 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 44.77 3f7k n GLY 10 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3f7k n ASP 11 N 0.00 7.96 -3.59 1.61 4.64 -1.22 -4.78 116.55 121.17 3f7k n ASP 11 Ca 0.00 -2.94 -0.01 0.00 -1.38 0.00 0.00 54.79 50.46 3f7k n ASP 11 Cb 0.00 -1.44 0.00 0.00 -1.04 0.00 0.00 41.12 38.64 3f7k n ASP 11 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3f7k s SER 12 N 1.10 -0.06 0.00 1.67 1.04 -1.26 -4.98 113.70 111.21 3f7k s SER 12 Ca 0.58 -0.41 0.08 0.00 0.48 0.00 0.00 55.95 56.68 3f7k s SER 12 Cb 0.18 0.37 0.35 0.00 0.10 0.00 0.00 66.02 67.01 3f7k s SER 12 CO -0.08 -0.71 1.24 -0.81 0.98 0.00 0.00 173.24 173.87 3f7k n PRO 13 N -0.62 1.26 -2.64 4.02 -0.04 -1.26 -4.91 135.00 130.81 3f7k n PRO 13 Ca -0.04 -0.40 -0.43 0.00 -0.04 0.00 0.00 63.50 62.59 3f7k n PRO 13 Cb 0.60 -1.15 -0.02 0.00 -0.04 0.00 0.00 33.50 32.89 3f7k n PRO 13 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3f7k s VAL 14 N -1.87 4.67 0.13 0.52 1.01 -1.26 -4.61 120.40 118.99 3f7k s VAL 14 Ca 0.14 1.96 -0.02 0.00 0.00 0.00 0.00 61.98 64.06 3f7k s VAL 14 Cb 0.07 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 3f7k s VAL 14 CO 0.10 -0.04 0.08 0.42 0.00 0.00 0.00 175.10 175.66 3f7k s THR 15 N 2.37 0.11 0.00 3.92 -4.23 -0.98 -4.23 115.64 112.60 3f7k s THR 15 Ca 0.49 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.17 3f7k s THR 15 Cb -0.18 -1.98 0.00 0.00 1.34 0.00 0.00 72.50 71.68 3f7k s THR 15 CO 0.16 -0.48 0.00 0.61 -0.54 0.00 0.00 174.62 174.36 3f7k n GLY 16 N -0.10 1.94 3.13 3.99 0.00 -1.20 -0.54 105.19 112.42 3f7k n GLY 16 Ca -0.06 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.90 3f7k n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f7k s THR 17 N -2.00 1.75 -0.13 2.61 2.01 -1.10 -0.52 115.64 118.26 3f7k s THR 17 Ca 0.00 -0.81 -0.01 0.00 0.31 0.00 0.00 61.69 61.18 3f7k s THR 17 Cb 0.00 -1.55 -0.02 0.00 0.01 0.00 0.00 72.50 70.94 3f7k s THR 17 CO 0.00 0.49 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.68 3f7k s ILE 18 N 0.71 3.21 -0.04 1.82 -1.09 -0.12 -2.98 121.20 122.73 3f7k s ILE 18 Ca -0.11 -0.61 0.02 0.00 -2.23 0.00 0.00 60.65 57.72 3f7k s ILE 18 Cb -0.16 -2.36 -0.03 0.00 -1.58 0.00 0.00 42.46 38.33 3f7k s ILE 18 CO 0.02 0.52 -0.08 -1.00 -1.23 0.00 0.00 174.94 173.17 3f7k s HIS 19 N 0.31 2.88 -0.03 3.97 3.76 0.97 -0.80 115.29 126.34 3f7k s HIS 19 Ca -0.09 -0.03 0.04 0.00 -0.15 0.00 0.00 55.06 54.83 3f7k s HIS 19 Cb -0.15 -1.65 -0.00 0.00 1.11 0.00 0.00 32.58 31.88 3f7k s HIS 19 CO 0.05 0.33 -0.14 -0.51 -0.85 0.00 0.00 174.74 173.62 3f7k s LEU 20 N -1.04 1.91 -0.01 0.89 1.02 -0.35 -0.99 118.68 120.10 3f7k s LEU 20 Ca 0.14 -0.28 -0.09 0.00 0.02 0.00 0.00 54.13 53.92 3f7k s LEU 20 Cb -0.11 -0.78 0.01 0.00 0.02 0.00 0.00 46.19 45.32 3f7k s LEU 20 CO 0.04 0.14 0.19 -1.59 0.02 0.00 0.00 176.35 175.14 3f7k s LYS 21 N -0.04 0.51 0.23 1.70 -2.85 -0.47 -0.70 119.74 118.12 3f7k s LYS 21 Ca -0.01 -0.27 -0.30 0.00 -1.00 0.00 0.00 55.97 54.40 3f7k s LYS 21 Cb -0.09 0.22 -0.09 0.00 -2.06 0.00 0.00 37.83 35.81 3f7k s LYS 21 CO 0.01 -0.12 1.34 -1.21 0.10 0.00 0.00 175.35 175.46 3f7k s GLU 22 N -1.20 4.36 -0.16 1.78 2.02 -0.53 -0.79 118.70 124.18 3f7k s GLU 22 Ca -0.13 2.13 -0.06 0.00 0.02 0.00 0.00 54.97 56.94 3f7k s GLU 22 Cb -0.06 -3.16 0.08 0.00 0.10 0.00 0.00 34.13 31.09 3f7k s GLU 22 CO 0.02 -0.27 0.34 -2.00 0.02 0.00 0.00 175.26 173.37 3f7k s GLU 23 N -0.44 0.24 4.60 1.61 2.12 -0.52 -4.75 118.70 121.57 3f7k s GLU 23 Ca 0.56 0.89 0.00 0.00 0.36 0.00 0.00 54.97 56.78 3f7k s GLU 23 Cb -0.38 0.15 0.00 0.00 0.26 0.00 0.00 34.13 34.16 3f7k s GLU 23 CO 0.41 -0.27 0.00 0.41 -0.54 0.00 0.00 175.26 175.28 3f7k n GLY 24 N 5.37 2.89 1.62 -1.50 0.00 -1.26 -1.96 105.19 110.35 3f7k n GLY 24 Ca -0.07 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 45.78 3f7k n GLY 24 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3f7k n ASP 25 N 2.08 4.59 -3.86 1.61 3.85 -1.26 -4.96 116.55 118.60 3f7k n ASP 25 Ca 0.00 -3.16 -0.25 0.00 -0.71 0.00 0.00 54.79 50.67 3f7k n ASP 25 Cb 0.00 -0.67 -0.06 0.00 -1.35 0.00 0.00 41.12 39.03 3f7k n ASP 25 CO 0.00 0.00 0.00 0.23 -1.01 0.00 0.00 177.20 176.42 3f7k n MET 26 N -0.17 0.72 -4.70 0.11 2.81 -0.83 -4.88 117.12 110.18 3f7k n MET 26 Ca 0.33 -3.14 -0.33 0.00 -1.81 0.00 0.00 57.70 52.74 3f7k n MET 26 Cb 1.19 1.41 -0.15 0.00 -0.71 0.00 0.00 33.22 34.97 3f7k n MET 26 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3f7k s VAL 27 N -2.82 2.93 -0.20 2.03 1.01 -0.69 -1.43 120.40 121.23 3f7k s VAL 27 Ca 0.12 -0.70 -0.13 0.00 0.00 0.00 0.00 61.98 61.27 3f7k s VAL 27 Cb 0.01 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 3f7k s VAL 27 CO 0.09 0.52 0.29 -0.89 0.00 0.00 0.00 175.10 175.10 3f7k s THR 28 N 0.51 5.29 -0.18 3.92 2.01 0.03 -1.05 115.64 126.17 3f7k s THR 28 Ca -0.09 0.48 -0.00 0.00 0.31 0.00 0.00 61.69 62.39 3f7k s THR 28 Cb -0.16 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.74 3f7k s THR 28 CO 0.04 0.33 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.46 3f7k s VAL 29 N 0.96 2.54 0.03 3.82 1.01 0.12 -1.37 120.40 127.51 3f7k s VAL 29 Ca 0.14 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.33 3f7k s VAL 29 Cb -0.14 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 3f7k s VAL 29 CO 0.05 0.51 -0.04 0.42 0.00 0.00 0.00 175.10 176.04 3f7k s THR 30 N 1.16 0.21 -5.00 3.92 -4.23 -0.16 -1.29 115.64 110.24 3f7k s THR 30 Ca 0.01 -1.23 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 3f7k s THR 30 Cb -0.14 -0.72 0.00 0.00 1.34 0.00 0.00 72.50 72.98 3f7k s THR 30 CO -0.06 -0.65 0.00 0.61 -0.54 0.00 0.00 174.62 173.98 3f7k n GLY 31 N 1.08 -1.44 3.07 3.99 0.00 -0.75 -0.02 105.19 111.12 3f7k n GLY 31 Ca -0.20 -1.45 -0.21 0.00 0.00 0.00 0.00 46.02 44.16 3f7k n GLY 31 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3f7k s GLU 32 N -1.86 1.00 -0.07 1.61 2.12 -1.16 -0.94 118.70 119.40 3f7k s GLU 32 Ca 0.00 -0.43 0.05 0.00 0.36 0.00 0.00 54.97 54.95 3f7k s GLU 32 Cb 0.00 -0.96 -0.01 0.00 0.26 0.00 0.00 34.13 33.42 3f7k s GLU 32 CO 0.00 0.25 -0.23 0.42 -0.54 0.00 0.00 175.26 175.16 3f7k s ILE 33 N -0.25 1.94 0.31 -3.70 1.01 0.33 -2.69 121.20 118.15 3f7k s ILE 33 Ca 0.04 -0.98 0.08 0.00 0.00 0.00 0.00 60.65 59.79 3f7k s ILE 33 Cb -0.05 -1.66 -0.06 0.00 0.01 0.00 0.00 42.46 40.70 3f7k s ILE 33 CO -0.00 0.54 -0.08 0.42 0.00 0.00 0.00 174.94 175.81 3f7k s THR 34 N 0.07 1.99 0.00 2.92 -4.23 0.30 -0.49 115.64 116.20 3f7k s THR 34 Ca -0.09 -2.18 0.00 0.00 -1.18 0.00 0.00 61.69 58.24 3f7k s THR 34 Cb -0.15 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.14 3f7k s THR 34 CO 0.05 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.49 3f7k n GLY 35 N -0.70 0.70 3.83 3.99 0.00 -0.93 -2.32 105.19 109.77 3f7k n GLY 35 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 3f7k n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f7k s LEU 36 N 0.00 4.17 0.45 0.99 1.43 -0.74 -4.49 118.68 120.49 3f7k s LEU 36 Ca 0.00 1.35 -0.25 0.00 -1.03 0.00 0.00 54.13 54.20 3f7k s LEU 36 Cb 0.00 -3.91 -0.08 0.00 0.03 0.00 0.00 46.19 42.23 3f7k s LEU 36 CO 0.00 -0.12 1.36 0.42 0.23 0.00 0.00 176.35 178.24 3f7k s THR 37 N -1.81 2.29 0.44 5.49 -4.23 -1.26 -4.13 115.64 112.43 3f7k s THR 37 Ca 0.50 0.25 -0.24 0.00 -1.18 0.00 0.00 61.69 61.02 3f7k s THR 37 Cb -0.13 -3.14 -0.09 0.00 1.34 0.00 0.00 72.50 70.48 3f7k s THR 37 CO 0.19 0.03 1.18 -2.65 -0.54 0.00 0.00 174.62 172.83 3f7k n PRO 38 N -0.24 1.67 0.00 3.99 -0.02 -1.26 -4.68 135.00 134.46 3f7k n PRO 38 Ca 0.06 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 3f7k n PRO 38 Cb 0.43 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 3f7k n PRO 38 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f7k n GLY 39 N 0.95 -0.47 3.76 -1.23 0.00 -0.20 -4.92 105.19 103.07 3f7k n GLY 39 Ca 0.08 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 43.51 3f7k n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f7k s LYS 40 N 0.00 4.51 -0.04 1.61 1.02 -1.26 -0.77 119.74 124.81 3f7k s LYS 40 Ca 0.00 1.09 0.02 0.00 0.02 0.00 0.00 55.97 57.11 3f7k s LYS 40 Cb 0.00 -3.32 0.01 0.00 -0.52 0.00 0.00 37.83 34.00 3f7k s LYS 40 CO 0.00 0.40 -0.10 -1.01 -0.92 0.00 0.00 175.35 173.72 3f7k s HIS 41 N -0.48 1.15 0.60 3.18 3.76 -0.24 -2.97 115.29 120.29 3f7k s HIS 41 Ca 0.37 -0.35 -0.20 0.00 -0.15 0.00 0.00 55.06 54.74 3f7k s HIS 41 Cb -0.21 -0.85 -0.03 0.00 1.11 0.00 0.00 32.58 32.60 3f7k s HIS 41 CO 0.24 -0.18 1.31 0.20 -0.85 0.00 0.00 174.74 175.47 3f7k s GLY 42 N 0.46 2.87 -0.20 -2.22 0.00 -0.32 -0.89 107.32 107.01 3f7k s GLY 42 Ca -0.08 1.25 -0.04 0.00 0.00 0.00 0.00 44.72 45.84 3f7k s GLY 42 CO 0.02 1.71 0.35 -0.12 0.00 0.00 0.00 173.10 175.06 3f7k s PHE 43 N -1.37 -0.67 0.06 1.90 5.36 -0.33 -0.86 117.98 122.08 3f7k s PHE 43 Ca 0.78 0.98 -0.07 0.00 -0.96 0.00 0.00 56.93 57.66 3f7k s PHE 43 Cb -0.38 0.04 -0.01 0.00 -0.34 0.00 0.00 43.02 42.33 3f7k s PHE 43 CO 0.42 -0.56 0.13 -1.01 -1.46 0.00 0.00 175.22 172.74 3f7k s HIS 44 N 2.51 0.22 -0.17 10.12 3.76 -0.86 -2.70 115.29 128.17 3f7k s HIS 44 Ca 0.06 -0.62 -0.27 0.00 -0.15 0.00 0.00 55.06 54.07 3f7k s HIS 44 Cb -0.14 -0.14 -0.01 0.00 1.11 0.00 0.00 32.58 33.41 3f7k s HIS 44 CO -0.13 -0.46 0.93 0.08 -0.85 0.00 0.00 174.74 174.32 3f7k s VAL 45 N -3.44 4.80 0.22 -0.90 1.01 -0.27 -1.41 120.40 120.41 3f7k s VAL 45 Ca 0.02 1.84 0.05 0.00 0.00 0.00 0.00 61.98 63.89 3f7k s VAL 45 Cb 0.03 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 3f7k s VAL 45 CO -0.09 -0.04 0.32 -1.00 0.00 0.00 0.00 175.10 174.29 3f7k s HIS 46 N 2.45 3.41 0.16 5.22 3.76 0.11 -0.74 115.29 129.66 3f7k s HIS 46 Ca 0.42 0.00 -0.12 0.00 -0.15 0.00 0.00 55.06 55.21 3f7k s HIS 46 Cb -0.16 -1.57 0.04 0.00 1.11 0.00 0.00 32.58 31.99 3f7k s HIS 46 CO 0.12 0.47 1.65 1.49 -0.85 0.00 0.00 174.74 177.61 3f7k h GLU 47 N 1.46 0.89 -5.90 1.40 4.81 -0.94 -2.74 114.58 113.56 3f7k h GLU 47 Ca -0.51 -0.24 -0.67 0.00 -0.13 0.00 0.00 59.36 57.81 3f7k h GLU 47 Cb 1.22 -0.10 -0.22 0.00 0.63 0.00 0.00 28.75 30.28 3f7k h GLU 47 CO 0.63 0.87 -0.72 -0.06 -0.73 0.00 0.00 179.01 179.00 3f7k s PHE 48 N -5.19 2.88 -0.64 0.92 0.08 -0.41 -4.67 117.98 110.95 3f7k s PHE 48 Ca -0.12 -0.18 -0.05 0.00 0.12 0.00 0.00 56.93 56.69 3f7k s PHE 48 Cb 0.12 -1.76 -0.03 0.00 -0.57 0.00 0.00 43.02 40.78 3f7k s PHE 48 CO 0.82 0.15 2.95 0.41 -0.10 0.00 0.00 175.22 179.44 3f7k n GLY 49 N 2.68 4.15 3.09 4.36 0.00 -0.99 -4.04 105.19 114.44 3f7k n GLY 49 Ca -0.18 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 43.82 3f7k n GLY 49 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3f7k s ASP 50 N 1.01 4.65 -0.33 1.61 3.68 -1.26 -4.96 116.67 121.07 3f7k s ASP 50 Ca 0.61 -1.51 0.09 0.00 2.13 0.00 0.00 52.55 53.87 3f7k s ASP 50 Cb 0.30 -1.62 0.63 0.00 -1.45 0.00 0.00 42.92 40.79 3f7k s ASP 50 CO -0.12 -0.25 1.69 -3.20 0.13 0.00 0.00 175.17 173.42 3f7k n ASN 51 N 4.46 3.76 0.25 -0.34 4.05 -1.26 -3.08 115.26 123.10 3f7k n ASN 51 Ca -0.11 -3.46 0.15 0.00 0.45 0.00 0.00 54.58 51.62 3f7k n ASN 51 Cb 0.42 -0.71 0.46 0.00 1.23 0.00 0.00 39.78 41.18 3f7k n ASN 51 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 3f7k h THR 52 N 1.64 0.00 -2.07 -0.44 1.35 -1.93 -3.29 112.91 108.16 3f7k h THR 52 Ca 0.32 -0.71 -0.53 0.00 -0.55 0.00 0.00 66.41 64.94 3f7k h THR 52 Cb 2.18 1.70 -0.40 0.00 -1.73 0.00 0.00 68.15 69.90 3f7k h THR 52 CO 0.67 0.00 -1.01 -3.20 -0.25 0.00 0.00 175.52 171.73 3f7k n ASN 53 N -3.07 1.68 0.00 5.36 5.15 -1.26 -5.04 115.26 118.08 3f7k n ASN 53 Ca 0.02 -3.12 0.00 0.00 -0.60 0.00 0.00 54.58 50.89 3f7k n ASN 53 Cb 0.40 -0.62 0.00 0.00 -0.53 0.00 0.00 39.78 39.03 3f7k n ASN 53 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3f7k n GLY 54 N 0.47 2.41 0.12 8.20 0.00 -1.24 -1.78 105.19 113.37 3f7k n GLY 54 Ca 0.26 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 46.02 3f7k n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f7k h THR 56 N 0.00 1.21 0.00 0.00 2.02 -1.69 -2.63 112.91 111.81 3f7k h THR 56 Ca 0.00 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.44 3f7k h THR 56 Cb 0.80 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3f7k h THR 56 CO 0.00 0.27 0.00 -1.54 0.37 0.00 0.00 175.52 174.62 3f7k n SER 57 N -4.30 0.00 0.08 4.18 3.41 -1.09 -2.58 113.62 113.33 3f7k n SER 57 Ca 0.03 -0.28 0.09 0.00 -0.26 0.00 0.00 58.87 58.46 3f7k n SER 57 Cb 0.21 -0.19 0.41 0.00 -0.26 0.00 0.00 64.21 64.38 3f7k n SER 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f7k n ALA 58 N -1.19 1.52 -0.46 7.33 0.00 -0.99 -4.45 120.51 122.27 3f7k n ALA 58 Ca 0.13 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.62 3f7k n ALA 58 Cb 0.14 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.30 3f7k n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f7k n GLY 59 N -0.31 -0.07 1.91 0.00 0.00 -1.07 -1.28 105.19 104.38 3f7k n GLY 59 Ca 0.02 -0.99 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 3f7k n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f7k n GLY 60 N 0.00 0.49 3.77 -0.02 0.00 -1.26 -4.72 105.19 103.45 3f7k n GLY 60 Ca 0.00 -1.96 -0.40 0.00 0.00 0.00 0.00 46.02 43.66 3f7k n GLY 60 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3f7k s HIS 61 N -1.51 2.61 -0.02 1.61 3.76 -1.26 -0.91 115.29 119.57 3f7k s HIS 61 Ca 0.33 1.30 -0.30 0.00 -0.15 0.00 0.00 55.06 56.24 3f7k s HIS 61 Cb -0.02 -3.85 -0.06 0.00 1.11 0.00 0.00 32.58 29.76 3f7k s HIS 61 CO 0.22 -2.65 1.66 0.12 -0.85 0.00 0.00 174.74 173.25 3f7k s PHE 62 N -1.20 2.08 -0.38 1.40 5.99 0.08 -4.56 117.98 121.39 3f7k s PHE 62 Ca 0.58 0.21 0.12 0.00 0.00 0.00 0.00 56.93 57.84 3f7k s PHE 62 Cb -0.42 -3.93 0.35 0.00 0.00 0.00 0.00 43.02 39.02 3f7k s PHE 62 CO 0.55 -3.89 0.79 -1.71 -0.00 0.00 0.00 175.22 170.96 3f7k n ASN 63 N 6.71 0.52 0.26 6.13 5.15 -1.26 -1.53 115.26 131.24 3f7k n ASN 63 Ca 0.17 -3.06 0.18 0.00 -0.60 0.00 0.00 54.58 51.27 3f7k n ASN 63 Cb 0.42 -0.34 0.85 0.00 -0.53 0.00 0.00 39.78 40.18 3f7k n ASN 63 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3f7k h PRO 64 N 2.99 0.00 -0.37 1.20 0.13 -1.98 -2.57 132.00 131.41 3f7k h PRO 64 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 3f7k h PRO 64 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 3f7k h PRO 64 CO 0.46 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.95 3f7k n HIS 65 N -2.82 0.47 -3.10 1.56 8.25 -1.26 -4.99 115.22 113.33 3f7k n HIS 65 Ca -0.01 -0.28 -0.17 0.00 -0.26 0.00 0.00 57.72 57.00 3f7k n HIS 65 Cb 0.16 -0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.31 3f7k n HIS 65 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3f7k n GLY 66 N 1.26 -0.14 4.01 -1.41 0.00 -0.97 -5.01 105.19 102.92 3f7k n GLY 66 Ca 0.17 -0.05 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 3f7k n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f7k s LYS 67 N -5.73 2.82 0.72 1.61 -0.14 -1.26 -5.12 119.74 112.64 3f7k s LYS 67 Ca 0.34 -1.19 -0.11 0.00 -1.36 0.00 0.00 55.97 53.65 3f7k s LYS 67 Cb -0.15 -2.74 0.02 0.00 -1.68 0.00 0.00 37.83 33.28 3f7k s LYS 67 CO 0.43 -0.30 1.10 -1.21 -0.76 0.00 0.00 175.35 174.61 3f7k s GLU 68 N -4.38 2.75 0.28 1.68 2.02 -1.26 -4.65 118.70 115.13 3f7k s GLU 68 Ca 0.55 0.45 -0.29 0.00 0.02 0.00 0.00 54.97 55.69 3f7k s GLU 68 Cb -0.10 -2.01 -0.10 0.00 0.10 0.00 0.00 34.13 32.02 3f7k s GLU 68 CO 0.33 -1.11 1.36 -1.58 0.02 0.00 0.00 175.26 174.28 3f7k s HIS 69 N -3.36 3.08 0.00 1.61 5.65 -0.56 -2.45 115.29 119.25 3f7k s HIS 69 Ca 0.59 1.24 0.00 0.00 0.25 0.00 0.00 55.06 57.13 3f7k s HIS 69 Cb -0.11 -3.72 0.00 0.00 -1.18 0.00 0.00 32.58 27.57 3f7k s HIS 69 CO 0.52 -2.15 0.00 0.41 -0.65 0.00 0.00 174.74 172.86 3f7k n GLY 70 N 1.62 2.87 3.86 1.59 0.00 -1.25 -4.34 105.19 109.52 3f7k n GLY 70 Ca 0.04 -1.25 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 3f7k n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f7k s ALA 71 N -1.39 3.23 0.47 4.61 0.00 -1.24 -4.72 121.76 122.71 3f7k s ALA 71 Ca 0.00 -0.02 0.21 0.00 0.00 0.00 0.00 51.96 52.15 3f7k s ALA 71 Cb 0.00 -2.89 1.22 0.00 0.00 0.00 0.00 23.12 21.45 3f7k s ALA 71 CO 0.00 -0.08 1.94 -1.35 0.00 0.00 0.00 175.76 176.27 3f7k h PRO 72 N 1.19 0.22 0.00 0.00 0.11 -1.90 -0.94 132.00 130.69 3f7k h PRO 72 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3f7k h PRO 72 Cb 1.19 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3f7k h PRO 72 CO 0.63 0.15 0.00 0.39 -0.21 0.00 0.00 178.00 178.96 3f7k n GLU 73 N -4.43 0.04 -2.99 1.05 4.71 -1.26 -4.88 120.64 112.89 3f7k n GLU 73 Ca 0.14 0.07 -0.30 0.00 -0.01 0.00 0.00 57.16 57.05 3f7k n GLU 73 Cb 0.62 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.52 3f7k n GLU 73 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3f7k s ASP 74 N -2.96 6.51 0.03 1.62 -0.00 -0.36 -4.99 116.67 116.53 3f7k s ASP 74 Ca 0.13 1.03 -0.19 0.00 -0.00 0.00 0.00 52.55 53.53 3f7k s ASP 74 Cb 0.17 -2.28 -0.19 0.00 -0.00 0.00 0.00 42.92 40.62 3f7k s ASP 74 CO 0.45 -0.34 1.21 -0.08 -0.00 0.00 0.00 175.17 176.41 3f7k h GLU 75 N 1.40 0.47 -5.35 8.23 4.22 -1.89 -3.39 114.58 118.27 3f7k h GLU 75 Ca -0.47 -0.39 -0.69 0.00 0.08 0.00 0.00 59.36 57.89 3f7k h GLU 75 Cb 1.19 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 30.38 3f7k h GLU 75 CO 0.64 1.03 1.47 1.21 -2.18 0.00 0.00 179.01 181.18 3f7k s ASN 76 N -6.63 6.80 0.03 1.04 2.47 -1.26 -4.90 114.94 112.50 3f7k s ASN 76 Ca -0.13 -2.34 -0.09 0.00 0.42 0.00 0.00 52.86 50.72 3f7k s ASN 76 Cb 0.05 -2.48 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 3f7k s ASN 76 CO 0.82 -1.07 0.17 0.00 -3.72 0.00 0.00 177.10 173.30 3f7k s ARG 77 N 3.15 0.65 0.49 0.43 1.70 -1.19 -3.91 118.95 120.26 3f7k s ARG 77 Ca 0.44 -0.62 -0.23 0.00 -0.47 0.00 0.00 55.73 54.85 3f7k s ARG 77 Cb -0.01 0.27 -0.07 0.00 -0.57 0.00 0.00 34.95 34.57 3f7k s ARG 77 CO -0.02 -0.18 1.23 -1.01 -1.08 0.00 0.00 175.30 174.24 3f7k s HIS 78 N -2.43 2.69 0.46 5.89 3.76 -1.02 -4.65 115.29 119.98 3f7k s HIS 78 Ca -0.06 1.48 0.20 0.00 -0.15 0.00 0.00 55.06 56.53 3f7k s HIS 78 Cb -0.02 -3.52 1.17 0.00 1.11 0.00 0.00 32.58 31.32 3f7k s HIS 78 CO -0.03 -1.96 1.91 0.00 -0.85 0.00 0.00 174.74 173.81 3f7k h ALA 79 N 1.88 2.29 -0.06 -1.40 0.00 -1.86 -1.77 119.26 118.34 3f7k h ALA 79 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3f7k h ALA 79 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3f7k h ALA 79 CO 0.59 -0.51 0.00 0.41 0.00 0.00 0.00 179.25 179.75 3f7k n GLY 80 N -1.56 -0.55 3.55 0.00 0.00 -0.58 -4.26 105.19 101.78 3f7k n GLY 80 Ca 0.15 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 3f7k n GLY 80 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3f7k s ASP 81 N -1.60 6.29 -0.05 1.61 1.01 -0.67 -1.12 116.67 122.15 3f7k s ASP 81 Ca 0.30 -0.29 0.14 0.00 0.71 0.00 0.00 52.55 53.41 3f7k s ASP 81 Cb 0.15 -2.53 0.44 0.00 1.01 0.00 0.00 42.92 41.99 3f7k s ASP 81 CO 0.24 -1.60 1.37 0.18 0.21 0.00 0.00 175.17 175.56 3f7k n LEU 82 N 8.67 3.46 0.00 1.23 4.77 -1.10 -3.96 117.00 130.07 3f7k n LEU 82 Ca 0.04 -2.26 0.00 0.00 -0.03 0.00 0.00 56.01 53.77 3f7k n LEU 82 Cb 0.48 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 3f7k n LEU 82 CO 0.70 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 178.13 3f7k n GLY 83 N 0.51 0.89 3.51 -0.72 0.00 -1.21 -4.80 105.19 103.38 3f7k n GLY 83 Ca 0.17 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 3f7k n GLY 83 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3f7k s ASN 84 N -4.00 4.08 0.18 1.61 0.01 -1.26 -1.19 114.94 114.37 3f7k s ASN 84 Ca 0.00 -0.34 -0.04 0.00 -0.71 0.00 0.00 52.86 51.77 3f7k s ASN 84 Cb 0.00 -0.76 -0.05 0.00 0.41 0.00 0.00 41.25 40.85 3f7k s ASN 84 CO 0.00 0.26 0.40 0.68 -1.51 0.00 0.00 177.10 176.93 3f7k s VAL 85 N -0.97 5.16 -0.31 1.60 -7.23 -0.07 -4.90 120.40 113.68 3f7k s VAL 85 Ca 0.16 -0.08 -0.02 0.00 -1.81 0.00 0.00 61.98 60.23 3f7k s VAL 85 Cb -0.11 -3.67 0.05 0.00 0.56 0.00 0.00 36.38 33.22 3f7k s VAL 85 CO 0.07 -0.07 0.01 -0.69 -0.31 0.00 0.00 175.10 174.10 3f7k s VAL 86 N -1.78 2.96 0.06 1.32 1.01 -1.26 -1.08 120.40 121.64 3f7k s VAL 86 Ca 0.41 -1.45 -0.28 0.00 0.00 0.00 0.00 61.98 60.66 3f7k s VAL 86 Cb -0.12 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.48 3f7k s VAL 86 CO 0.27 -0.15 0.89 0.00 0.00 0.00 0.00 175.10 176.11 3f7k s ALA 87 N 1.23 3.27 1.19 5.51 0.00 0.05 -4.25 121.76 128.76 3f7k s ALA 87 Ca -0.04 0.46 -0.18 0.00 0.00 0.00 0.00 51.96 52.20 3f7k s ALA 87 Cb -0.20 -3.19 0.26 0.00 0.00 0.00 0.00 23.12 19.99 3f7k s ALA 87 CO -0.01 -0.05 0.98 0.41 0.00 0.00 0.00 175.76 177.09 3f7k n GLY 88 N 2.47 -2.58 0.33 0.00 0.00 -0.33 -1.03 105.19 104.06 3f7k n GLY 88 Ca 0.01 -1.52 0.17 0.00 0.00 0.00 0.00 46.02 44.69 3f7k n GLY 88 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3f7k h GLU 89 N 0.00 0.00 -0.11 1.61 4.39 -1.96 -0.02 114.58 118.48 3f7k h GLU 89 Ca -0.36 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.34 3f7k h GLU 89 Cb 1.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 3f7k h GLU 89 CO 0.24 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 177.69 3f7k n ASP 90 N -3.63 1.12 0.00 1.42 5.75 -1.26 -4.79 116.55 115.16 3f7k n ASP 90 Ca 0.00 -1.61 0.00 0.00 -0.01 0.00 0.00 54.79 53.17 3f7k n ASP 90 Cb 0.27 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 3f7k n ASP 90 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3f7k n GLY 91 N 1.02 0.61 3.35 6.12 0.00 -0.02 -4.76 105.19 111.50 3f7k n GLY 91 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3f7k n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f7k s LYS 92 N -0.21 3.20 -0.06 1.61 1.02 -1.26 -1.78 119.74 122.27 3f7k s LYS 92 Ca 0.00 -0.73 0.03 0.00 0.02 0.00 0.00 55.97 55.28 3f7k s LYS 92 Cb 0.00 -2.52 -0.03 0.00 -0.52 0.00 0.00 37.83 34.76 3f7k s LYS 92 CO 0.00 0.26 -0.12 0.00 -0.92 0.00 0.00 175.35 174.57 3f7k s ALA 93 N 0.22 2.78 -0.09 5.17 0.00 0.36 -1.19 121.76 129.01 3f7k s ALA 93 Ca -0.10 -0.95 0.04 0.00 0.00 0.00 0.00 51.96 50.95 3f7k s ALA 93 Cb -0.16 -1.06 0.00 0.00 0.00 0.00 0.00 23.12 21.90 3f7k s ALA 93 CO 0.06 0.56 -0.22 0.08 0.00 0.00 0.00 175.76 176.24 3f7k s VAL 94 N -0.76 1.86 0.05 0.00 1.01 -1.26 -0.51 120.40 120.79 3f7k s VAL 94 Ca 0.12 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.24 3f7k s VAL 94 Cb -0.11 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 3f7k s VAL 94 CO 0.01 0.52 -0.07 -0.51 0.00 0.00 0.00 175.10 175.04 3f7k s ILE 95 N 0.37 3.56 -0.41 2.22 2.07 -0.12 -4.79 121.20 124.10 3f7k s ILE 95 Ca -0.17 -0.99 0.07 0.00 -1.41 0.00 0.00 60.65 58.15 3f7k s ILE 95 Cb -0.17 -2.60 0.18 0.00 0.13 0.00 0.00 42.46 39.99 3f7k s ILE 95 CO 0.08 0.26 0.58 0.21 -1.91 0.00 0.00 174.94 174.16 3f7k s ASN 96 N -1.80 -0.89 -0.03 4.50 2.47 -1.22 -1.82 114.94 116.15 3f7k s ASN 96 Ca 0.20 -1.09 0.02 0.00 0.42 0.00 0.00 52.86 52.41 3f7k s ASN 96 Cb -0.11 1.61 0.01 0.00 -1.45 0.00 0.00 41.25 41.31 3f7k s ASN 96 CO 0.11 -0.18 -0.07 -0.32 -3.72 0.00 0.00 177.10 172.92 3f7k s MET 97 N 1.63 0.89 -0.15 0.43 -2.45 -0.41 -4.99 119.30 114.25 3f7k s MET 97 Ca 0.18 -0.22 -0.02 0.00 -1.25 0.00 0.00 55.69 54.37 3f7k s MET 97 Cb -0.06 -0.85 -0.02 0.00 1.25 0.00 0.00 34.83 35.15 3f7k s MET 97 CO -0.06 0.04 -0.07 0.15 1.05 0.00 0.00 175.02 176.13 3f7k s LYS 98 N 0.45 3.56 -0.02 4.11 1.02 -1.26 0.15 119.74 127.74 3f7k s LYS 98 Ca -0.07 -0.58 0.03 0.00 0.02 0.00 0.00 55.97 55.38 3f7k s LYS 98 Cb -0.10 -2.82 -0.00 0.00 -0.52 0.00 0.00 37.83 34.39 3f7k s LYS 98 CO 0.01 0.22 -0.11 0.34 -0.92 0.00 0.00 175.35 174.89 3f7k s ASP 99 N 0.38 1.41 0.18 2.83 -1.08 -0.21 -4.95 116.67 115.22 3f7k s ASP 99 Ca -0.06 -0.22 0.23 0.00 -0.52 0.00 0.00 52.55 51.98 3f7k s ASP 99 Cb -0.15 -0.30 0.14 0.00 -1.46 0.00 0.00 42.92 41.15 3f7k s ASP 99 CO 0.04 0.11 1.17 0.07 0.52 0.00 0.00 175.17 177.07 3f7k h LYS 100 N 6.17 0.00 0.00 4.34 2.10 -1.89 -1.84 116.57 125.45 3f7k h LYS 100 Ca -0.33 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.24 3f7k h LYS 100 Cb 1.17 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.48 3f7k h LYS 100 CO 0.49 0.00 -1.89 1.28 -2.00 0.00 0.00 179.45 177.33 3f7k n LEU 101 N -2.45 0.19 -4.71 7.07 4.77 -1.26 -4.86 117.00 115.75 3f7k n LEU 101 Ca 0.01 0.08 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 3f7k n LEU 101 Cb 0.50 0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.66 3f7k n LEU 101 CO 0.38 0.08 1.01 -0.69 -1.33 0.00 0.00 177.39 176.85 3f7k s VAL 102 N -3.25 3.60 0.07 4.08 1.01 -1.26 -4.94 120.40 119.71 3f7k s VAL 102 Ca -0.07 1.13 0.06 0.00 0.00 0.00 0.00 61.98 63.10 3f7k s VAL 102 Cb 0.11 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 3f7k s VAL 102 CO 0.87 0.08 -0.17 -0.54 0.00 0.00 0.00 175.10 175.33 3f7k s LYS 103 N 1.27 1.02 -0.05 2.72 -0.14 -1.26 -4.29 119.74 119.01 3f7k s LYS 103 Ca 0.62 -0.96 0.10 0.00 -1.36 0.00 0.00 55.97 54.37 3f7k s LYS 103 Cb -0.34 -1.13 0.29 0.00 -1.68 0.00 0.00 37.83 34.97 3f7k s LYS 103 CO 0.29 0.27 1.22 1.28 -0.76 0.00 0.00 175.35 177.66 3f7k n LEU 104 N 1.47 2.88 -3.60 3.17 4.77 -1.26 -0.77 117.00 123.65 3f7k n LEU 104 Ca -0.19 -2.32 -0.10 0.00 -0.03 0.00 0.00 56.01 53.37 3f7k n LEU 104 Cb 0.54 -0.27 -0.02 0.00 -2.33 0.00 0.00 43.42 41.34 3f7k n LEU 104 CO 0.22 0.67 0.45 0.28 -1.33 0.00 0.00 177.39 177.68 3f7k s THR 105 N -1.57 0.00 0.00 -5.08 -1.32 -1.26 -4.81 115.64 101.60 3f7k s THR 105 Ca 0.23 -0.39 0.00 0.00 -1.21 0.00 0.00 61.69 60.31 3f7k s THR 105 Cb 0.16 -1.41 0.00 0.00 -1.51 0.00 0.00 72.50 69.74 3f7k s THR 105 CO 0.10 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.12 3f7k n GLY 106 N -0.41 -2.20 0.29 6.08 0.00 -1.26 -3.86 105.19 103.83 3f7k n GLY 106 Ca -0.11 -1.54 0.16 0.00 0.00 0.00 0.00 46.02 44.52 3f7k n GLY 106 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3f7k h PRO 107 N 0.00 0.00 -0.48 1.61 0.13 -2.01 -2.05 132.00 129.20 3f7k h PRO 107 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.98 3f7k h PRO 107 Cb 0.00 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.04 3f7k h PRO 107 CO 0.00 0.05 0.10 -0.25 -0.23 0.00 0.00 178.00 177.67 3f7k n ASP 108 N -3.57 3.77 -4.74 1.44 8.00 -1.26 -5.00 116.55 115.18 3f7k n ASP 108 Ca -0.02 -3.34 -0.41 0.00 0.71 0.00 0.00 54.79 51.73 3f7k n ASP 108 Cb 0.16 -0.65 0.00 0.00 -0.02 0.00 0.00 41.12 40.61 3f7k n ASP 108 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3f7k n SER 109 N -0.62 3.21 -1.00 -2.24 2.88 -0.77 -4.03 113.62 111.05 3f7k n SER 109 Ca 0.33 1.18 0.12 0.00 -1.33 0.00 0.00 58.87 59.17 3f7k n SER 109 Cb 1.13 -1.56 0.18 0.00 -0.75 0.00 0.00 64.21 63.21 3f7k n SER 109 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3f7k n VAL 110 N 0.15 0.21 -1.70 2.46 0.24 0.05 -4.91 118.33 114.84 3f7k n VAL 110 Ca 0.04 -0.58 -0.44 0.00 -2.04 0.00 0.00 64.34 61.32 3f7k n VAL 110 Cb 0.39 1.19 -0.03 0.00 -1.47 0.00 0.00 33.84 33.92 3f7k n VAL 110 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 3f7k n ILE 111 N 1.30 0.48 -0.94 1.34 2.08 -1.26 -1.24 119.36 121.11 3f7k n ILE 111 Ca 0.17 -0.12 0.00 0.00 0.56 0.00 0.00 62.75 63.36 3f7k n ILE 111 Cb 0.58 -1.73 0.00 0.00 -0.75 0.00 0.00 39.64 37.74 3f7k n ILE 111 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3f7k n GLY 112 N 2.93 0.83 0.00 7.39 0.00 0.61 -5.00 105.19 111.95 3f7k n GLY 112 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3f7k n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f7k n ARG 113 N -2.31 2.10 -4.52 1.61 1.74 -0.37 -2.33 116.66 112.57 3f7k n ARG 113 Ca 0.00 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 3f7k n ARG 113 Cb 0.00 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 31.30 3f7k n ARG 113 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3f7k s THR 114 N 1.33 1.11 -0.13 0.55 2.01 -1.03 -0.51 115.64 118.97 3f7k s THR 114 Ca 0.00 -0.76 -0.07 0.00 0.31 0.00 0.00 61.69 61.16 3f7k s THR 114 Cb 0.00 -0.96 -0.04 0.00 0.01 0.00 0.00 72.50 71.51 3f7k s THR 114 CO 0.00 0.18 0.13 -0.76 -0.69 0.00 0.00 174.62 173.48 3f7k s LEU 115 N -0.67 4.31 -0.05 4.42 1.43 -0.67 0.05 118.68 127.51 3f7k s LEU 115 Ca 0.04 0.42 0.04 0.00 -1.03 0.00 0.00 54.13 53.59 3f7k s LEU 115 Cb -0.06 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 44.10 3f7k s LEU 115 CO 0.00 0.38 -0.15 -0.69 0.23 0.00 0.00 176.35 176.12 3f7k s VAL 116 N -0.82 1.28 -0.07 -1.59 1.01 -0.50 -1.94 120.40 117.77 3f7k s VAL 116 Ca 0.14 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.51 3f7k s VAL 116 Cb -0.12 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 3f7k s VAL 116 CO 0.03 0.38 -0.07 0.54 0.00 0.00 0.00 175.10 175.98 3f7k s VAL 117 N 0.21 3.66 0.26 2.92 0.11 -0.67 -2.02 120.40 124.87 3f7k s VAL 117 Ca -0.07 -0.49 0.08 0.00 -2.93 0.00 0.00 61.98 58.57 3f7k s VAL 117 Cb -0.12 -2.50 -0.04 0.00 -1.53 0.00 0.00 36.38 32.19 3f7k s VAL 117 CO 0.02 0.59 0.14 -1.00 -3.33 0.00 0.00 175.10 171.52 3f7k s HIS 118 N -0.73 2.98 0.17 1.54 3.76 -0.04 -1.00 115.29 121.97 3f7k s HIS 118 Ca 0.11 -0.15 -0.14 0.00 -0.15 0.00 0.00 55.06 54.73 3f7k s HIS 118 Cb -0.11 -1.34 0.10 0.00 1.11 0.00 0.00 32.58 32.33 3f7k s HIS 118 CO 0.01 0.55 1.78 0.28 -0.85 0.00 0.00 174.74 176.51 3f7k h VAL 119 N 1.61 0.97 -1.57 -0.90 2.07 -1.08 -3.38 116.25 113.97 3f7k h VAL 119 Ca -0.47 -0.16 -0.57 0.00 0.82 0.00 0.00 66.70 66.32 3f7k h VAL 119 Cb 1.24 0.47 -0.09 0.00 -1.52 0.00 0.00 31.29 31.40 3f7k h VAL 119 CO 0.61 0.08 -0.50 -1.81 0.02 0.00 0.00 177.57 175.97 3f7k s ASP 120 N -5.48 4.41 0.40 0.57 1.01 -0.54 -4.92 116.67 112.13 3f7k s ASP 120 Ca -0.13 -1.09 -0.26 0.00 0.71 0.00 0.00 52.55 51.77 3f7k s ASP 120 Cb 0.13 -0.46 -0.09 0.00 1.01 0.00 0.00 42.92 43.51 3f7k s ASP 120 CO 0.73 -0.55 1.34 -0.70 0.21 0.00 0.00 175.17 176.20 3f7k s GLU 121 N -3.91 3.98 -0.26 8.23 2.12 -1.16 -1.17 118.70 126.54 3f7k s GLU 121 Ca 0.41 2.25 -0.26 0.00 0.36 0.00 0.00 54.97 57.73 3f7k s GLU 121 Cb 0.04 -2.80 0.00 0.00 0.26 0.00 0.00 34.13 31.63 3f7k s GLU 121 CO 0.22 -0.52 0.91 0.34 -0.54 0.00 0.00 175.26 175.67 3f7k s ASP 122 N -0.61 6.89 0.00 -1.70 3.68 -1.26 -4.02 116.67 119.65 3f7k s ASP 122 Ca 0.56 1.07 0.13 0.00 2.13 0.00 0.00 52.55 56.45 3f7k s ASP 122 Cb -0.40 -2.47 0.75 0.00 -1.45 0.00 0.00 42.92 39.35 3f7k s ASP 122 CO 0.52 -0.61 1.49 -0.90 0.13 0.00 0.00 175.17 175.80 3f7k n ASP 123 N 6.22 0.08 -1.31 -0.34 3.85 0.27 -4.86 116.55 120.45 3f7k n ASP 123 Ca 0.08 -1.61 -0.16 0.00 -0.71 0.00 0.00 54.79 52.38 3f7k n ASP 123 Cb 0.47 -0.01 -0.06 0.00 -1.35 0.00 0.00 41.12 40.17 3f7k n ASP 123 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3f7k n LEU 124 N -0.65 -1.24 0.00 -2.12 4.77 -1.26 -1.83 117.00 114.66 3f7k n LEU 124 Ca 0.10 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 3f7k n LEU 124 Cb 0.06 -2.34 0.00 0.00 -2.33 0.00 0.00 43.42 38.80 3f7k n LEU 124 CO 0.07 -0.77 0.00 0.61 -1.33 0.00 0.00 177.39 175.97 3f7k n GLY 125 N -0.99 0.82 0.36 -0.72 0.00 -1.24 -3.62 105.19 99.80 3f7k n GLY 125 Ca -0.17 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.89 3f7k n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f7k n ARG 126 N -2.00 2.07 0.05 1.61 1.74 -0.76 -4.46 116.66 114.91 3f7k n ARG 126 Ca 0.00 -1.57 0.13 0.00 -0.77 0.00 0.00 57.85 55.63 3f7k n ARG 126 Cb 0.00 -1.16 0.50 0.00 -1.02 0.00 0.00 32.46 30.78 3f7k n ARG 126 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3f7k n GLY 127 N 0.20 -1.53 2.20 -0.13 0.00 -1.25 -4.94 105.19 99.75 3f7k n GLY 127 Ca 0.06 -0.05 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 3f7k n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f7k n GLY 128 N 1.19 0.60 3.93 -0.02 0.00 -1.26 -5.05 105.19 104.58 3f7k n GLY 128 Ca 0.06 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 3f7k n GLY 128 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3f7k s HIS 129 N -2.33 3.38 0.30 1.61 3.76 -1.26 -5.01 115.29 115.74 3f7k s HIS 129 Ca 0.00 -0.01 0.02 0.00 -0.15 0.00 0.00 55.06 54.92 3f7k s HIS 129 Cb 0.00 -1.56 0.57 0.00 1.11 0.00 0.00 32.58 32.70 3f7k s HIS 129 CO 0.00 0.48 1.89 1.49 -0.85 0.00 0.00 174.74 177.75 3f7k h GLU 130 N 1.54 0.96 -0.01 1.40 4.81 -2.03 -1.65 114.58 119.59 3f7k h GLU 130 Ca -0.50 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 3f7k h GLU 130 Cb 1.22 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.39 3f7k h GLU 130 CO 0.63 0.63 -0.03 1.04 -0.73 0.00 0.00 179.01 180.55 3f7k n GLN 131 N -4.52 1.34 -0.19 1.92 1.13 -1.26 -4.36 117.38 111.43 3f7k n GLN 131 Ca 0.15 -0.61 -0.01 0.00 -1.94 0.00 0.00 57.00 54.59 3f7k n GLN 131 Cb 0.26 -1.49 0.09 0.00 0.11 0.00 0.00 30.24 29.22 3f7k n GLN 131 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 3f7k h SER 132 N 1.48 0.18 -0.17 1.08 0.02 -1.61 0.13 113.55 114.66 3f7k h SER 132 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3f7k h SER 132 Cb 0.36 0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.96 3f7k h SER 132 CO 0.00 0.12 0.00 0.29 -1.14 0.00 0.00 176.83 176.10 3f7k n LYS 133 N -5.01 1.50 -0.07 3.45 5.02 -1.26 -1.47 118.16 120.31 3f7k n LYS 133 Ca 0.07 -0.77 -0.15 0.00 -2.02 0.00 0.00 58.31 55.44 3f7k n LYS 133 Cb 0.25 -1.26 -0.05 0.00 -0.02 0.00 0.00 35.03 33.94 3f7k n LYS 133 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3f7k n ILE 134 N 0.05 0.80 -0.34 -0.18 5.41 -0.60 -1.50 119.36 123.01 3f7k n ILE 134 Ca 0.11 -0.20 0.00 0.00 1.00 0.00 0.00 62.75 63.67 3f7k n ILE 134 Cb 0.21 -1.70 0.00 0.00 -0.71 0.00 0.00 39.64 37.44 3f7k n ILE 134 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3f7k n THR 135 N -3.65 0.00 -1.01 1.39 -2.24 0.37 -4.66 114.28 104.48 3f7k n THR 135 Ca -0.28 -0.21 -0.00 0.00 -2.27 0.00 0.00 64.05 61.29 3f7k n THR 135 Cb 0.70 1.34 -0.00 0.00 -2.10 0.00 0.00 70.33 70.27 3f7k n THR 135 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f7k n GLY 136 N 0.17 0.47 4.03 3.38 0.00 -0.54 -3.63 105.19 109.07 3f7k n GLY 136 Ca 0.00 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 3f7k n GLY 136 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3f7k n ASN 137 N 0.21 -3.31 -0.32 1.61 5.15 -1.21 -0.57 115.26 116.81 3f7k n ASN 137 Ca -0.00 -0.91 0.12 0.00 -0.60 0.00 0.00 54.58 53.18 3f7k n ASN 137 Cb 0.05 -3.32 0.52 0.00 -0.53 0.00 0.00 39.78 36.50 3f7k n ASN 137 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3f7k n ALA 138 N -4.50 2.58 -0.47 5.20 0.00 -1.24 -4.75 120.51 117.32 3f7k n ALA 138 Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.06 3f7k n ALA 138 Cb 0.54 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.78 3f7k n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f7k n GLY 139 N 1.03 -0.30 3.65 0.00 0.00 -1.26 -1.47 105.19 106.84 3f7k n GLY 139 Ca 0.17 -1.07 -0.30 0.00 0.00 0.00 0.00 46.02 44.82 3f7k n GLY 139 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3f7k s GLY 140 N -1.81 1.64 -0.27 -0.02 0.00 -1.26 -4.68 107.32 100.92 3f7k s GLY 140 Ca 0.00 -1.13 -0.04 0.00 0.00 0.00 0.00 44.72 43.55 3f7k s GLY 140 CO 0.00 -0.21 0.01 0.50 0.00 0.00 0.00 173.10 173.39 3f7k s ARG 141 N -5.61 2.92 0.04 2.90 0.52 -1.26 -0.87 118.95 117.58 3f7k s ARG 141 Ca 0.73 -0.94 -0.11 0.00 -0.52 0.00 0.00 55.73 54.89 3f7k s ARG 141 Cb -0.06 -3.17 -0.33 0.00 0.52 0.00 0.00 34.95 31.91 3f7k s ARG 141 CO 0.55 -0.43 1.01 -0.07 0.02 0.00 0.00 175.30 176.38 3f7k h LEU 142 N 8.11 0.68 -7.00 2.53 3.38 -1.37 -3.43 115.31 118.22 3f7k h LEU 142 Ca -0.31 -0.76 0.02 0.00 0.09 0.00 0.00 57.88 56.92 3f7k h LEU 142 Cb 1.11 -0.22 -0.16 0.00 0.09 0.00 0.00 40.66 41.48 3f7k h LEU 142 CO 0.58 1.60 0.33 0.00 0.09 0.00 0.00 178.44 181.05 3f7k s ALA 143 N -2.62 -1.75 0.20 1.53 0.00 -1.20 -3.39 121.76 114.54 3f7k s ALA 143 Ca -0.08 0.97 -0.21 0.00 0.00 0.00 0.00 51.96 52.64 3f7k s ALA 143 Cb 0.05 0.35 0.05 0.00 0.00 0.00 0.00 23.12 23.57 3f7k s ALA 143 CO 0.92 -0.60 0.62 0.00 0.00 0.00 0.00 175.76 176.69 3f7k s GLY 145 N -2.83 -0.50 0.17 0.00 0.00 -0.82 -1.47 107.32 101.88 3f7k s GLY 145 Ca 0.06 0.64 -0.30 0.00 0.00 0.00 0.00 44.72 45.12 3f7k s GLY 145 CO -0.05 0.33 1.00 0.14 0.00 0.00 0.00 173.10 174.52 3f7k s VAL 146 N -2.70 4.18 -0.32 1.40 1.01 -1.26 -1.66 120.40 121.05 3f7k s VAL 146 Ca -0.04 1.93 -0.28 0.00 0.00 0.00 0.00 61.98 63.59 3f7k s VAL 146 Cb -0.00 -4.23 0.02 0.00 0.00 0.00 0.00 36.38 32.16 3f7k s VAL 146 CO -0.04 0.35 1.03 -0.63 0.00 0.00 0.00 175.10 175.81 3f7k s ILE 147 N -0.39 4.55 0.24 2.22 1.01 0.34 -4.51 121.20 124.66 3f7k s ILE 147 Ca 0.46 1.62 0.10 0.00 0.00 0.00 0.00 60.65 62.84 3f7k s ILE 147 Cb -0.26 -4.38 -0.05 0.00 0.01 0.00 0.00 42.46 37.79 3f7k s ILE 147 CO 0.32 -0.46 -0.11 -0.83 0.00 0.00 0.00 174.94 173.86 3f7k s GLY 148 N 1.68 1.75 0.13 6.18 0.00 -0.18 -0.29 107.32 116.59 3f7k s GLY 148 Ca 0.43 -1.68 -0.30 0.00 0.00 0.00 0.00 44.72 43.17 3f7k s GLY 148 CO 0.15 -1.74 1.23 -0.42 0.00 0.00 0.00 173.10 172.33 3f7k s ILE 149 N -2.17 3.66 0.36 0.90 1.01 -1.26 -0.69 121.20 123.01 3f7k s ILE 149 Ca 0.28 1.29 0.04 0.00 0.00 0.00 0.00 60.65 62.26 3f7k s ILE 149 Cb -0.07 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.54 3f7k s ILE 149 CO 0.16 0.15 0.12 0.28 0.00 0.00 0.00 174.94 175.65 3f7k s THR 150 N 0.50 0.69 -2.00 2.92 -1.32 -0.62 -4.84 115.64 110.97 3f7k s THR 150 Ca 0.57 -2.00 0.23 0.00 -1.21 0.00 0.00 61.69 59.28 3f7k s THR 150 Cb -0.32 -2.50 0.66 0.00 -1.51 0.00 0.00 72.50 68.83 3f7k s THR 150 CO 0.33 0.00 1.75 2.29 -2.21 0.00 0.00 174.62 176.79