#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fng s LYS 2 N 0.00 0.22 -0.53 9.51 2.20 -1.26 -5.12 119.74 124.76 1fng s LYS 2 Ca 0.00 0.73 -0.10 0.00 -0.36 0.00 0.00 55.97 56.23 1fng s LYS 2 Cb 0.00 -0.01 0.13 0.00 -1.51 0.00 0.00 37.83 36.44 1fng s LYS 2 CO 0.00 -0.23 0.42 -1.21 -0.36 0.00 0.00 175.35 173.97 1fng s GLU 3 N 1.98 2.69 -0.27 4.03 0.41 -1.26 -5.05 118.70 121.23 1fng s GLU 3 Ca -0.04 -1.88 -0.15 0.00 -0.41 0.00 0.00 54.97 52.49 1fng s GLU 3 Cb -0.11 -4.03 -0.04 0.00 -1.78 0.00 0.00 34.13 28.17 1fng s GLU 3 CO -0.10 -1.23 0.39 -1.21 -0.49 0.00 0.00 175.26 172.63 1fng s GLU 4 N 1.19 4.03 0.22 1.61 2.02 -1.26 -5.05 118.70 121.46 1fng s GLU 4 Ca 0.07 0.08 -0.11 0.00 0.02 0.00 0.00 54.97 55.04 1fng s GLU 4 Cb -0.25 -3.65 -0.01 0.00 0.10 0.00 0.00 34.13 30.32 1fng s GLU 4 CO -0.01 -0.28 0.39 -1.01 0.02 0.00 0.00 175.26 174.37 1fng s HIS 5 N 2.08 0.44 -0.07 1.61 3.76 -1.26 -5.09 115.29 116.76 1fng s HIS 5 Ca 0.16 -0.79 -0.03 0.00 -0.15 0.00 0.00 55.06 54.25 1fng s HIS 5 Cb -0.16 0.04 0.04 0.00 1.11 0.00 0.00 32.58 33.61 1fng s HIS 5 CO 0.10 -0.87 0.17 0.99 -0.85 0.00 0.00 174.74 174.27 1fng s THR 6 N -4.01 -0.05 -0.08 1.30 2.01 -1.26 -5.01 115.64 108.54 1fng s THR 6 Ca 0.22 0.17 0.03 0.00 0.31 0.00 0.00 61.69 62.42 1fng s THR 6 Cb 0.01 -0.27 -0.02 0.00 0.01 0.00 0.00 72.50 72.24 1fng s THR 6 CO 0.06 0.07 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.25 1fng s ILE 7 N 1.15 2.67 -0.06 1.82 1.01 -1.26 -0.97 121.20 125.56 1fng s ILE 7 Ca -0.09 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 59.75 1fng s ILE 7 Cb -0.11 -2.05 0.01 0.00 0.01 0.00 0.00 42.46 40.33 1fng s ILE 7 CO -0.06 0.56 -0.10 -0.63 0.00 0.00 0.00 174.94 174.71 1fng s ILE 8 N -0.16 0.96 -0.28 2.92 1.01 0.39 -4.96 121.20 121.08 1fng s ILE 8 Ca -0.02 -0.39 -0.11 0.00 0.00 0.00 0.00 60.65 60.14 1fng s ILE 8 Cb -0.14 -0.89 -0.05 0.00 0.01 0.00 0.00 42.46 41.39 1fng s ILE 8 CO 0.04 0.31 0.18 -1.58 0.00 0.00 0.00 174.94 173.89 1fng s GLN 9 N 0.67 3.94 -0.10 2.79 0.74 -1.26 -0.34 119.66 126.10 1fng s GLN 9 Ca -0.13 -0.32 0.04 0.00 0.05 0.00 0.00 55.36 54.99 1fng s GLN 9 Cb -0.15 -3.64 0.00 0.00 1.10 0.00 0.00 33.01 30.32 1fng s GLN 9 CO 0.03 -0.17 -0.22 0.00 -0.55 0.00 0.00 175.29 174.37 1fng s ALA 10 N 1.71 2.08 0.02 1.58 0.00 -0.20 -5.00 121.76 121.95 1fng s ALA 10 Ca 0.07 -0.93 -0.10 0.00 0.00 0.00 0.00 51.96 51.00 1fng s ALA 10 Cb -0.16 -0.81 0.01 0.00 0.00 0.00 0.00 23.12 22.16 1fng s ALA 10 CO 0.10 0.23 0.21 -1.83 0.00 0.00 0.00 175.76 174.47 1fng s GLU 11 N 0.44 0.64 0.23 0.00 -1.05 -1.26 -1.47 118.70 116.23 1fng s GLU 11 Ca -0.17 -0.46 -0.20 0.00 -0.15 0.00 0.00 54.97 53.99 1fng s GLU 11 Cb -0.17 0.27 0.03 0.00 -0.44 0.00 0.00 34.13 33.82 1fng s GLU 11 CO 0.07 -0.18 0.63 -0.59 0.95 0.00 0.00 175.26 176.14 1fng s PHE 12 N -1.97 -0.19 -0.02 4.83 -0.12 -0.76 -4.97 117.98 114.78 1fng s PHE 12 Ca -0.10 -0.18 0.01 0.00 -0.05 0.00 0.00 56.93 56.61 1fng s PHE 12 Cb -0.04 0.56 0.02 0.00 -0.63 0.00 0.00 43.02 42.93 1fng s PHE 12 CO -0.01 -1.07 -0.01 -0.47 -0.05 0.00 0.00 175.22 173.61 1fng s TYR 13 N -3.88 0.33 -0.05 3.49 5.04 -1.26 -1.73 117.35 119.29 1fng s TYR 13 Ca 0.10 -0.03 0.05 0.00 -2.44 0.00 0.00 57.07 54.74 1fng s TYR 13 Cb -0.03 -0.35 -0.01 0.00 0.35 0.00 0.00 41.96 41.92 1fng s TYR 13 CO 0.01 -0.09 -0.21 -1.17 -1.34 0.00 0.00 175.55 172.75 1fng s LEU 14 N 0.62 1.99 0.19 6.97 2.96 0.11 -4.97 118.68 126.55 1fng s LEU 14 Ca -0.06 -0.43 0.10 0.00 -0.22 0.00 0.00 54.13 53.53 1fng s LEU 14 Cb -0.09 -1.16 -0.04 0.00 0.50 0.00 0.00 46.19 45.40 1fng s LEU 14 CO -0.01 0.20 -0.22 -0.76 -1.32 0.00 0.00 176.35 174.24 1fng s LEU 15 N -0.05 2.45 0.00 -0.68 1.43 -1.26 -0.30 118.68 120.27 1fng s LEU 15 Ca -0.04 -0.88 0.30 0.00 -1.03 0.00 0.00 54.13 52.48 1fng s LEU 15 Cb -0.13 -1.04 1.50 0.00 0.03 0.00 0.00 46.19 46.56 1fng s LEU 15 CO 0.03 0.06 2.04 -0.81 0.23 0.00 0.00 176.35 177.89 1fng n PRO 16 N 0.17 0.50 0.12 1.29 -0.04 -1.26 -4.85 135.00 130.94 1fng n PRO 16 Ca -0.12 -0.03 0.20 0.00 -0.04 0.00 0.00 63.50 63.51 1fng n PRO 16 Cb 0.57 -1.50 0.76 0.00 -0.04 0.00 0.00 33.50 33.29 1fng n PRO 16 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1fng h ASP 17 N 0.08 0.00 -5.72 3.54 5.19 -2.03 -3.45 116.42 114.03 1fng h ASP 17 Ca 0.00 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 56.07 1fng h ASP 17 Cb 0.28 0.00 0.15 0.00 0.18 0.00 0.00 39.33 39.94 1fng h ASP 17 CO 0.00 0.00 -0.79 0.29 -3.12 0.00 0.00 179.24 175.62 1fng n LYS 18 N -3.66 -5.92 -4.92 3.56 5.02 0.59 -5.01 118.16 107.81 1fng n LYS 18 Ca 0.06 0.81 -0.27 0.00 -2.02 0.00 0.00 58.31 56.89 1fng n LYS 18 Cb 0.58 -5.73 -0.15 0.00 -0.02 0.00 0.00 35.03 29.71 1fng n LYS 18 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1fng s ARG 19 N -5.40 1.59 0.38 1.97 1.70 -0.87 -4.95 118.95 113.37 1fng s ARG 19 Ca 0.04 -0.76 0.04 0.00 -0.47 0.00 0.00 55.73 54.57 1fng s ARG 19 Cb -0.01 -1.57 -0.05 0.00 -0.57 0.00 0.00 34.95 32.76 1fng s ARG 19 CO 0.75 0.43 0.07 0.20 -1.08 0.00 0.00 175.30 175.66 1fng s GLY 20 N -0.61 2.39 -0.13 3.88 0.00 -1.26 0.04 107.32 111.63 1fng s GLY 20 Ca 0.08 -1.65 -0.28 0.00 0.00 0.00 0.00 44.72 42.87 1fng s GLY 20 CO -0.00 -1.90 0.66 1.85 0.00 0.00 0.00 173.10 173.71 1fng s GLU 21 N -3.82 0.95 -0.08 2.90 2.12 -0.71 -4.96 118.70 115.10 1fng s GLU 21 Ca 0.29 0.49 -0.03 0.00 0.36 0.00 0.00 54.97 56.08 1fng s GLU 21 Cb 0.06 0.45 0.05 0.00 0.26 0.00 0.00 34.13 34.95 1fng s GLU 21 CO 0.14 -0.24 0.17 0.12 -0.54 0.00 0.00 175.26 174.91 1fng s PHE 22 N -0.62 -0.20 0.14 5.30 2.19 -1.26 -1.82 117.98 121.71 1fng s PHE 22 Ca -0.07 0.62 -0.12 0.00 0.33 0.00 0.00 56.93 57.70 1fng s PHE 22 Cb -0.02 -0.21 0.01 0.00 -1.31 0.00 0.00 43.02 41.49 1fng s PHE 22 CO 0.06 -0.26 0.32 0.00 1.83 0.00 0.00 175.22 177.17 1fng s MET 23 N 2.11 1.09 -0.04 10.12 0.23 -0.54 -1.08 119.30 131.18 1fng s MET 23 Ca 0.01 -0.98 0.07 0.00 -1.03 0.00 0.00 55.69 53.76 1fng s MET 23 Cb -0.12 0.41 -0.02 0.00 -1.53 0.00 0.00 34.83 33.57 1fng s MET 23 CO -0.06 -0.41 -0.24 -0.06 -2.03 0.00 0.00 175.02 172.22 1fng s PHE 24 N -3.89 2.42 -0.02 3.16 0.40 -0.28 -1.04 117.98 118.73 1fng s PHE 24 Ca 0.10 -0.49 0.07 0.00 -0.60 0.00 0.00 56.93 56.01 1fng s PHE 24 Cb 0.03 -1.55 -0.02 0.00 0.51 0.00 0.00 43.02 41.99 1fng s PHE 24 CO -0.06 -0.07 -0.23 0.34 0.70 0.00 0.00 175.22 175.91 1fng s ASP 25 N -0.47 2.72 -0.18 1.36 -1.08 0.54 0.38 116.67 119.93 1fng s ASP 25 Ca 0.06 -0.42 0.00 0.00 -0.52 0.00 0.00 52.55 51.67 1fng s ASP 25 Cb -0.11 -0.36 0.04 0.00 -1.46 0.00 0.00 42.92 41.03 1fng s ASP 25 CO 0.01 0.28 -0.08 0.12 0.52 0.00 0.00 175.17 176.02 1fng s PHE 26 N -0.48 2.06 -1.37 -5.34 2.19 0.12 -0.46 117.98 114.70 1fng s PHE 26 Ca 0.07 -1.35 -0.12 0.00 0.33 0.00 0.00 56.93 55.86 1fng s PHE 26 Cb -0.09 -1.48 0.10 0.00 -1.31 0.00 0.00 43.02 40.23 1fng s PHE 26 CO -0.00 -0.68 0.57 -0.25 1.83 0.00 0.00 175.22 176.68 1fng n ASP 27 N 4.78 -3.54 0.00 6.13 8.00 -0.15 -1.26 116.55 130.52 1fng n ASP 27 Ca -0.13 -0.55 0.00 0.00 0.71 0.00 0.00 54.79 54.82 1fng n ASP 27 Cb 0.47 -2.92 0.00 0.00 -0.02 0.00 0.00 41.12 38.65 1fng n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fng n GLY 28 N -1.22 0.58 3.49 0.44 0.00 -1.26 -5.05 105.19 102.18 1fng n GLY 28 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1fng n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fng s ASP 29 N -2.60 4.04 0.05 1.61 1.01 -0.39 -5.04 116.67 115.35 1fng s ASP 29 Ca 0.00 -0.32 -0.31 0.00 0.71 0.00 0.00 52.55 52.64 1fng s ASP 29 Cb 0.00 -0.77 -0.06 0.00 1.01 0.00 0.00 42.92 43.10 1fng s ASP 29 CO 0.00 0.28 1.40 -0.70 0.21 0.00 0.00 175.17 176.36 1fng s GLU 30 N -1.31 4.30 -0.14 8.23 2.12 -1.26 0.14 118.70 130.78 1fng s GLU 30 Ca 0.15 2.01 -0.22 0.00 0.36 0.00 0.00 54.97 57.27 1fng s GLU 30 Cb -0.11 -3.45 -0.25 0.00 0.26 0.00 0.00 34.13 30.58 1fng s GLU 30 CO 0.05 -0.52 0.55 0.82 -0.54 0.00 0.00 175.26 175.62 1fng h ILE 31 N 4.66 1.25 -2.06 -3.70 2.04 -0.42 -3.41 117.51 115.87 1fng h ILE 31 Ca -0.40 -2.34 0.21 0.00 1.00 0.00 0.00 64.86 63.33 1fng h ILE 31 Cb 1.19 2.80 -0.11 0.00 -0.74 0.00 0.00 36.82 39.97 1fng h ILE 31 CO 0.89 0.57 0.59 0.72 0.00 0.00 0.00 178.15 180.91 1fng s PHE 32 N -2.37 -0.14 0.17 1.37 -0.12 -1.21 -1.44 117.98 114.24 1fng s PHE 32 Ca -0.22 -0.07 -0.01 0.00 -0.05 0.00 0.00 56.93 56.58 1fng s PHE 32 Cb 0.02 0.59 -0.04 0.00 -0.63 0.00 0.00 43.02 42.97 1fng s PHE 32 CO 0.70 -0.62 0.11 -3.38 -0.05 0.00 0.00 175.22 171.99 1fng s HIS 33 N -3.00 1.03 -0.20 3.49 -3.43 -0.88 -1.13 115.29 111.17 1fng s HIS 33 Ca 0.11 -1.31 -0.07 0.00 -0.80 0.00 0.00 55.06 53.00 1fng s HIS 33 Cb 0.00 -0.51 -0.03 0.00 -1.43 0.00 0.00 32.58 30.60 1fng s HIS 33 CO -0.01 -0.60 0.04 0.08 -2.00 0.00 0.00 174.74 172.25 1fng s VAL 34 N -4.11 4.45 -0.37 -5.38 1.01 -0.24 -0.77 120.40 114.98 1fng s VAL 34 Ca 0.33 -0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.87 1fng s VAL 34 Cb 0.07 -3.02 0.02 0.00 0.00 0.00 0.00 36.38 33.45 1fng s VAL 34 CO 0.08 0.43 1.17 -0.62 0.00 0.00 0.00 175.10 176.16 1fng s ASP 35 N 0.74 6.74 0.05 3.32 -1.08 0.71 -4.60 116.67 122.55 1fng s ASP 35 Ca 0.02 0.90 -0.24 0.00 -0.52 0.00 0.00 52.55 52.71 1fng s ASP 35 Cb -0.14 -2.54 -0.16 0.00 -1.46 0.00 0.00 42.92 38.62 1fng s ASP 35 CO 0.02 -1.08 1.57 0.40 0.52 0.00 0.00 175.17 176.60 1fng h ILE 36 N 5.99 1.15 -0.24 4.11 1.08 -1.93 0.43 117.51 128.10 1fng h ILE 36 Ca -0.23 -0.44 0.03 0.00 -0.39 0.00 0.00 64.86 63.83 1fng h ILE 36 Cb 1.07 1.41 -0.01 0.00 -3.07 0.00 0.00 36.82 36.22 1fng h ILE 36 CO 1.07 0.12 0.16 -0.33 -0.69 0.00 0.00 178.15 178.48 1fng h GLU 37 N -0.15 0.18 -0.01 2.37 4.39 -1.98 -2.59 114.58 116.78 1fng h GLU 37 Ca 0.01 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1fng h GLU 37 Cb 0.18 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1fng h GLU 37 CO -0.00 0.12 -0.11 1.63 -1.16 0.00 0.00 179.01 179.49 1fng n LYS 38 N -4.49 1.32 -3.89 2.33 4.01 -1.17 -5.01 118.16 111.26 1fng n LYS 38 Ca 0.02 -1.12 -0.26 0.00 -0.51 0.00 0.00 58.31 56.44 1fng n LYS 38 Cb 0.18 -1.24 -0.01 0.00 -0.51 0.00 0.00 35.03 33.45 1fng n LYS 38 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1fng n SER 39 N 0.43 -1.25 -3.99 4.39 7.64 0.15 -4.97 113.62 116.02 1fng n SER 39 Ca 0.07 -1.00 -0.09 0.00 1.01 0.00 0.00 58.87 58.86 1fng n SER 39 Cb 0.33 -3.15 -0.11 0.00 -1.01 0.00 0.00 64.21 60.27 1fng n SER 39 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1fng s GLU 40 N -6.44 0.33 -0.10 1.43 -1.05 -0.90 -4.75 118.70 107.23 1fng s GLU 40 Ca 0.09 -0.62 -0.30 0.00 -0.15 0.00 0.00 54.97 53.99 1fng s GLU 40 Cb -0.03 0.08 -0.02 0.00 -0.44 0.00 0.00 34.13 33.72 1fng s GLU 40 CO 0.88 -0.04 1.09 0.99 0.95 0.00 0.00 175.26 179.13 1fng s THR 41 N -1.45 4.55 -0.32 1.83 2.01 -1.26 -0.21 115.64 120.79 1fng s THR 41 Ca -0.16 1.85 -0.03 0.00 0.31 0.00 0.00 61.69 63.66 1fng s THR 41 Cb -0.10 -4.19 0.05 0.00 0.01 0.00 0.00 72.50 68.28 1fng s THR 41 CO -0.01 -0.02 0.04 -0.63 -0.69 0.00 0.00 174.62 173.31 1fng s ILE 42 N 2.27 3.15 0.32 1.82 -1.09 0.05 -4.94 121.20 122.78 1fng s ILE 42 Ca 0.51 -1.42 -0.28 0.00 -2.23 0.00 0.00 60.65 57.24 1fng s ILE 42 Cb -0.21 -2.85 -0.09 0.00 -1.58 0.00 0.00 42.46 37.73 1fng s ILE 42 CO 0.18 -0.19 1.08 0.26 -1.23 0.00 0.00 174.94 175.05 1fng s TRP 43 N 1.26 3.47 0.22 3.97 0.52 -1.26 -2.08 118.94 125.04 1fng s TRP 43 Ca -0.03 1.68 -0.07 0.00 0.02 0.00 0.00 56.10 57.71 1fng s TRP 43 Cb -0.20 -3.23 0.18 0.00 -1.15 0.00 0.00 33.47 29.07 1fng s TRP 43 CO -0.01 -0.57 1.74 -0.09 0.02 0.00 0.00 176.95 178.04 1fng h ARG 44 N 3.36 1.07 -5.37 4.98 9.65 -1.48 -3.41 114.38 123.19 1fng h ARG 44 Ca -0.47 -0.25 -0.64 0.00 -1.10 0.00 0.00 59.98 57.52 1fng h ARG 44 Cb 1.21 -0.14 -0.32 0.00 -1.39 0.00 0.00 29.97 29.33 1fng h ARG 44 CO 0.65 0.95 -0.86 -0.51 2.80 0.00 0.00 179.97 183.00 1fng s LEU 45 N -9.48 1.98 0.32 3.80 1.43 -1.26 -5.05 118.68 110.42 1fng s LEU 45 Ca -0.11 -0.47 0.07 0.00 -1.03 0.00 0.00 54.13 52.58 1fng s LEU 45 Cb 0.15 -1.23 0.77 0.00 0.03 0.00 0.00 46.19 45.91 1fng s LEU 45 CO 0.84 0.16 1.79 -0.33 0.23 0.00 0.00 176.35 179.04 1fng h GLU 46 N 6.52 0.72 -0.00 1.70 4.39 -2.00 -1.92 114.58 123.99 1fng h GLU 46 Ca -0.26 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.39 1fng h GLU 46 Cb 1.20 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1fng h GLU 46 CO 0.47 0.48 0.03 1.05 -1.16 0.00 0.00 179.01 179.87 1fng h GLU 47 N 0.74 0.00 -0.28 2.33 4.11 -1.97 -2.55 114.58 116.97 1fng h GLU 47 Ca 0.56 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.90 1fng h GLU 47 Cb 0.90 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1fng h GLU 47 CO -0.34 0.00 -0.19 0.74 0.07 0.00 0.00 179.01 179.29 1fng h PHE 48 N 0.00 0.55 -0.52 2.06 0.04 -1.76 -3.22 116.94 114.09 1fng h PHE 48 Ca 0.00 -0.10 0.15 0.00 2.80 0.00 0.00 57.97 60.82 1fng h PHE 48 Cb 0.05 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.04 1fng h PHE 48 CO 0.00 0.66 0.55 0.00 -0.60 0.00 0.00 178.31 178.92 1fng h ALA 49 N 1.35 2.27 -0.01 2.45 0.00 -1.64 -0.35 119.26 123.34 1fng h ALA 49 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1fng h ALA 49 Cb 0.58 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1fng h ALA 49 CO 0.04 -0.82 -0.22 0.36 0.00 0.00 0.00 179.25 178.61 1fng n LYS 50 N -3.70 0.70 -0.00 0.00 2.85 -1.21 -3.92 118.16 112.88 1fng n LYS 50 Ca 0.10 -0.36 0.09 0.00 -1.05 0.00 0.00 58.31 57.09 1fng n LYS 50 Cb 0.75 -1.49 -0.12 0.00 -0.65 0.00 0.00 35.03 33.52 1fng n LYS 50 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1fng n PHE 51 N -0.84 0.00 -3.74 5.58 3.72 -0.14 -5.05 117.46 116.98 1fng n PHE 51 Ca 0.12 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.51 1fng n PHE 51 Cb 0.32 -0.14 -0.00 0.00 -0.94 0.00 0.00 39.48 38.72 1fng n PHE 51 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1fng s ALA 52 N -2.93 -1.89 0.11 4.37 0.00 -1.22 -5.17 121.76 115.03 1fng s ALA 52 Ca 0.03 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1fng s ALA 52 Cb 0.13 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 1fng s ALA 52 CO 0.77 -1.06 -0.00 -1.54 0.00 0.00 0.00 175.76 173.93 1fng s SER 53 N -3.09 0.71 -0.10 0.00 1.04 -1.26 -4.67 113.70 106.33 1fng s SER 53 Ca 0.16 -1.10 -0.06 0.00 0.48 0.00 0.00 55.95 55.42 1fng s SER 53 Cb 0.01 0.19 0.04 0.00 0.10 0.00 0.00 66.02 66.36 1fng s SER 53 CO 0.01 -0.61 0.25 0.12 0.98 0.00 0.00 173.24 173.99 1fng s PHE 54 N -3.85 -0.31 -0.63 5.02 5.36 -1.26 -5.11 117.98 117.20 1fng s PHE 54 Ca 0.17 0.75 -0.26 0.00 -0.96 0.00 0.00 56.93 56.63 1fng s PHE 54 Cb 0.07 0.06 0.04 0.00 -0.34 0.00 0.00 43.02 42.85 1fng s PHE 54 CO -0.03 -0.20 1.11 -1.21 -1.46 0.00 0.00 175.22 173.43 1fng s GLU 55 N 0.91 3.31 0.21 10.12 0.41 -1.26 -4.73 118.70 127.67 1fng s GLU 55 Ca -0.06 -0.20 -0.12 0.00 -0.41 0.00 0.00 54.97 54.18 1fng s GLU 55 Cb -0.08 -4.11 0.27 0.00 -1.78 0.00 0.00 34.13 28.44 1fng s GLU 55 CO -0.06 -1.78 1.66 0.00 -0.49 0.00 0.00 175.26 174.59 1fng h ALA 56 N 9.62 0.55 -0.41 5.21 0.00 -1.94 -2.08 119.26 130.21 1fng h ALA 56 Ca -0.27 0.20 0.12 0.00 0.00 0.00 0.00 54.91 54.96 1fng h ALA 56 Cb 1.06 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1fng h ALA 56 CO 1.19 -0.40 0.32 1.96 0.00 0.00 0.00 179.25 182.31 1fng h GLN 57 N 0.09 0.00 -0.21 0.00 1.08 -1.92 0.20 115.11 114.35 1fng h GLN 57 Ca 0.31 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.44 1fng h GLN 57 Cb 0.50 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 1fng h GLN 57 CO -0.54 0.00 -0.16 0.78 -0.95 0.00 0.00 178.83 177.96 1fng h GLY 58 N 0.00 0.39 1.49 3.46 0.00 -1.79 -0.07 103.07 106.53 1fng h GLY 58 Ca 0.19 -0.27 -0.19 0.00 0.00 0.00 0.00 47.33 47.07 1fng h GLY 58 CO -0.00 0.25 -0.71 0.00 0.00 0.00 0.00 176.54 176.08 1fng h ALA 59 N 1.50 0.56 -0.35 3.60 0.00 -0.70 -2.42 119.26 121.45 1fng h ALA 59 Ca 0.06 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.32 1fng h ALA 59 Cb 0.48 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1fng h ALA 59 CO 0.03 0.73 -0.07 -0.07 0.00 0.00 0.00 179.25 179.88 1fng h LEU 60 N 0.36 0.56 -0.48 0.00 3.38 -0.67 -1.12 115.31 117.33 1fng h LEU 60 Ca -0.03 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 1fng h LEU 60 Cb 1.29 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1fng h LEU 60 CO 0.13 0.67 -0.02 0.00 0.09 0.00 0.00 178.44 179.31 1fng h ALA 61 N 1.39 0.65 -0.64 1.53 0.00 -0.84 -0.58 119.26 120.78 1fng h ALA 61 Ca 0.11 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1fng h ALA 61 Cb 0.45 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1fng h ALA 61 CO 0.02 0.48 0.42 -0.91 0.00 0.00 0.00 179.25 179.26 1fng h ASN 62 N 0.72 0.73 -0.70 0.00 4.21 -1.01 -1.39 115.58 118.14 1fng h ASN 62 Ca 0.13 -0.02 -0.04 0.00 1.21 0.00 0.00 56.30 57.59 1fng h ASN 62 Cb 0.54 -0.18 -0.03 0.00 -1.12 0.00 0.00 38.32 37.53 1fng h ASN 62 CO 0.03 0.52 0.31 0.40 -1.29 0.00 0.00 177.43 177.40 1fng h ILE 63 N 0.86 1.24 -0.95 2.81 1.08 -0.91 -0.60 117.51 121.03 1fng h ILE 63 Ca 0.24 -0.73 0.01 0.00 -0.39 0.00 0.00 64.86 63.99 1fng h ILE 63 Cb -0.09 0.36 -0.05 0.00 -3.07 0.00 0.00 36.82 33.97 1fng h ILE 63 CO -0.06 0.30 0.62 0.00 -0.69 0.00 0.00 178.15 178.32 1fng h ALA 64 N 1.30 1.29 -0.40 1.87 0.00 -0.37 0.15 119.26 123.09 1fng h ALA 64 Ca 0.24 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1fng h ALA 64 Cb 0.17 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1fng h ALA 64 CO -0.02 0.64 -0.04 0.28 0.00 0.00 0.00 179.25 180.11 1fng h VAL 65 N 1.30 1.27 -0.46 0.00 2.07 -0.45 -1.17 116.25 118.80 1fng h VAL 65 Ca 0.35 -1.08 -0.03 0.00 0.82 0.00 0.00 66.70 66.76 1fng h VAL 65 Cb -0.12 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1fng h VAL 65 CO -0.07 0.36 0.17 0.44 0.02 0.00 0.00 177.57 178.49 1fng h ASP 66 N 0.56 0.61 -0.39 0.57 3.32 -0.35 0.31 116.42 121.04 1fng h ASP 66 Ca 0.11 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 1fng h ASP 66 Cb 0.53 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1fng h ASP 66 CO 0.03 0.56 -0.03 0.50 -1.72 0.00 0.00 179.24 178.59 1fng h LYS 67 N 0.66 0.70 -0.46 3.56 3.64 -0.42 0.11 116.57 124.37 1fng h LYS 67 Ca 0.16 -0.24 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 1fng h LYS 67 Cb 0.16 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1fng h LYS 67 CO -0.01 0.81 0.00 0.00 -2.27 0.00 0.00 179.45 177.98 1fng h ALA 68 N 0.87 0.62 -0.20 5.00 0.00 -0.63 -2.82 119.26 122.10 1fng h ALA 68 Ca 0.11 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1fng h ALA 68 Cb 0.51 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1fng h ALA 68 CO 0.03 0.41 -0.07 -0.91 0.00 0.00 0.00 179.25 178.71 1fng h ASN 69 N 0.66 0.28 -0.78 0.00 2.35 -0.19 -2.66 115.58 115.24 1fng h ASN 69 Ca 0.13 -0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 1fng h ASN 69 Cb 0.50 -0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.76 1fng h ASN 69 CO 0.02 0.39 0.39 0.25 -1.65 0.00 0.00 177.43 176.84 1fng h LEU 70 N 0.29 1.01 -0.80 1.61 5.85 -0.51 -0.43 115.31 122.34 1fng h LEU 70 Ca 0.06 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.59 1fng h LEU 70 Cb 0.31 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1fng h LEU 70 CO 0.01 0.85 -0.02 0.44 -0.34 0.00 0.00 178.44 179.38 1fng h ASP 71 N 1.12 0.86 -0.51 1.25 3.32 -1.43 -0.37 116.42 120.66 1fng h ASP 71 Ca 0.27 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 1fng h ASP 71 Cb 0.09 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1fng h ASP 71 CO -0.04 0.93 0.25 0.58 -1.72 0.00 0.00 179.24 179.25 1fng h VAL 72 N 0.82 1.19 -0.49 -1.35 2.07 -1.17 -1.67 116.25 115.64 1fng h VAL 72 Ca 0.15 -0.53 -0.10 0.00 0.82 0.00 0.00 66.70 67.04 1fng h VAL 72 Cb 0.51 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1fng h VAL 72 CO 0.03 0.21 -0.09 0.24 0.02 0.00 0.00 177.57 177.98 1fng h MET 73 N 0.68 0.90 -0.35 1.57 2.86 -0.73 -0.42 114.93 119.44 1fng h MET 73 Ca 0.18 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1fng h MET 73 Cb 0.10 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 1fng h MET 73 CO -0.02 0.95 0.20 0.87 1.06 0.00 0.00 176.91 179.96 1fng h LYS 74 N 0.81 0.48 -0.35 1.72 1.57 -0.82 -0.79 116.57 119.19 1fng h LYS 74 Ca 0.14 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.73 1fng h LYS 74 Cb 0.61 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 1fng h LYS 74 CO 0.04 0.39 -0.32 1.05 -0.57 0.00 0.00 179.45 180.04 1fng h GLU 75 N 0.44 0.76 -0.42 3.15 4.11 -1.16 1.22 114.58 122.69 1fng h GLU 75 Ca 0.12 -0.35 -0.05 0.00 0.07 0.00 0.00 59.36 59.15 1fng h GLU 75 Cb 0.04 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1fng h GLU 75 CO -0.02 0.97 0.03 -0.09 0.07 0.00 0.00 179.01 179.98 1fng h ARG 76 N 0.64 0.66 -0.33 1.06 2.43 -0.73 -1.68 114.38 116.44 1fng h ARG 76 Ca 0.07 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1fng h ARG 76 Cb 0.85 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1fng h ARG 76 CO 0.07 0.66 0.00 -1.13 -1.51 0.00 0.00 179.97 178.06 1fng n SER 77 N -4.26 2.71 -3.58 -3.80 3.41 -0.33 -4.93 113.62 102.84 1fng n SER 77 Ca 0.02 -1.90 -0.21 0.00 -0.26 0.00 0.00 58.87 56.53 1fng n SER 77 Cb 0.25 -0.21 0.07 0.00 -0.26 0.00 0.00 64.21 64.05 1fng n SER 77 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1fng n ASN 78 N 1.00 -2.79 -4.07 4.04 5.15 -0.36 -2.59 115.26 115.64 1fng n ASN 78 Ca 0.18 -0.68 -0.33 0.00 -0.60 0.00 0.00 54.58 53.16 1fng n ASN 78 Cb 0.48 -4.71 -0.00 0.00 -0.53 0.00 0.00 39.78 35.02 1fng n ASN 78 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1fng n ASN 79 N -3.06 -3.48 -4.57 1.20 3.02 0.41 -4.94 115.26 103.84 1fng n ASN 79 Ca -0.21 -0.92 -0.41 0.00 -0.03 0.00 0.00 54.58 53.00 1fng n ASN 79 Cb 0.64 -3.24 -0.07 0.00 -0.61 0.00 0.00 39.78 36.50 1fng n ASN 79 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1fng s THR 80 N -3.38 4.96 0.49 3.41 2.01 -1.07 -5.06 115.64 117.00 1fng s THR 80 Ca 0.61 0.49 -0.03 0.00 0.31 0.00 0.00 61.69 63.08 1fng s THR 80 Cb -0.32 -4.01 -0.01 0.00 0.01 0.00 0.00 72.50 68.16 1fng s THR 80 CO 0.88 -0.25 0.75 -2.16 -0.69 0.00 0.00 174.62 173.16 1fng s PRO 81 N 2.54 3.17 0.43 4.92 0.04 -1.26 -5.02 135.00 139.82 1fng s PRO 81 Ca 0.22 -0.18 0.08 0.00 0.04 0.00 0.00 61.00 61.15 1fng s PRO 81 Cb -0.15 -2.45 -0.01 0.00 0.04 0.00 0.00 34.50 31.93 1fng s PRO 81 CO 0.14 -0.33 0.42 -0.51 0.04 0.00 0.00 177.00 176.75 1fng s ASP 82 N -4.20 5.12 0.73 6.66 1.01 -1.26 -5.11 116.67 119.63 1fng s ASP 82 Ca 0.49 -0.72 -0.12 0.00 0.71 0.00 0.00 52.55 52.90 1fng s ASP 82 Cb -0.10 -0.52 0.04 0.00 1.01 0.00 0.00 42.92 43.35 1fng s ASP 82 CO 0.41 -0.71 1.10 0.00 0.21 0.00 0.00 175.17 176.18 1fng s ALA 83 N -2.47 2.34 0.01 5.23 0.00 -1.26 -5.01 121.76 120.60 1fng s ALA 83 Ca 0.49 0.35 -0.22 0.00 0.00 0.00 0.00 51.96 52.58 1fng s ALA 83 Cb -0.04 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.74 1fng s ALA 83 CO 0.29 -1.58 0.67 -0.80 0.00 0.00 0.00 175.76 174.34 1fng s ASN 84 N -3.13 7.07 -0.35 0.00 0.01 -1.26 -4.87 114.94 112.40 1fng s ASN 84 Ca 0.63 1.27 -0.09 0.00 -0.71 0.00 0.00 52.86 53.96 1fng s ASN 84 Cb -0.18 -2.41 0.02 0.00 0.41 0.00 0.00 41.25 39.09 1fng s ASN 84 CO 0.51 0.05 0.16 -0.69 -1.51 0.00 0.00 177.10 175.62 1fng s VAL 85 N -0.05 4.37 0.44 1.60 1.01 0.30 -4.69 120.40 123.37 1fng s VAL 85 Ca 0.34 -0.81 -0.24 0.00 0.00 0.00 0.00 61.98 61.28 1fng s VAL 85 Cb -0.19 -3.39 -0.08 0.00 0.00 0.00 0.00 36.38 32.73 1fng s VAL 85 CO 0.19 -0.13 1.22 0.00 0.00 0.00 0.00 175.10 176.38 1fng s ALA 86 N 1.53 3.08 0.62 5.51 0.00 -1.26 -2.29 121.76 128.95 1fng s ALA 86 Ca 0.02 1.05 -0.08 0.00 0.00 0.00 0.00 51.96 52.95 1fng s ALA 86 Cb -0.19 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1fng s ALA 86 CO 0.05 -0.73 0.96 -1.25 0.00 0.00 0.00 175.76 174.80 1fng s PRO 87 N -2.49 3.04 -0.03 0.00 0.04 -1.26 -4.60 135.00 129.70 1fng s PRO 87 Ca 0.61 0.25 -0.02 0.00 0.04 0.00 0.00 61.00 61.87 1fng s PRO 87 Cb -0.32 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 1fng s PRO 87 CO 0.40 -0.74 0.10 -1.21 0.04 0.00 0.00 177.00 175.60 1fng s GLU 88 N -5.10 3.20 -0.05 4.56 2.02 -0.06 -4.91 118.70 118.36 1fng s GLU 88 Ca 0.55 -0.39 0.03 0.00 0.02 0.00 0.00 54.97 55.18 1fng s GLU 88 Cb -0.11 -2.96 0.00 0.00 0.10 0.00 0.00 34.13 31.17 1fng s GLU 88 CO 0.48 0.68 -0.15 0.08 0.02 0.00 0.00 175.26 176.37 1fng s VAL 89 N -1.16 1.29 -0.02 2.63 1.01 -1.26 -0.72 120.40 122.15 1fng s VAL 89 Ca 0.22 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1fng s VAL 89 Cb -0.12 -1.13 -0.00 0.00 0.00 0.00 0.00 36.38 35.13 1fng s VAL 89 CO 0.12 0.38 -0.13 -0.89 0.00 0.00 0.00 175.10 174.58 1fng s THR 90 N 0.24 1.05 -0.11 3.92 2.01 -0.47 -4.97 115.64 117.30 1fng s THR 90 Ca -0.07 -0.53 0.03 0.00 0.31 0.00 0.00 61.69 61.43 1fng s THR 90 Cb -0.12 -0.90 -0.00 0.00 0.01 0.00 0.00 72.50 71.49 1fng s THR 90 CO 0.03 0.31 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.35 1fng s VAL 91 N -0.05 2.22 0.02 3.82 1.01 -1.26 -0.37 120.40 125.79 1fng s VAL 91 Ca 0.00 -0.96 -0.16 0.00 0.00 0.00 0.00 61.98 60.86 1fng s VAL 91 Cb -0.08 -1.87 0.03 0.00 0.00 0.00 0.00 36.38 34.46 1fng s VAL 91 CO 0.00 0.55 0.36 -1.48 0.00 0.00 0.00 175.10 174.53 1fng s LEU 92 N 0.43 0.66 0.56 3.92 2.34 -0.03 -4.97 118.68 121.59 1fng s LEU 92 Ca -0.16 -0.00 -0.17 0.00 0.06 0.00 0.00 54.13 53.86 1fng s LEU 92 Cb -0.17 1.50 -0.05 0.00 -0.56 0.00 0.00 46.19 46.90 1fng s LEU 92 CO 0.07 -0.58 1.05 -0.94 -1.06 0.00 0.00 176.35 174.89 1fng s SER 93 N -1.77 5.96 0.23 1.48 1.04 -1.26 0.73 113.70 120.11 1fng s SER 93 Ca -0.08 1.83 0.03 0.00 0.48 0.00 0.00 55.95 58.20 1fng s SER 93 Cb -0.02 -2.54 0.24 0.00 0.10 0.00 0.00 66.02 63.80 1fng s SER 93 CO 0.00 -1.05 1.56 -0.09 0.98 0.00 0.00 173.24 174.65 1fng h ARG 94 N 0.71 0.31 -3.80 4.02 2.43 -0.92 -3.45 114.38 113.69 1fng h ARG 94 Ca -0.47 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 58.39 1fng h ARG 94 Cb 1.22 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 30.70 1fng h ARG 94 CO 0.58 0.80 -0.18 -1.54 -1.51 0.00 0.00 179.97 178.12 1fng s SER 95 N -6.90 0.06 0.12 -3.80 1.04 -1.26 -5.05 113.70 97.91 1fng s SER 95 Ca -0.05 -1.06 -0.35 0.00 0.48 0.00 0.00 55.95 54.98 1fng s SER 95 Cb 0.12 0.58 -0.17 0.00 0.10 0.00 0.00 66.02 66.65 1fng s SER 95 CO 0.80 -1.14 1.10 -2.65 0.98 0.00 0.00 173.24 172.34 1fng n PRO 96 N -0.40 0.78 -3.13 4.02 -0.02 -1.26 -4.89 135.00 130.10 1fng n PRO 96 Ca -0.01 0.28 -0.40 0.00 -2.02 0.00 0.00 63.50 61.35 1fng n PRO 96 Cb 0.62 -1.75 -0.06 0.00 -0.02 0.00 0.00 33.50 32.29 1fng n PRO 96 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1fng s VAL 97 N -0.12 5.01 -0.07 -1.45 1.01 -1.26 -5.05 120.40 118.47 1fng s VAL 97 Ca 0.78 1.11 0.04 0.00 0.00 0.00 0.00 61.98 63.91 1fng s VAL 97 Cb -0.97 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 31.49 1fng s VAL 97 CO 0.53 0.07 -0.19 0.20 0.00 0.00 0.00 175.10 175.71 1fng s ASN 98 N 1.38 2.46 0.27 3.32 0.01 -1.26 -5.06 114.94 116.05 1fng s ASN 98 Ca 0.26 -0.42 -0.30 0.00 -0.71 0.00 0.00 52.86 51.69 1fng s ASN 98 Cb -0.16 -0.97 -0.13 0.00 0.41 0.00 0.00 41.25 40.40 1fng s ASN 98 CO 0.09 0.13 1.29 0.18 -1.51 0.00 0.00 177.10 177.28 1fng n LEU 99 N 3.45 2.84 0.00 0.60 4.77 -1.26 -1.48 117.00 125.92 1fng n LEU 99 Ca -0.20 1.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 1fng n LEU 99 Cb 0.52 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 1fng n LEU 99 CO 0.26 -0.72 0.00 0.61 -1.33 0.00 0.00 177.39 176.21 1fng n GLY 100 N 1.63 0.79 3.31 -0.72 0.00 -1.18 -4.98 105.19 104.06 1fng n GLY 100 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1fng n GLY 100 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fng s GLU 101 N -0.21 3.17 0.21 1.61 2.02 -0.55 -4.96 118.70 120.00 1fng s GLU 101 Ca 0.00 -0.78 -0.31 0.00 0.02 0.00 0.00 54.97 53.90 1fng s GLU 101 Cb 0.00 -3.18 -0.15 0.00 0.10 0.00 0.00 34.13 30.89 1fng s GLU 101 CO 0.00 -0.34 1.09 -2.30 0.02 0.00 0.00 175.26 173.73 1fng n PRO 102 N 4.81 1.16 -2.38 0.39 -0.02 -1.26 -4.24 135.00 133.46 1fng n PRO 102 Ca -0.16 0.41 -0.04 0.00 -2.02 0.00 0.00 63.50 61.69 1fng n PRO 102 Cb 0.49 -1.85 -0.01 0.00 -0.02 0.00 0.00 33.50 32.11 1fng n PRO 102 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1fng n ASN 103 N 1.79 -0.19 -3.74 2.55 2.85 0.00 -5.00 115.26 113.53 1fng n ASN 103 Ca 0.14 -1.45 -0.14 0.00 -0.11 0.00 0.00 54.58 53.01 1fng n ASN 103 Cb 0.27 0.40 -0.15 0.00 1.24 0.00 0.00 39.78 41.55 1fng n ASN 103 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1fng s ILE 104 N -2.34 -0.07 0.03 -1.44 1.01 -1.26 -1.24 121.20 115.88 1fng s ILE 104 Ca 0.08 0.20 -0.21 0.00 0.00 0.00 0.00 60.65 60.72 1fng s ILE 104 Cb 0.00 -0.24 -0.06 0.00 0.01 0.00 0.00 42.46 42.17 1fng s ILE 104 CO 0.06 0.08 0.62 -0.76 0.00 0.00 0.00 174.94 174.94 1fng s LEU 105 N 1.29 4.45 -0.16 2.97 1.43 0.57 -0.17 118.68 129.06 1fng s LEU 105 Ca -0.08 1.25 -0.03 0.00 -1.03 0.00 0.00 54.13 54.24 1fng s LEU 105 Cb -0.12 -2.98 -0.02 0.00 0.03 0.00 0.00 46.19 43.10 1fng s LEU 105 CO -0.06 0.13 -0.06 -0.63 0.23 0.00 0.00 176.35 175.96 1fng s ILE 106 N -0.39 3.61 -0.37 -0.59 1.01 0.22 -1.55 121.20 123.15 1fng s ILE 106 Ca 0.32 -0.45 -0.06 0.00 0.00 0.00 0.00 60.65 60.46 1fng s ILE 106 Cb -0.19 -2.58 0.06 0.00 0.01 0.00 0.00 42.46 39.76 1fng s ILE 106 CO 0.19 0.49 0.15 0.00 0.00 0.00 0.00 174.94 175.76 1fng s PHE 108 N 1.36 3.23 -0.26 0.00 5.36 0.50 -1.14 117.98 127.03 1fng s PHE 108 Ca 0.01 -0.28 -0.09 0.00 -0.96 0.00 0.00 56.93 55.60 1fng s PHE 108 Cb -0.21 -2.55 -0.04 0.00 -0.34 0.00 0.00 43.02 39.88 1fng s PHE 108 CO 0.01 -0.44 0.13 0.42 -1.46 0.00 0.00 175.22 173.88 1fng s ILE 109 N 1.78 4.79 0.12 3.12 1.01 -0.22 -1.36 121.20 130.44 1fng s ILE 109 Ca 0.07 -0.01 0.04 0.00 0.00 0.00 0.00 60.65 60.75 1fng s ILE 109 Cb -0.18 -3.26 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 1fng s ILE 109 CO 0.11 0.30 -0.10 -0.62 0.00 0.00 0.00 174.94 174.63 1fng s ASP 110 N 1.67 1.60 -1.24 3.58 2.15 0.10 -0.22 116.67 124.32 1fng s ASP 110 Ca 0.07 -0.95 -0.03 0.00 0.43 0.00 0.00 52.55 52.07 1fng s ASP 110 Cb -0.15 0.01 -0.01 0.00 -0.30 0.00 0.00 42.92 42.46 1fng s ASP 110 CO 0.07 -0.33 0.80 0.29 -0.17 0.00 0.00 175.17 175.83 1fng n LYS 111 N 0.05 -4.53 -4.24 4.34 5.02 -0.58 -0.88 118.16 117.35 1fng n LYS 111 Ca -0.12 0.68 -0.14 0.00 -2.02 0.00 0.00 58.31 56.71 1fng n LYS 111 Cb 0.60 -5.29 -0.10 0.00 -0.02 0.00 0.00 35.03 30.22 1fng n LYS 111 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1fng s PHE 112 N -3.55 1.24 -0.25 2.13 -0.71 -0.99 -4.37 117.98 111.48 1fng s PHE 112 Ca 0.11 -1.13 -0.27 0.00 -1.04 0.00 0.00 56.93 54.59 1fng s PHE 112 Cb -0.03 -0.70 0.15 0.00 -1.21 0.00 0.00 43.02 41.23 1fng s PHE 112 CO 0.79 -0.34 1.19 0.45 -1.34 0.00 0.00 175.22 175.98 1fng s SER 113 N -3.19 -0.25 0.88 1.98 0.15 -0.97 -0.71 113.70 111.59 1fng s SER 113 Ca 0.29 0.38 -0.10 0.00 0.70 0.00 0.00 55.95 57.22 1fng s SER 113 Cb 0.07 0.36 0.12 0.00 -1.71 0.00 0.00 66.02 64.86 1fng s SER 113 CO 0.07 -0.15 1.12 -2.16 1.20 0.00 0.00 173.24 173.33 1fng s PRO 114 N -0.44 1.34 -1.39 5.44 0.04 -1.26 -0.54 135.00 138.19 1fng s PRO 114 Ca 0.04 1.36 -0.15 0.00 0.04 0.00 0.00 61.00 62.29 1fng s PRO 114 Cb -0.03 -1.78 0.01 0.00 0.04 0.00 0.00 34.50 32.74 1fng s PRO 114 CO -0.07 -2.35 2.25 -0.35 0.04 0.00 0.00 177.00 176.52 1fng n PRO 115 N -4.02 2.75 -3.74 0.56 -0.04 -1.26 -4.78 135.00 124.46 1fng n PRO 115 Ca 0.10 -2.47 -0.12 0.00 -0.04 0.00 0.00 63.50 60.97 1fng n PRO 115 Cb 0.53 -3.20 -0.12 0.00 -0.04 0.00 0.00 33.50 30.67 1fng n PRO 115 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1fng s VAL 116 N 3.34 -0.02 0.02 0.52 -7.23 -1.26 -5.00 120.40 110.76 1fng s VAL 116 Ca 0.50 0.07 -0.28 0.00 -1.81 0.00 0.00 61.98 60.46 1fng s VAL 116 Cb 0.14 -0.46 0.08 0.00 0.56 0.00 0.00 36.38 36.70 1fng s VAL 116 CO -0.06 0.03 0.68 0.54 -0.31 0.00 0.00 175.10 175.98 1fng s VAL 117 N 0.83 0.00 -0.18 1.32 0.11 -1.26 -4.77 120.40 116.45 1fng s VAL 117 Ca -0.05 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.00 1fng s VAL 117 Cb -0.06 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.80 1fng s VAL 117 CO -0.06 0.00 -0.18 0.20 -3.33 0.00 0.00 175.10 171.74 1fng s ASN 118 N -1.82 3.36 -0.06 3.54 0.01 -0.58 -4.99 114.94 114.39 1fng s ASN 118 Ca -0.05 -0.58 0.05 0.00 -0.71 0.00 0.00 52.86 51.56 1fng s ASN 118 Cb -0.00 -1.52 -0.00 0.00 0.41 0.00 0.00 41.25 40.13 1fng s ASN 118 CO 0.00 0.02 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.72 1fng s VAL 119 N 1.19 1.71 -0.07 1.60 1.01 -1.26 -0.06 120.40 124.52 1fng s VAL 119 Ca 0.02 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1fng s VAL 119 Cb -0.14 -1.47 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1fng s VAL 119 CO -0.08 0.48 -0.11 -0.89 0.00 0.00 0.00 175.10 174.50 1fng s THR 120 N 0.09 1.06 0.00 3.92 2.01 0.36 -4.98 115.64 118.10 1fng s THR 120 Ca -0.07 -0.41 -0.16 0.00 0.31 0.00 0.00 61.69 61.35 1fng s THR 120 Cb -0.14 -0.99 -0.06 0.00 0.01 0.00 0.00 72.50 71.32 1fng s THR 120 CO 0.04 0.34 0.45 0.26 -0.69 0.00 0.00 174.62 175.02 1fng s TRP 121 N 0.87 3.72 -0.08 4.92 0.52 -1.26 -0.52 118.94 127.10 1fng s TRP 121 Ca -0.11 1.04 0.02 0.00 0.02 0.00 0.00 56.10 57.07 1fng s TRP 121 Cb -0.15 -2.36 0.02 0.00 -1.15 0.00 0.00 33.47 29.82 1fng s TRP 121 CO 0.01 0.58 -0.12 -0.51 0.02 0.00 0.00 176.95 176.94 1fng s LEU 122 N -0.90 1.57 -0.25 2.99 1.43 0.73 -1.12 118.68 123.13 1fng s LEU 122 Ca 0.25 -0.31 -0.02 0.00 -1.03 0.00 0.00 54.13 53.02 1fng s LEU 122 Cb -0.17 -0.85 0.02 0.00 0.03 0.00 0.00 46.19 45.22 1fng s LEU 122 CO 0.14 0.00 -0.06 -0.60 0.23 0.00 0.00 176.35 176.07 1fng s ARG 123 N 0.89 2.89 -1.47 1.70 3.52 -0.14 -0.57 118.95 125.77 1fng s ARG 123 Ca -0.10 -0.94 -0.12 0.00 -0.13 0.00 0.00 55.73 54.44 1fng s ARG 123 Cb -0.15 -2.99 0.06 0.00 -1.56 0.00 0.00 34.95 30.31 1fng s ARG 123 CO 0.01 -0.38 1.05 0.09 -0.81 0.00 0.00 175.30 175.26 1fng n ASN 124 N 4.68 -5.28 0.00 -2.12 3.02 0.63 -1.66 115.26 114.52 1fng n ASN 124 Ca -0.17 -0.70 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1fng n ASN 124 Cb 0.47 -4.28 0.00 0.00 -0.61 0.00 0.00 39.78 35.36 1fng n ASN 124 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fng n GLY 125 N -1.80 0.97 3.50 7.41 0.00 -1.26 -5.03 105.19 108.98 1fng n GLY 125 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1fng n GLY 125 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fng s ARG 126 N -0.03 2.51 0.21 1.61 0.52 -0.67 -5.02 118.95 118.09 1fng s ARG 126 Ca 0.00 -0.69 -0.32 0.00 -0.52 0.00 0.00 55.73 54.19 1fng s ARG 126 Cb 0.00 -2.41 -0.13 0.00 0.52 0.00 0.00 34.95 32.93 1fng s ARG 126 CO 0.00 0.62 1.57 -2.30 0.02 0.00 0.00 175.30 175.21 1fng n PRO 127 N 2.18 2.32 -3.87 3.54 -0.02 -1.26 -0.96 135.00 136.92 1fng n PRO 127 Ca -0.17 0.83 -0.35 0.00 -2.02 0.00 0.00 63.50 61.79 1fng n PRO 127 Cb 0.52 -2.59 -0.14 0.00 -0.02 0.00 0.00 33.50 31.27 1fng n PRO 127 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1fng s VAL 128 N 0.61 3.55 -0.30 -1.45 1.01 -0.28 -4.87 120.40 118.68 1fng s VAL 128 Ca 0.74 -0.46 0.12 0.00 0.00 0.00 0.00 61.98 62.37 1fng s VAL 128 Cb -0.61 -2.64 -0.16 0.00 0.00 0.00 0.00 36.38 32.97 1fng s VAL 128 CO 0.41 0.38 0.39 0.41 0.00 0.00 0.00 175.10 176.69 1fng n THR 129 N 4.82 0.00 -4.02 3.92 -1.04 -1.26 -4.56 114.28 112.13 1fng n THR 129 Ca -0.18 -0.25 -0.34 0.00 -2.04 0.00 0.00 64.05 61.24 1fng n THR 129 Cb 0.51 0.63 -0.06 0.00 -1.82 0.00 0.00 70.33 69.59 1fng n THR 129 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1fng s GLU 130 N -2.45 3.25 -1.00 -2.82 2.02 -1.26 -4.36 118.70 112.08 1fng s GLU 130 Ca 0.00 -0.34 0.00 0.00 0.02 0.00 0.00 54.97 54.65 1fng s GLU 130 Cb 0.08 -3.00 0.00 0.00 0.10 0.00 0.00 34.13 31.31 1fng s GLU 130 CO 0.49 0.70 0.00 0.41 0.02 0.00 0.00 175.26 176.88 1fng n GLY 131 N 1.45 -0.11 3.39 -1.39 0.00 -1.26 -4.80 105.19 102.45 1fng n GLY 131 Ca -0.15 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 1fng n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fng s VAL 132 N -2.58 2.27 0.26 1.61 -7.23 -1.26 -0.65 120.40 112.82 1fng s VAL 132 Ca 0.00 -1.65 -0.12 0.00 -1.81 0.00 0.00 61.98 58.40 1fng s VAL 132 Cb 0.00 -1.98 -0.00 0.00 0.56 0.00 0.00 36.38 34.96 1fng s VAL 132 CO 0.00 0.16 0.50 -0.94 -0.31 0.00 0.00 175.10 174.51 1fng s SER 133 N -1.86 -0.00 0.19 4.85 1.04 -0.69 -4.99 113.70 112.25 1fng s SER 133 Ca 0.14 -0.98 -0.20 0.00 0.48 0.00 0.00 55.95 55.39 1fng s SER 133 Cb -0.10 0.61 0.04 0.00 0.10 0.00 0.00 66.02 66.67 1fng s SER 133 CO 0.05 -1.19 0.58 -1.83 0.98 0.00 0.00 173.24 171.83 1fng s GLU 134 N -3.85 1.39 0.42 4.02 -1.05 -1.26 -0.34 118.70 118.03 1fng s GLU 134 Ca 0.22 -0.73 0.08 0.00 -0.15 0.00 0.00 54.97 54.39 1fng s GLU 134 Cb -0.01 0.56 -0.01 0.00 -0.44 0.00 0.00 34.13 34.23 1fng s GLU 134 CO 0.10 -0.60 0.47 0.95 0.95 0.00 0.00 175.26 177.12 1fng s THR 135 N -3.83 2.78 0.04 1.83 -4.23 -0.50 -5.01 115.64 106.71 1fng s THR 135 Ca 0.06 -1.20 -0.01 0.00 -1.18 0.00 0.00 61.69 59.37 1fng s THR 135 Cb -0.02 -2.98 0.01 0.00 1.34 0.00 0.00 72.50 70.86 1fng s THR 135 CO -0.06 0.00 0.06 1.33 -0.54 0.00 0.00 174.62 175.41 1fng n VAL 136 N -1.69 0.00 -2.69 2.29 0.24 -1.26 -4.69 118.33 110.53 1fng n VAL 136 Ca 0.06 -0.05 -0.43 0.00 -2.04 0.00 0.00 64.34 61.88 1fng n VAL 136 Cb 0.61 -1.91 -0.02 0.00 -1.47 0.00 0.00 33.84 31.04 1fng n VAL 136 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1fng s PHE 137 N -0.99 3.43 0.01 6.34 0.40 -1.26 -4.63 117.98 121.27 1fng s PHE 137 Ca 0.03 1.51 -0.01 0.00 -0.60 0.00 0.00 56.93 57.86 1fng s PHE 137 Cb -0.00 -3.21 -0.04 0.00 0.51 0.00 0.00 43.02 40.28 1fng s PHE 137 CO 0.02 -0.34 0.16 -0.51 0.70 0.00 0.00 175.22 175.24 1fng s LEU 138 N 2.57 4.21 0.63 -0.37 1.43 0.74 -4.93 118.68 122.96 1fng s LEU 138 Ca 0.46 0.25 -0.14 0.00 -1.03 0.00 0.00 54.13 53.67 1fng s LEU 138 Cb -0.17 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.45 1fng s LEU 138 CO 0.12 0.24 1.06 -2.16 0.23 0.00 0.00 176.35 175.84 1fng s PRO 139 N -2.04 3.15 0.41 1.29 0.04 -1.26 -1.66 135.00 134.93 1fng s PRO 139 Ca 0.28 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.45 1fng s PRO 139 Cb -0.13 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1fng s PRO 139 CO 0.20 -0.94 0.02 0.54 0.04 0.00 0.00 177.00 176.85 1fng n ARG 140 N -2.44 1.00 0.16 4.56 1.74 -1.18 -4.78 116.66 115.72 1fng n ARG 140 Ca 0.08 -2.97 0.01 0.00 -0.77 0.00 0.00 57.85 54.20 1fng n ARG 140 Cb 0.53 0.77 0.25 0.00 -1.02 0.00 0.00 32.46 32.99 1fng n ARG 140 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 1fng h ASP 141 N 0.96 0.00 0.00 0.55 1.82 -1.98 -3.45 116.42 114.32 1fng h ASP 141 Ca -0.34 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.30 1fng h ASP 141 Cb 1.03 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.04 1fng h ASP 141 CO 0.56 0.51 0.00 -0.90 -1.61 0.00 0.00 179.24 177.80 1fng n ASP 142 N -3.89 0.00 -0.94 2.28 5.68 -1.26 -5.00 116.55 113.43 1fng n ASP 142 Ca -0.01 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.39 1fng n ASP 142 Cb 0.53 0.00 0.25 0.00 -1.14 0.00 0.00 41.12 40.76 1fng n ASP 142 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fng n HIS 143 N 0.00 0.31 -3.28 2.11 1.44 -1.26 -4.98 115.22 109.57 1fng n HIS 143 Ca 0.00 -0.16 -0.19 0.00 -2.01 0.00 0.00 57.72 55.36 1fng n HIS 143 Cb 0.00 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.11 1fng n HIS 143 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1fng s LEU 144 N -1.62 3.45 0.36 2.39 1.43 -1.26 -4.97 118.68 118.45 1fng s LEU 144 Ca 0.35 -0.64 0.08 0.00 -1.03 0.00 0.00 54.13 52.90 1fng s LEU 144 Cb 0.21 -2.24 -0.06 0.00 0.03 0.00 0.00 46.19 44.13 1fng s LEU 144 CO 0.30 -0.79 0.05 -0.36 0.23 0.00 0.00 176.35 175.78 1fng s PHE 145 N -2.45 2.56 0.11 0.29 0.40 0.11 -3.09 117.98 115.91 1fng s PHE 145 Ca 0.52 -0.48 -0.02 0.00 -0.60 0.00 0.00 56.93 56.34 1fng s PHE 145 Cb -0.06 -1.61 -0.04 0.00 0.51 0.00 0.00 43.02 41.82 1fng s PHE 145 CO 0.31 0.41 0.06 -0.98 0.70 0.00 0.00 175.22 175.72 1fng s ARG 146 N -3.76 0.86 -0.10 0.44 1.70 -0.66 -1.52 118.95 115.91 1fng s ARG 146 Ca 0.36 -1.33 -0.30 0.00 -0.47 0.00 0.00 55.73 53.99 1fng s ARG 146 Cb 0.01 0.25 0.07 0.00 -0.57 0.00 0.00 34.95 34.72 1fng s ARG 146 CO 0.20 -0.24 0.69 0.21 -1.08 0.00 0.00 175.30 175.09 1fng s LYS 147 N -4.00 1.00 -0.06 3.89 2.20 0.69 -0.19 119.74 123.28 1fng s LYS 147 Ca 0.18 0.43 0.05 0.00 -0.36 0.00 0.00 55.97 56.27 1fng s LYS 147 Cb 0.07 0.48 -0.02 0.00 -1.51 0.00 0.00 37.83 36.85 1fng s LYS 147 CO -0.02 -0.27 -0.22 -0.06 -0.36 0.00 0.00 175.35 174.42 1fng s PHE 148 N -0.82 2.52 -0.01 4.03 0.08 -1.26 -1.05 117.98 121.46 1fng s PHE 148 Ca -0.08 -0.56 0.07 0.00 0.12 0.00 0.00 56.93 56.48 1fng s PHE 148 Cb -0.01 -1.62 -0.02 0.00 -0.57 0.00 0.00 43.02 40.80 1fng s PHE 148 CO 0.08 -0.11 -0.23 -1.01 -0.10 0.00 0.00 175.22 173.85 1fng s HIS 149 N -0.29 2.06 0.07 0.36 3.76 -0.29 -1.41 115.29 119.54 1fng s HIS 149 Ca 0.01 -0.39 0.07 0.00 -0.15 0.00 0.00 55.06 54.60 1fng s HIS 149 Cb -0.13 -1.30 -0.03 0.00 1.11 0.00 0.00 32.58 32.23 1fng s HIS 149 CO 0.03 -0.01 -0.19 0.71 -0.85 0.00 0.00 174.74 174.43 1fng s TYR 150 N -0.59 1.66 -0.09 1.40 2.02 0.54 -0.56 117.35 121.73 1fng s TYR 150 Ca 0.09 -0.40 -0.03 0.00 -0.37 0.00 0.00 57.07 56.36 1fng s TYR 150 Cb -0.09 -0.94 0.04 0.00 -0.40 0.00 0.00 41.96 40.57 1fng s TYR 150 CO -0.00 0.14 0.07 -1.17 -1.57 0.00 0.00 175.55 173.01 1fng s LEU 151 N -1.59 0.24 0.22 -1.29 2.96 -0.59 -1.70 118.68 116.92 1fng s LEU 151 Ca 0.05 -0.18 -0.30 0.00 -0.22 0.00 0.00 54.13 53.49 1fng s LEU 151 Cb -0.09 -0.19 -0.08 0.00 0.50 0.00 0.00 46.19 46.32 1fng s LEU 151 CO 0.03 -0.28 1.15 -0.89 -1.32 0.00 0.00 176.35 175.04 1fng s THR 152 N 2.15 3.57 0.13 3.68 2.01 0.18 -0.32 115.64 127.04 1fng s THR 152 Ca 0.04 1.40 -0.11 0.00 0.31 0.00 0.00 61.69 63.33 1fng s THR 152 Cb -0.13 -3.90 0.01 0.00 0.01 0.00 0.00 72.50 68.49 1fng s THR 152 CO -0.05 0.26 0.29 0.72 -0.69 0.00 0.00 174.62 175.15 1fng s PHE 153 N -0.46 0.14 -0.33 4.92 -0.71 -0.37 -4.92 117.98 116.24 1fng s PHE 153 Ca 0.50 -0.52 -0.06 0.00 -1.04 0.00 0.00 56.93 55.80 1fng s PHE 153 Cb -0.32 0.05 0.03 0.00 -1.21 0.00 0.00 43.02 41.57 1fng s PHE 153 CO 0.38 -0.67 0.10 -1.17 -1.34 0.00 0.00 175.22 172.52 1fng s LEU 154 N -2.89 4.22 0.07 -1.99 2.96 -1.26 -0.82 118.68 118.98 1fng s LEU 154 Ca 0.09 -1.06 -0.36 0.00 -0.22 0.00 0.00 54.13 52.57 1fng s LEU 154 Cb 0.03 -1.87 -0.16 0.00 0.50 0.00 0.00 46.19 44.70 1fng s LEU 154 CO -0.07 -0.30 1.42 -2.65 -1.32 0.00 0.00 176.35 173.43 1fng n PRO 155 N 4.82 1.35 -3.75 0.98 -0.02 -1.26 -4.88 135.00 132.23 1fng n PRO 155 Ca -0.13 0.49 -0.13 0.00 -2.02 0.00 0.00 63.50 61.71 1fng n PRO 155 Cb 0.45 -2.16 -0.10 0.00 -0.02 0.00 0.00 33.50 31.67 1fng n PRO 155 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1fng s SER 156 N 0.82 -0.35 0.00 2.55 0.15 -1.26 -3.07 113.70 112.54 1fng s SER 156 Ca 0.84 0.64 0.20 0.00 0.70 0.00 0.00 55.95 58.34 1fng s SER 156 Cb -0.91 0.67 0.85 0.00 -1.71 0.00 0.00 66.02 64.92 1fng s SER 156 CO 0.46 -0.15 1.63 0.35 1.20 0.00 0.00 173.24 176.73 1fng n THR 157 N 2.73 0.64 -0.04 6.45 -2.24 -1.26 -3.32 114.28 117.24 1fng n THR 157 Ca -0.14 0.16 -0.04 0.00 -2.27 0.00 0.00 64.05 61.76 1fng n THR 157 Cb 0.57 -0.82 -0.14 0.00 -2.10 0.00 0.00 70.33 67.85 1fng n THR 157 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1fng n ASP 158 N -1.50 0.41 -4.83 3.42 8.00 -1.26 -4.93 116.55 115.86 1fng n ASP 158 Ca 0.05 0.18 -0.33 0.00 0.71 0.00 0.00 54.79 55.40 1fng n ASP 158 Cb 0.23 0.70 -0.07 0.00 -0.02 0.00 0.00 41.12 41.97 1fng n ASP 158 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1fng s ASP 159 N -5.55 6.87 0.03 -2.24 1.01 -1.21 -5.06 116.67 110.52 1fng s ASP 159 Ca -0.07 1.50 0.03 0.00 0.71 0.00 0.00 52.55 54.72 1fng s ASP 159 Cb 0.08 -2.46 -0.02 0.00 1.01 0.00 0.00 42.92 41.53 1fng s ASP 159 CO 0.83 -0.28 -0.08 0.72 0.21 0.00 0.00 175.17 176.57 1fng s PHE 160 N -2.08 0.72 0.27 4.23 -0.71 -1.26 -4.24 117.98 114.91 1fng s PHE 160 Ca 0.58 -0.33 0.09 0.00 -1.04 0.00 0.00 56.93 56.23 1fng s PHE 160 Cb -0.10 -0.44 -0.05 0.00 -1.21 0.00 0.00 43.02 41.22 1fng s PHE 160 CO 0.15 -0.03 -0.12 0.71 -1.34 0.00 0.00 175.22 174.59 1fng s TYR 161 N -0.83 2.02 -0.11 3.49 1.51 0.20 -0.27 117.35 123.35 1fng s TYR 161 Ca -0.03 -0.55 -0.10 0.00 -1.01 0.00 0.00 57.07 55.37 1fng s TYR 161 Cb -0.07 -1.03 0.03 0.00 -0.11 0.00 0.00 41.96 40.78 1fng s TYR 161 CO 0.00 0.45 0.30 -0.51 -1.11 0.00 0.00 175.55 174.68 1fng s ASP 162 N -3.44 -0.31 -0.31 2.29 1.01 0.27 -0.94 116.67 115.23 1fng s ASP 162 Ca 0.28 0.61 -0.04 0.00 0.71 0.00 0.00 52.55 54.10 1fng s ASP 162 Cb 0.00 0.61 0.04 0.00 1.01 0.00 0.00 42.92 44.58 1fng s ASP 162 CO 0.12 -0.11 0.04 0.00 0.21 0.00 0.00 175.17 175.43 1fng s GLU 164 N 1.36 4.07 -0.09 0.00 2.12 0.32 -1.21 118.70 125.27 1fng s GLU 164 Ca -0.02 -0.28 0.03 0.00 0.36 0.00 0.00 54.97 55.07 1fng s GLU 164 Cb -0.19 -3.44 0.01 0.00 0.26 0.00 0.00 34.13 30.77 1fng s GLU 164 CO 0.00 0.16 -0.20 0.08 -0.54 0.00 0.00 175.26 174.77 1fng s VAL 165 N 0.75 1.72 0.02 3.70 1.01 0.17 -0.49 120.40 127.28 1fng s VAL 165 Ca 0.07 -0.82 0.09 0.00 0.00 0.00 0.00 61.98 61.31 1fng s VAL 165 Cb -0.13 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 1fng s VAL 165 CO 0.02 0.49 -0.26 -0.62 0.00 0.00 0.00 175.10 174.72 1fng s ASP 166 N 0.48 3.14 0.04 3.32 2.15 0.92 0.04 116.67 126.76 1fng s ASP 166 Ca -0.17 -0.54 -0.23 0.00 0.43 0.00 0.00 52.55 52.04 1fng s ASP 166 Cb -0.17 -0.32 0.05 0.00 -0.30 0.00 0.00 42.92 42.19 1fng s ASP 166 CO 0.07 0.28 0.54 -2.28 -0.17 0.00 0.00 175.17 173.60 1fng s HIS 167 N -0.74 -0.45 -0.07 -5.34 5.65 -1.26 -1.53 115.29 111.55 1fng s HIS 167 Ca 0.11 0.54 0.27 0.00 0.25 0.00 0.00 55.06 56.23 1fng s HIS 167 Cb -0.10 0.35 1.39 0.00 -1.18 0.00 0.00 32.58 33.04 1fng s HIS 167 CO 0.01 -0.64 1.82 -1.49 -0.65 0.00 0.00 174.74 173.79 1fng h TRP 168 N 2.81 0.00 -0.00 3.88 4.06 -1.96 -1.31 115.95 123.43 1fng h TRP 168 Ca -0.30 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.65 1fng h TRP 168 Cb 1.21 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.37 1fng h TRP 168 CO 0.36 0.00 -0.36 0.41 -3.56 0.00 0.00 178.44 175.30 1fng n GLY 169 N -0.96 -1.10 3.88 1.49 0.00 -1.26 -4.88 105.19 102.36 1fng n GLY 169 Ca -0.01 -0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 1fng n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fng s LEU 170 N -2.84 4.39 0.28 0.99 1.43 -0.50 -4.35 118.68 118.09 1fng s LEU 170 Ca 0.16 0.49 0.04 0.00 -1.03 0.00 0.00 54.13 53.79 1fng s LEU 170 Cb 0.18 -2.28 0.42 0.00 0.03 0.00 0.00 46.19 44.55 1fng s LEU 170 CO 0.62 0.36 1.69 -0.33 0.23 0.00 0.00 176.35 178.92 1fng h GLU 171 N 4.63 0.34 -3.43 1.70 5.08 -1.90 -3.46 114.58 117.55 1fng h GLU 171 Ca -0.53 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 57.63 1fng h GLU 171 Cb 1.22 -0.01 -0.12 0.00 0.50 0.00 0.00 28.75 30.33 1fng h GLU 171 CO 0.61 0.66 -0.08 -2.00 -1.00 0.00 0.00 179.01 177.20 1fng s GLU 172 N -4.25 1.12 0.27 2.33 2.12 -1.26 -5.14 118.70 113.88 1fng s GLU 172 Ca -0.05 -0.77 -0.29 0.00 0.36 0.00 0.00 54.97 54.21 1fng s GLU 172 Cb 0.13 0.47 -0.14 0.00 0.26 0.00 0.00 34.13 34.85 1fng s GLU 172 CO 0.78 -0.44 1.15 -2.30 -0.54 0.00 0.00 175.26 173.92 1fng n PRO 173 N -0.24 1.56 -3.56 4.30 -0.02 -1.26 -4.91 135.00 130.88 1fng n PRO 173 Ca -0.14 0.55 -0.36 0.00 -2.02 0.00 0.00 63.50 61.52 1fng n PRO 173 Cb 0.63 -2.03 -0.07 0.00 -0.02 0.00 0.00 33.50 32.01 1fng n PRO 173 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1fng s LEU 174 N 0.18 4.23 -0.24 2.45 2.96 0.11 -4.90 118.68 123.47 1fng s LEU 174 Ca 0.62 0.46 0.02 0.00 -0.22 0.00 0.00 54.13 55.02 1fng s LEU 174 Cb -0.70 -2.34 0.06 0.00 0.50 0.00 0.00 46.19 43.71 1fng s LEU 174 CO 0.57 0.10 -0.09 -0.60 -1.32 0.00 0.00 176.35 175.02 1fng s ARG 175 N 0.50 1.98 -0.18 1.98 3.52 -1.26 0.41 118.95 125.90 1fng s ARG 175 Ca 0.15 -1.13 -0.14 0.00 -0.13 0.00 0.00 55.73 54.48 1fng s ARG 175 Cb -0.13 -2.71 -0.05 0.00 -1.56 0.00 0.00 34.95 30.51 1fng s ARG 175 CO 0.03 -0.56 0.30 0.15 -0.81 0.00 0.00 175.30 174.41 1fng s LYS 176 N 1.26 4.23 0.27 5.12 -0.14 -0.35 -4.91 119.74 125.22 1fng s LYS 176 Ca -0.07 0.08 -0.04 0.00 -1.36 0.00 0.00 55.97 54.58 1fng s LYS 176 Cb -0.19 -3.45 -0.05 0.00 -1.68 0.00 0.00 37.83 32.46 1fng s LYS 176 CO -0.06 0.18 0.52 -1.58 -0.76 0.00 0.00 175.35 173.64 1fng s HIS 177 N 0.66 3.48 -0.28 3.18 2.46 -1.26 -0.76 115.29 122.78 1fng s HIS 177 Ca 0.16 0.56 -0.21 0.00 0.47 0.00 0.00 55.06 56.04 1fng s HIS 177 Cb -0.13 -2.04 0.08 0.00 -0.13 0.00 0.00 32.58 30.36 1fng s HIS 177 CO 0.04 0.21 0.74 -0.46 -2.47 0.00 0.00 174.74 172.80 1fng s TRP 178 N -2.05 -0.88 -0.10 3.88 -0.00 -0.11 -4.90 118.94 114.78 1fng s TRP 178 Ca 0.42 1.94 -0.22 0.00 -0.00 0.00 0.00 56.10 58.25 1fng s TRP 178 Cb -0.11 0.43 0.05 0.00 -0.00 0.00 0.00 33.47 33.85 1fng s TRP 178 CO 0.30 -0.43 0.53 -1.83 -0.00 0.00 0.00 176.95 175.52 1fng s GLU 179 N 0.94 0.79 0.40 5.86 -1.05 -1.26 0.59 118.70 124.97 1fng s GLU 179 Ca -0.04 0.32 -0.27 0.00 -0.15 0.00 0.00 54.97 54.83 1fng s GLU 179 Cb -0.05 0.37 -0.10 0.00 -0.44 0.00 0.00 34.13 33.91 1fng s GLU 179 CO -0.09 -0.19 1.38 0.34 0.95 0.00 0.00 175.26 177.65 1fng n PHE 180 N 1.72 2.57 -3.96 4.83 7.35 -1.26 -4.98 117.46 123.72 1fng n PHE 180 Ca -0.18 0.48 -0.31 0.00 -0.76 0.00 0.00 57.45 56.68 1fng n PHE 180 Cb 0.56 -2.45 -0.14 0.00 0.35 0.00 0.00 39.48 37.80 1fng n PHE 180 CO 0.00 0.00 0.00 -2.00 -0.76 0.00 0.00 176.76 174.00 1fng s GLU 181 N -2.18 1.82 0.00 -4.13 2.56 -1.26 -4.96 118.70 110.55 1fng s GLU 181 Ca 0.58 -2.29 0.07 0.00 0.00 0.00 0.00 54.97 53.32 1fng s GLU 181 Cb -0.49 -3.31 0.41 0.00 2.00 0.00 0.00 34.13 32.74 1fng s GLU 181 CO 0.60 -1.05 0.88 -0.85 -0.56 0.00 0.00 175.26 174.28