#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fhs h ILE 2 N 0.00 1.28 -3.71 -0.61 6.09 -2.05 -3.41 117.51 115.10 1fhs h ILE 2 Ca 0.00 -1.90 -0.63 0.00 -1.37 0.00 0.00 64.86 60.96 1fhs h ILE 2 Cb 0.00 1.87 -0.15 0.00 0.47 0.00 0.00 36.82 39.00 1fhs h ILE 2 CO 0.00 0.61 -0.23 -0.70 -3.07 0.00 0.00 178.15 174.75 1fhs s GLU 3 N -3.87 3.92 1.01 2.19 -6.30 -1.26 -5.03 118.70 109.35 1fhs s GLU 3 Ca -0.10 -0.05 -0.22 0.00 -2.50 0.00 0.00 54.97 52.10 1fhs s GLU 3 Cb 0.09 -3.69 -0.12 0.00 0.00 0.00 0.00 34.13 30.41 1fhs s GLU 3 CO 0.90 -0.34 -0.91 -0.12 0.02 0.00 0.00 175.26 174.81 1fhs n MET 4 N 5.37 -0.25 -0.29 4.30 0.00 -1.26 -4.73 117.12 120.26 1fhs n MET 4 Ca -0.08 -0.07 0.05 0.00 -0.00 0.00 0.00 57.70 57.60 1fhs n MET 4 Cb 0.50 -1.18 0.14 0.00 0.00 0.00 0.00 33.22 32.68 1fhs n MET 4 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 1fhs h LYS 5 N -1.20 0.02 -6.01 2.12 3.64 -1.96 -3.38 116.57 109.81 1fhs h LYS 5 Ca -0.43 -0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.36 1fhs h LYS 5 Cb 1.35 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 33.10 1fhs h LYS 5 CO 0.25 0.02 0.72 -1.25 -2.27 0.00 0.00 179.45 176.91 1fhs s PRO 6 N -6.19 4.25 -0.12 1.90 0.04 -1.26 -4.89 135.00 128.73 1fhs s PRO 6 Ca -0.14 1.26 -0.02 0.00 0.04 0.00 0.00 61.00 62.14 1fhs s PRO 6 Cb 0.24 -3.64 -0.07 0.00 0.04 0.00 0.00 34.50 31.07 1fhs s PRO 6 CO 0.76 -0.59 -0.13 1.58 0.04 0.00 0.00 177.00 178.66 1fhs n HIS 7 N 6.21 0.00 0.00 0.56 -0.00 -1.26 -4.98 115.22 115.75 1fhs n HIS 7 Ca 0.10 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.28 1fhs n HIS 7 Cb 0.46 -0.45 0.00 0.00 -0.12 0.00 0.00 29.99 29.88 1fhs n HIS 7 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 1fhs n PRO 8 N -3.11 0.00 -0.61 1.57 -0.02 -1.26 -4.78 135.00 126.79 1fhs n PRO 8 Ca -0.22 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.25 1fhs n PRO 8 Cb 0.70 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 34.18 1fhs n PRO 8 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1fhs n TRP 9 N 0.00 0.00 -3.10 6.00 4.27 -1.26 -4.91 117.44 118.44 1fhs n TRP 9 Ca 0.00 -0.08 -0.42 0.00 -3.89 0.00 0.00 57.50 53.11 1fhs n TRP 9 Cb 0.00 0.16 -0.06 0.00 -1.36 0.00 0.00 31.31 30.05 1fhs n TRP 9 CO 0.00 0.00 0.00 -0.06 -2.29 0.00 0.00 177.69 175.34 1fhs s PHE 10 N 0.00 3.16 -0.33 -2.67 0.40 -1.26 -3.22 117.98 114.07 1fhs s PHE 10 Ca 0.02 0.42 0.02 0.00 -0.60 0.00 0.00 56.93 56.79 1fhs s PHE 10 Cb 0.02 -3.12 0.09 0.00 0.51 0.00 0.00 43.02 40.52 1fhs s PHE 10 CO -0.01 -0.60 0.03 -0.06 0.70 0.00 0.00 175.22 175.29 1fhs s PHE 11 N 2.71 3.55 0.18 0.36 0.40 -1.09 -5.00 117.98 119.09 1fhs s PHE 11 Ca 0.25 -2.59 -0.19 0.00 -0.60 0.00 0.00 56.93 53.80 1fhs s PHE 11 Cb -0.14 -2.64 0.04 0.00 0.51 0.00 0.00 43.02 40.79 1fhs s PHE 11 CO 0.14 -0.92 0.53 0.20 0.70 0.00 0.00 175.22 175.88 1fhs s GLY 12 N 1.16 -0.26 -0.44 4.36 0.00 -1.26 -2.98 107.32 107.89 1fhs s GLY 12 Ca 0.04 -0.01 -0.23 0.00 0.00 0.00 0.00 44.72 44.52 1fhs s GLY 12 CO -0.06 -0.15 0.77 -1.59 0.00 0.00 0.00 173.10 172.07 1fhs s LYS 13 N -3.83 3.41 -0.22 2.90 -2.85 -1.26 -4.90 119.74 113.00 1fhs s LYS 13 Ca 0.06 -0.10 -0.12 0.00 -1.00 0.00 0.00 55.97 54.80 1fhs s LYS 13 Cb -0.01 -3.93 -0.05 0.00 -2.06 0.00 0.00 37.83 31.78 1fhs s LYS 13 CO -0.07 -1.10 0.24 -1.50 0.10 0.00 0.00 175.35 173.03 1fhs s ILE 14 N 3.25 5.31 -0.21 3.79 1.10 -1.24 -4.98 121.20 128.21 1fhs s ILE 14 Ca 0.29 0.37 -0.39 0.00 -0.51 0.00 0.00 60.65 60.41 1fhs s ILE 14 Cb -0.12 -3.58 -0.16 0.00 0.15 0.00 0.00 42.46 38.75 1fhs s ILE 14 CO 0.22 0.33 1.69 -2.65 -2.11 0.00 0.00 174.94 172.42 1fhs n PRO 15 N 4.21 1.20 -0.38 3.50 -0.02 -1.26 -4.67 135.00 137.58 1fhs n PRO 15 Ca -0.13 0.44 0.34 0.00 -2.02 0.00 0.00 63.50 62.14 1fhs n PRO 15 Cb 0.52 -2.12 0.60 0.00 -0.02 0.00 0.00 33.50 32.47 1fhs n PRO 15 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1fhs n ARG 16 N 5.00 -0.04 0.28 -0.52 0.63 -1.26 0.12 116.66 120.87 1fhs n ARG 16 Ca 0.25 1.22 -0.12 0.00 -0.92 0.00 0.00 57.85 58.27 1fhs n ARG 16 Cb 0.15 -2.31 -0.06 0.00 0.45 0.00 0.00 32.46 30.69 1fhs n ARG 16 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1fhs h ALA 17 N 1.64 -0.77 -0.97 5.13 0.00 -2.00 -2.73 119.26 119.55 1fhs h ALA 17 Ca 0.81 -0.17 0.32 0.00 0.00 0.00 0.00 54.91 55.86 1fhs h ALA 17 Cb 2.43 0.30 -0.17 0.00 0.00 0.00 0.00 17.79 20.35 1fhs h ALA 17 CO -0.55 -0.72 0.32 -0.22 0.00 0.00 0.00 179.25 178.08 1fhs h LYS 18 N -1.20 0.09 0.08 0.00 1.63 0.65 0.69 116.57 118.51 1fhs h LYS 18 Ca -0.08 -0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.72 1fhs h LYS 18 Cb 0.60 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.18 1fhs h LYS 18 CO 0.13 0.06 -0.35 0.00 -3.45 0.00 0.00 179.45 175.84 1fhs h ALA 19 N 1.93 -0.85 -0.93 5.00 0.00 -0.39 0.18 119.26 124.20 1fhs h ALA 19 Ca 0.69 -0.07 0.27 0.00 0.00 0.00 0.00 54.91 55.80 1fhs h ALA 19 Cb 1.61 0.75 -0.16 0.00 0.00 0.00 0.00 17.79 19.98 1fhs h ALA 19 CO -0.77 -0.94 0.19 0.93 0.00 0.00 0.00 179.25 178.67 1fhs h GLU 20 N -0.50 0.11 0.00 0.00 5.08 0.57 0.64 114.58 120.47 1fhs h GLU 20 Ca -0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1fhs h GLU 20 Cb 0.50 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1fhs h GLU 20 CO -0.19 0.07 0.00 0.39 -1.00 0.00 0.00 179.01 178.28 1fhs n GLU 21 N -5.33 0.00 -0.35 2.33 1.02 0.28 0.68 120.64 119.28 1fhs n GLU 21 Ca 0.24 0.00 0.17 0.00 -0.02 0.00 0.00 57.16 57.55 1fhs n GLU 21 Cb 0.78 -0.88 0.38 0.00 -0.02 0.00 0.00 31.44 31.70 1fhs n GLU 21 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1fhs h MET 22 N 0.00 0.59 -0.20 3.49 -0.00 -0.64 1.21 114.93 119.39 1fhs h MET 22 Ca 0.00 -0.04 -0.05 0.00 -0.00 0.00 0.00 59.70 59.62 1fhs h MET 22 Cb 0.00 -0.13 -0.01 0.00 -0.00 0.00 0.00 31.60 31.45 1fhs h MET 22 CO 0.00 0.39 -0.08 1.25 -0.00 0.00 0.00 176.91 178.47 1fhs h LEU 23 N 0.61 0.29 -1.04 -0.10 5.85 0.25 -1.23 115.31 119.94 1fhs h LEU 23 Ca 0.64 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 59.21 1fhs h LEU 23 Cb 1.18 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1fhs h LEU 23 CO -0.46 0.41 -0.35 -1.28 -0.34 0.00 0.00 178.44 176.42 1fhs h SER 24 N 0.29 0.24 0.00 1.25 0.87 0.73 -2.92 113.55 114.01 1fhs h SER 24 Ca 0.06 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1fhs h SER 24 Cb 0.34 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 1fhs h SER 24 CO 0.02 0.58 0.00 0.29 -0.53 0.00 0.00 176.83 177.19 1fhs n LYS 25 N -4.08 0.66 -4.18 2.24 5.02 -0.43 -4.76 118.16 112.63 1fhs n LYS 25 Ca -0.01 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.93 1fhs n LYS 25 Cb 0.43 -1.17 -0.09 0.00 -0.02 0.00 0.00 35.03 34.18 1fhs n LYS 25 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1fhs s GLN 26 N 0.53 3.46 -0.48 1.97 -1.52 -1.11 -4.98 119.66 117.54 1fhs s GLN 26 Ca 0.00 -0.36 0.02 0.00 -1.95 0.00 0.00 55.36 53.07 1fhs s GLN 26 Cb 0.00 -3.01 0.56 0.00 -0.22 0.00 0.00 33.01 30.34 1fhs s GLN 26 CO 0.00 0.52 1.91 0.54 -0.25 0.00 0.00 175.29 178.01 1fhs n ARG 27 N 2.74 2.28 -3.24 2.91 3.00 -1.26 -4.73 116.66 118.36 1fhs n ARG 27 Ca -0.18 -2.87 -0.03 0.00 -0.01 0.00 0.00 57.85 54.76 1fhs n ARG 27 Cb 0.53 -2.12 -0.04 0.00 0.00 0.00 0.00 32.46 30.83 1fhs n ARG 27 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1fhs s HIS 28 N -3.21 -1.31 -0.47 -1.55 3.76 -1.26 -5.08 115.29 106.16 1fhs s HIS 28 Ca 0.55 0.86 -0.28 0.00 -0.15 0.00 0.00 55.06 56.04 1fhs s HIS 28 Cb 0.45 0.13 -0.09 0.00 1.11 0.00 0.00 32.58 34.18 1fhs s HIS 28 CO 0.07 -0.95 2.38 -0.40 -0.85 0.00 0.00 174.74 174.99 1fhs n ASP 29 N 5.39 2.26 0.00 1.40 5.75 -1.26 -1.67 116.55 128.42 1fhs n ASP 29 Ca 0.01 -0.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.64 1fhs n ASP 29 Cb 0.51 -1.46 0.00 0.00 -1.03 0.00 0.00 41.12 39.14 1fhs n ASP 29 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fhs n GLY 30 N 6.10 1.21 3.51 6.12 0.00 -0.98 -4.26 105.19 116.89 1fhs n GLY 30 Ca 0.39 -0.06 -0.45 0.00 0.00 0.00 0.00 46.02 45.91 1fhs n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fhs n ALA 31 N 0.00 -1.13 -2.36 4.61 0.00 -0.67 -2.50 120.51 118.47 1fhs n ALA 31 Ca 0.00 0.35 -0.12 0.00 0.00 0.00 0.00 53.44 53.67 1fhs n ALA 31 Cb 0.00 -1.87 -0.09 0.00 0.00 0.00 0.00 19.45 17.49 1fhs n ALA 31 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1fhs s PHE 32 N -1.15 1.03 -0.07 0.00 -0.71 -1.07 -1.78 117.98 114.24 1fhs s PHE 32 Ca 0.61 -1.27 -0.31 0.00 -1.04 0.00 0.00 56.93 54.92 1fhs s PHE 32 Cb -0.73 -0.44 0.08 0.00 -1.21 0.00 0.00 43.02 40.72 1fhs s PHE 32 CO 0.59 -0.70 0.73 -0.48 -1.34 0.00 0.00 175.22 174.02 1fhs s LEU 33 N -3.14 -0.62 -0.29 -1.99 0.05 -1.05 -4.34 118.68 107.31 1fhs s LEU 33 Ca 0.36 0.67 -0.05 0.00 0.05 0.00 0.00 54.13 55.16 1fhs s LEU 33 Cb 0.06 2.44 0.02 0.00 -2.05 0.00 0.00 46.19 46.65 1fhs s LEU 33 CO 0.11 -0.57 0.05 -0.63 -0.55 0.00 0.00 176.35 174.76 1fhs s ILE 34 N -1.19 3.68 -0.09 1.48 1.01 -1.20 -0.93 121.20 123.96 1fhs s ILE 34 Ca -0.10 -0.81 -0.20 0.00 0.00 0.00 0.00 60.65 59.55 1fhs s ILE 34 Cb -0.00 -2.91 -0.04 0.00 0.01 0.00 0.00 42.46 39.52 1fhs s ILE 34 CO 0.09 0.09 0.55 0.00 0.00 0.00 0.00 174.94 175.67 1fhs s ARG 35 N 1.45 4.36 0.31 2.79 1.70 -1.18 -2.67 118.95 125.71 1fhs s ARG 35 Ca 0.02 0.60 -0.30 0.00 -0.47 0.00 0.00 55.73 55.58 1fhs s ARG 35 Cb -0.17 -3.43 -0.11 0.00 -0.57 0.00 0.00 34.95 30.66 1fhs s ARG 35 CO 0.01 0.15 1.59 -1.91 -1.08 0.00 0.00 175.30 174.06 1fhs n GLU 36 N 3.61 2.73 -1.69 3.89 2.13 -1.16 -4.31 120.64 125.85 1fhs n GLU 36 Ca -0.05 0.97 -0.52 0.00 0.66 0.00 0.00 57.16 58.22 1fhs n GLU 36 Cb 0.51 -2.75 -0.06 0.00 0.27 0.00 0.00 31.44 29.42 1fhs n GLU 36 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1fhs n SER 37 N 1.90 3.02 0.00 4.31 7.64 -1.20 -4.48 113.62 124.81 1fhs n SER 37 Ca 0.07 0.99 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1fhs n SER 37 Cb 0.37 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 1fhs n SER 37 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1fhs n GLU 38 N 6.27 0.00 -3.10 1.43 4.07 -1.26 -4.15 120.64 123.90 1fhs n GLU 38 Ca 0.25 0.29 -0.24 0.00 -0.06 0.00 0.00 57.16 57.40 1fhs n GLU 38 Cb 0.23 -1.06 -0.05 0.00 -0.06 0.00 0.00 31.44 30.51 1fhs n GLU 38 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1fhs n SER 39 N -0.93 2.97 -3.68 4.31 7.64 -1.26 -5.05 113.62 117.61 1fhs n SER 39 Ca 0.00 -3.37 -0.12 0.00 1.01 0.00 0.00 58.87 56.39 1fhs n SER 39 Cb 0.00 -0.60 -0.06 0.00 -1.01 0.00 0.00 64.21 62.54 1fhs n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fhs s ALA 40 N -2.84 -0.87 0.00 -0.43 0.00 -1.26 -5.15 121.76 111.21 1fhs s ALA 40 Ca 0.44 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1fhs s ALA 40 Cb 0.27 0.46 0.00 0.00 0.00 0.00 0.00 23.12 23.85 1fhs s ALA 40 CO -0.10 -0.51 0.00 -2.30 0.00 0.00 0.00 175.76 172.85 1fhs n PRO 41 N 0.24 0.00 -2.93 0.00 -0.02 -1.26 -4.46 135.00 126.57 1fhs n PRO 41 Ca -0.17 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 60.91 1fhs n PRO 41 Cb 0.61 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 34.09 1fhs n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fhs n GLY 42 N 0.00 5.47 3.52 -1.23 0.00 -1.26 -4.74 105.19 106.96 1fhs n GLY 42 Ca 0.00 -2.66 -0.41 0.00 0.00 0.00 0.00 46.02 42.95 1fhs n GLY 42 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fhs s ASP 43 N -1.85 6.09 -0.10 1.61 1.11 -1.26 -4.86 116.67 117.41 1fhs s ASP 43 Ca 0.36 -0.49 0.01 0.00 0.18 0.00 0.00 52.55 52.61 1fhs s ASP 43 Cb 0.12 -2.15 0.02 0.00 1.07 0.00 0.00 42.92 41.97 1fhs s ASP 43 CO 0.01 -0.30 -0.11 -0.36 1.18 0.00 0.00 175.17 175.59 1fhs s PHE 44 N 1.78 1.58 -0.08 4.23 0.08 -1.26 -3.25 117.98 121.05 1fhs s PHE 44 Ca 0.07 -0.73 0.04 0.00 0.12 0.00 0.00 56.93 56.43 1fhs s PHE 44 Cb -0.18 -1.22 -0.01 0.00 -0.57 0.00 0.00 43.02 41.04 1fhs s PHE 44 CO 0.11 -0.44 -0.21 -1.54 -0.10 0.00 0.00 175.22 173.04 1fhs s SER 45 N 1.24 3.40 -0.37 1.36 1.04 -1.26 0.11 113.70 119.22 1fhs s SER 45 Ca -0.03 -0.45 -0.18 0.00 0.48 0.00 0.00 55.95 55.77 1fhs s SER 45 Cb -0.14 -1.17 0.00 0.00 0.10 0.00 0.00 66.02 64.81 1fhs s SER 45 CO -0.03 0.22 0.49 -0.22 0.98 0.00 0.00 173.24 174.68 1fhs s LEU 46 N 0.02 4.44 0.13 2.42 0.20 0.77 -3.11 118.68 123.55 1fhs s LEU 46 Ca -0.08 -0.17 -0.06 0.00 0.69 0.00 0.00 54.13 54.52 1fhs s LEU 46 Cb -0.15 -2.54 -0.06 0.00 -0.43 0.00 0.00 46.19 43.02 1fhs s LEU 46 CO 0.05 -0.50 0.39 -0.94 -0.29 0.00 0.00 176.35 175.06 1fhs s SER 47 N 1.78 6.53 -0.09 3.68 1.04 -0.11 0.10 113.70 126.64 1fhs s SER 47 Ca 0.17 0.65 -0.07 0.00 0.48 0.00 0.00 55.95 57.18 1fhs s SER 47 Cb -0.16 -2.12 0.03 0.00 0.10 0.00 0.00 66.02 63.88 1fhs s SER 47 CO 0.14 0.07 0.23 -0.69 0.98 0.00 0.00 173.24 173.98 1fhs s VAL 48 N -1.60 -0.02 -0.56 5.02 1.01 0.10 -2.53 120.40 121.82 1fhs s VAL 48 Ca 0.39 0.06 -0.28 0.00 0.00 0.00 0.00 61.98 62.15 1fhs s VAL 48 Cb -0.12 -0.35 0.03 0.00 0.00 0.00 0.00 36.38 35.94 1fhs s VAL 48 CO 0.23 0.02 1.18 -0.75 0.00 0.00 0.00 175.10 175.78 1fhs s LYS 49 N 0.57 3.55 -0.18 2.72 2.20 -0.74 0.26 119.74 128.12 1fhs s LYS 49 Ca -0.04 0.30 0.00 0.00 -0.36 0.00 0.00 55.97 55.87 1fhs s LYS 49 Cb -0.05 -4.00 0.04 0.00 -1.51 0.00 0.00 37.83 32.31 1fhs s LYS 49 CO -0.03 -1.63 -0.08 0.12 -0.36 0.00 0.00 175.35 173.37 1fhs s PHE 50 N 4.86 2.08 0.12 4.03 2.19 -0.85 -2.32 117.98 128.10 1fhs s PHE 50 Ca 0.44 -1.36 -0.09 0.00 0.33 0.00 0.00 56.93 56.25 1fhs s PHE 50 Cb -0.07 -1.49 -0.06 0.00 -1.31 0.00 0.00 43.02 40.09 1fhs s PHE 50 CO 0.26 -0.69 0.09 0.41 1.83 0.00 0.00 175.22 177.13 1fhs n GLY 51 N 4.77 -0.90 0.00 13.12 0.00 -1.26 -1.59 105.19 119.34 1fhs n GLY 51 Ca -0.13 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1fhs n GLY 51 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fhs n ASN 52 N 0.83 0.00 -0.11 1.61 3.02 -1.26 -4.95 115.26 114.40 1fhs n ASN 52 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 1fhs n ASN 52 Cb 0.13 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 1fhs n ASN 52 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1fhs n ASP 53 N 2.00 0.00 -4.66 6.41 5.68 -0.62 -5.13 116.55 120.23 1fhs n ASP 53 Ca 0.00 -0.11 -0.38 0.00 -0.50 0.00 0.00 54.79 53.81 1fhs n ASP 53 Cb 0.00 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 39.89 1fhs n ASP 53 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1fhs s VAL 54 N -2.02 5.27 0.33 2.12 1.01 -1.26 -2.00 120.40 123.85 1fhs s VAL 54 Ca 0.00 0.47 0.02 0.00 0.00 0.00 0.00 61.98 62.46 1fhs s VAL 54 Cb 0.00 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 1fhs s VAL 54 CO 0.00 0.28 0.51 -1.58 0.00 0.00 0.00 175.10 174.31 1fhs s GLN 55 N 1.28 3.42 -0.01 2.72 0.74 0.14 -4.91 119.66 123.04 1fhs s GLN 55 Ca 0.14 -0.48 -0.02 0.00 0.05 0.00 0.00 55.36 55.05 1fhs s GLN 55 Cb -0.14 -2.71 -0.00 0.00 1.10 0.00 0.00 33.01 31.25 1fhs s GLN 55 CO 0.07 0.17 0.04 -1.01 -0.55 0.00 0.00 175.29 174.01 1fhs s HIS 56 N -2.25 0.04 -0.30 1.67 3.76 -1.26 0.02 115.29 116.97 1fhs s HIS 56 Ca 0.39 -0.07 0.00 0.00 -0.15 0.00 0.00 55.06 55.24 1fhs s HIS 56 Cb -0.09 -0.04 0.09 0.00 1.11 0.00 0.00 32.58 33.64 1fhs s HIS 56 CO 0.34 -0.10 0.06 -0.06 -0.85 0.00 0.00 174.74 174.13 1fhs s PHE 57 N -0.52 2.20 -0.29 1.40 0.08 0.29 -4.93 117.98 116.21 1fhs s PHE 57 Ca -0.06 -1.94 -0.29 0.00 0.12 0.00 0.00 56.93 54.76 1fhs s PHE 57 Cb -0.04 -1.90 -0.06 0.00 -0.57 0.00 0.00 43.02 40.45 1fhs s PHE 57 CO -0.00 -0.86 2.26 1.63 -0.10 0.00 0.00 175.22 178.15 1fhs n LYS 58 N 4.71 1.67 -2.49 0.44 4.76 -1.26 -0.16 118.16 125.82 1fhs n LYS 58 Ca -0.03 0.41 -0.43 0.00 -2.87 0.00 0.00 58.31 55.39 1fhs n LYS 58 Cb 0.43 -3.14 0.00 0.00 -1.84 0.00 0.00 35.03 30.48 1fhs n LYS 58 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1fhs n VAL 59 N 7.72 3.92 -2.11 -0.18 0.31 0.31 -4.68 118.33 123.62 1fhs n VAL 59 Ca 0.33 -4.03 -0.27 0.00 -0.01 0.00 0.00 64.34 60.36 1fhs n VAL 59 Cb 0.43 -2.40 0.10 0.00 -0.91 0.00 0.00 33.84 31.06 1fhs n VAL 59 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1fhs s LEU 60 N 3.51 2.74 0.00 7.52 1.43 -1.07 -4.07 118.68 128.74 1fhs s LEU 60 Ca 0.51 0.41 0.00 0.00 -1.03 0.00 0.00 54.13 54.02 1fhs s LEU 60 Cb 0.05 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 43.41 1fhs s LEU 60 CO 0.04 -1.94 0.00 -2.11 0.23 0.00 0.00 176.35 172.57 1fhs n ARG 61 N -3.19 0.00 -1.57 1.70 1.85 -1.25 0.16 116.66 114.36 1fhs n ARG 61 Ca 0.10 0.00 0.01 0.00 -1.00 0.00 0.00 57.85 56.97 1fhs n ARG 61 Cb 0.60 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 32.01 1fhs n ARG 61 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1fhs n ASP 62 N 0.00 -8.12 -3.46 2.89 2.03 -1.18 -4.52 116.55 104.18 1fhs n ASP 62 Ca 0.00 1.79 -0.21 0.00 0.52 0.00 0.00 54.79 56.88 1fhs n ASP 62 Cb 0.00 -5.02 -0.04 0.00 -0.72 0.00 0.00 41.12 35.34 1fhs n ASP 62 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1fhs n GLY 63 N -2.74 -0.43 0.44 0.27 0.00 -1.26 -4.37 105.19 97.09 1fhs n GLY 63 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1fhs n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fhs n ALA 64 N -3.19 1.20 0.00 4.61 0.00 -1.26 -5.08 120.51 116.79 1fhs n ALA 64 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1fhs n ALA 64 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1fhs n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fhs n GLY 65 N 0.12 0.45 6.01 0.00 0.00 -1.26 -4.91 105.19 105.62 1fhs n GLY 65 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1fhs n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fhs n LYS 66 N 0.00 0.00 -1.57 1.61 5.02 -1.26 -4.26 118.16 117.70 1fhs n LYS 66 Ca 0.00 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.97 1fhs n LYS 66 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 35.03 35.07 1fhs n LYS 66 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1fhs s TYR 67 N 0.00 2.80 0.07 2.13 2.02 -0.89 -3.10 117.35 120.39 1fhs s TYR 67 Ca 0.00 1.51 -0.16 0.00 -0.37 0.00 0.00 57.07 58.05 1fhs s TYR 67 Cb 0.00 -3.02 0.03 0.00 -0.40 0.00 0.00 41.96 38.57 1fhs s TYR 67 CO 0.00 -1.51 0.38 0.12 -1.57 0.00 0.00 175.55 172.97 1fhs s PHE 68 N -2.75 -0.20 0.05 2.71 2.19 0.42 0.11 117.98 120.50 1fhs s PHE 68 Ca 0.62 0.04 0.00 0.00 0.33 0.00 0.00 56.93 57.91 1fhs s PHE 68 Cb -0.17 0.20 0.00 0.00 -1.31 0.00 0.00 43.02 41.75 1fhs s PHE 68 CO 0.50 -0.61 0.00 -0.11 1.83 0.00 0.00 175.22 176.83 1fhs n LEU 69 N 0.23 0.26 0.00 6.12 7.94 -1.16 -2.60 117.00 127.80 1fhs n LEU 69 Ca -0.17 0.07 0.00 0.00 -1.11 0.00 0.00 56.01 54.80 1fhs n LEU 69 Cb 0.61 -0.05 0.00 0.00 0.53 0.00 0.00 43.42 44.51 1fhs n LEU 69 CO 0.19 -0.59 0.00 0.79 -1.11 0.00 0.00 177.39 176.68 1fhs n TRP 70 N -2.82 0.00 0.00 1.96 5.03 -1.26 -4.93 117.44 115.43 1fhs n TRP 70 Ca 0.00 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.53 1fhs n TRP 70 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.28 1fhs n TRP 70 CO 0.00 0.00 0.00 0.28 -0.03 0.00 0.00 177.69 177.94 1fhs n VAL 71 N -1.21 0.00 -4.42 -0.99 0.31 -1.26 -5.10 118.33 105.65 1fhs n VAL 71 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.12 1fhs n VAL 71 Cb 0.00 -0.44 -0.10 0.00 -0.91 0.00 0.00 33.84 32.39 1fhs n VAL 71 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1fhs s VAL 72 N -1.71 0.85 0.52 2.52 -7.23 -1.26 -5.16 120.40 108.94 1fhs s VAL 72 Ca 0.00 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.24 1fhs s VAL 72 Cb 0.00 -2.65 0.05 0.00 0.56 0.00 0.00 36.38 34.34 1fhs s VAL 72 CO 0.00 0.00 0.72 -1.59 -0.31 0.00 0.00 175.10 173.92 1fhs s LYS 73 N -3.89 2.50 -0.09 4.82 0.00 -1.26 -2.96 119.74 118.85 1fhs s LYS 73 Ca 0.34 -1.33 -0.05 0.00 0.00 0.00 0.00 55.97 54.94 1fhs s LYS 73 Cb 0.07 -2.65 0.04 0.00 0.00 0.00 0.00 37.83 35.29 1fhs s LYS 73 CO 0.15 -0.65 0.21 -0.06 0.00 0.00 0.00 175.35 175.00 1fhs s PHE 74 N -2.59 -0.27 -0.41 1.78 0.40 0.30 -4.91 117.98 112.29 1fhs s PHE 74 Ca 0.59 0.66 0.03 0.00 -0.60 0.00 0.00 56.93 57.60 1fhs s PHE 74 Cb -0.08 0.02 0.25 0.00 0.51 0.00 0.00 43.02 43.72 1fhs s PHE 74 CO 0.37 -0.19 1.14 0.27 0.70 0.00 0.00 175.22 177.51 1fhs n ASN 75 N 3.94 2.97 0.00 1.36 0.23 -1.26 -2.09 115.26 120.40 1fhs n ASN 75 Ca -0.23 -2.44 0.00 0.00 -0.53 0.00 0.00 54.58 51.38 1fhs n ASN 75 Cb 0.54 -0.59 0.00 0.00 -2.08 0.00 0.00 39.78 37.65 1fhs n ASN 75 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 1fhs n SER 76 N 0.06 0.00 -0.33 0.53 2.88 -1.26 -4.93 113.62 110.58 1fhs n SER 76 Ca 0.15 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.86 1fhs n SER 76 Cb 0.75 0.00 0.37 0.00 -0.75 0.00 0.00 64.21 64.58 1fhs n SER 76 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1fhs h LEU 77 N 0.00 0.51 -1.84 2.46 3.38 -2.01 1.19 115.31 119.00 1fhs h LEU 77 Ca 0.00 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1fhs h LEU 77 Cb 0.00 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1fhs h LEU 77 CO 0.00 0.02 0.03 0.78 0.09 0.00 0.00 178.44 179.36 1fhs h ASN 78 N 0.47 0.11 0.44 -0.43 2.35 -1.98 0.25 115.58 116.79 1fhs h ASN 78 Ca 0.62 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 56.32 1fhs h ASN 78 Cb 1.22 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 39.56 1fhs h ASN 78 CO -0.52 0.12 -0.21 -0.08 -1.65 0.00 0.00 177.43 175.09 1fhs h GLU 79 N 0.13 0.00 0.00 0.81 4.57 0.11 0.64 114.58 120.84 1fhs h GLU 79 Ca 0.03 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.15 1fhs h GLU 79 Cb 0.05 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 1fhs h GLU 79 CO -0.00 0.21 -0.38 1.25 -1.18 0.00 0.00 179.01 178.90 1fhs h LEU 80 N 0.00 0.00 -0.61 1.64 6.46 -0.25 0.21 115.31 122.76 1fhs h LEU 80 Ca -0.00 -0.56 0.06 0.00 -0.12 0.00 0.00 57.88 57.26 1fhs h LEU 80 Cb 0.48 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.36 1fhs h LEU 80 CO 0.03 1.00 0.32 0.58 -0.62 0.00 0.00 178.44 179.75 1fhs h VAL 81 N -1.00 0.94 0.53 1.05 2.07 -0.66 0.42 116.25 119.60 1fhs h VAL 81 Ca -0.09 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 1fhs h VAL 81 Cb 0.83 0.29 0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1fhs h VAL 81 CO -0.05 0.11 -0.25 -0.78 0.02 0.00 0.00 177.57 176.61 1fhs h ASP 82 N 0.60 -0.60 -0.91 0.57 3.58 0.20 -1.26 116.42 118.59 1fhs h ASP 82 Ca 0.28 0.02 0.21 0.00 0.42 0.00 0.00 57.03 57.96 1fhs h ASP 82 Cb 0.19 0.16 -0.12 0.00 1.72 0.00 0.00 39.33 41.28 1fhs h ASP 82 CO -0.19 -0.37 0.45 0.22 -2.88 0.00 0.00 179.24 176.47 1fhs h TYR 83 N -0.83 0.75 -1.41 0.28 5.03 -0.48 0.74 116.97 121.06 1fhs h TYR 83 Ca -0.07 0.04 -0.72 0.00 2.58 0.00 0.00 58.73 60.56 1fhs h TYR 83 Cb 0.54 -0.19 -0.28 0.00 1.55 0.00 0.00 36.73 38.35 1fhs h TYR 83 CO 0.07 0.01 0.95 0.72 -1.32 0.00 0.00 178.16 178.59 1fhs n HIS 84 N -4.98 3.13 0.06 -3.82 8.25 0.15 -4.29 115.22 113.72 1fhs n HIS 84 Ca 0.22 -2.74 -0.23 0.00 -0.26 0.00 0.00 57.72 54.72 1fhs n HIS 84 Cb 0.64 -1.34 -0.15 0.00 1.12 0.00 0.00 29.99 30.26 1fhs n HIS 84 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1fhs h ARG 85 N 2.41 0.37 0.00 -0.41 9.65 0.17 -3.41 114.38 123.16 1fhs h ARG 85 Ca 0.59 -0.62 -0.14 0.00 -1.10 0.00 0.00 59.98 58.71 1fhs h ARG 85 Cb 0.49 0.23 -0.03 0.00 -1.39 0.00 0.00 29.97 29.28 1fhs h ARG 85 CO 1.53 1.30 -1.54 0.45 2.80 0.00 0.00 179.97 184.51 1fhs n SER 86 N -3.62 3.22 -1.70 -3.80 2.88 -1.26 -3.73 113.62 105.60 1fhs n SER 86 Ca -0.26 -0.03 -0.03 0.00 -1.33 0.00 0.00 58.87 57.22 1fhs n SER 86 Cb 1.05 0.13 -0.04 0.00 -0.75 0.00 0.00 64.21 64.60 1fhs n SER 86 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1fhs n THR 87 N -2.61 1.99 -2.48 2.46 5.66 -1.26 -4.85 114.28 113.19 1fhs n THR 87 Ca -0.15 -0.68 0.00 0.00 -3.05 0.00 0.00 64.05 60.17 1fhs n THR 87 Cb 0.70 -1.58 0.00 0.00 -1.55 0.00 0.00 70.33 67.91 1fhs n THR 87 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1fhs n SER 88 N 1.84 0.00 0.00 1.09 7.64 -1.21 -4.88 113.62 118.11 1fhs n SER 88 Ca 0.10 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1fhs n SER 88 Cb 0.54 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 1fhs n SER 88 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1fhs n VAL 89 N 0.00 0.00 -2.99 0.44 3.14 -1.26 -4.59 118.33 113.07 1fhs n VAL 89 Ca 0.00 0.00 -0.34 0.00 -2.96 0.00 0.00 64.34 61.04 1fhs n VAL 89 Cb 0.00 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 32.72 1fhs n VAL 89 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1fhs s SER 90 N -1.14 6.96 0.34 6.55 0.15 -1.26 -4.92 113.70 120.38 1fhs s SER 90 Ca 0.00 1.51 0.13 0.00 0.70 0.00 0.00 55.95 58.28 1fhs s SER 90 Cb 0.00 -2.46 1.09 0.00 -1.71 0.00 0.00 66.02 62.94 1fhs s SER 90 CO 0.00 -0.18 1.60 0.03 1.20 0.00 0.00 173.24 175.89 1fhs h ARG 91 N 2.55 0.06 -5.79 5.44 -0.00 -2.01 -3.04 114.38 111.60 1fhs h ARG 91 Ca -0.48 -0.00 -0.39 0.00 -0.50 0.00 0.00 59.98 58.60 1fhs h ARG 91 Cb 1.18 -0.01 -0.03 0.00 0.00 0.00 0.00 29.97 31.11 1fhs h ARG 91 CO 0.64 0.04 1.12 -0.80 0.00 0.00 0.00 179.97 180.97 1fhs s ASN 92 N -4.76 4.96 -0.81 7.04 0.01 -1.26 -4.84 114.94 115.28 1fhs s ASN 92 Ca -0.11 0.17 -0.25 0.00 -0.71 0.00 0.00 52.86 51.97 1fhs s ASN 92 Cb 0.31 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 39.40 1fhs s ASN 92 CO 0.78 -2.71 1.91 -1.10 -1.51 0.00 0.00 177.10 174.48 1fhs s GLN 93 N 7.42 2.59 0.00 -0.60 -1.52 -1.15 -4.05 119.66 122.36 1fhs s GLN 93 Ca 0.76 0.00 0.00 0.00 -1.95 0.00 0.00 55.36 54.17 1fhs s GLN 93 Cb -0.12 -4.84 0.00 0.00 -0.22 0.00 0.00 33.01 27.83 1fhs s GLN 93 CO 0.15 -3.15 0.00 0.00 -0.25 0.00 0.00 175.29 172.04 1fhs n GLN 94 N 8.97 0.00 -4.56 2.91 10.64 -1.26 -5.06 117.38 129.03 1fhs n GLN 94 Ca 0.33 0.00 -0.31 0.00 -1.83 0.00 0.00 57.00 55.20 1fhs n GLN 94 Cb 0.49 0.00 -0.12 0.00 -0.86 0.00 0.00 30.24 29.75 1fhs n GLN 94 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 1fhs s ILE 95 N 0.00 3.03 -0.03 -0.39 -1.09 -1.26 -5.01 121.20 116.45 1fhs s ILE 95 Ca 0.00 -1.13 0.01 0.00 -2.23 0.00 0.00 60.65 57.31 1fhs s ILE 95 Cb 0.00 -2.31 0.02 0.00 -1.58 0.00 0.00 42.46 38.59 1fhs s ILE 95 CO 0.00 0.31 -0.04 0.12 -1.23 0.00 0.00 174.94 174.10 1fhs s PHE 96 N -0.98 0.63 -0.60 3.97 5.36 -1.26 -3.33 117.98 121.77 1fhs s PHE 96 Ca 0.16 -0.15 -0.22 0.00 -0.96 0.00 0.00 56.93 55.77 1fhs s PHE 96 Cb -0.11 -0.55 0.07 0.00 -0.34 0.00 0.00 43.02 42.09 1fhs s PHE 96 CO 0.07 -0.14 0.86 -0.51 -1.46 0.00 0.00 175.22 174.04 1fhs s LEU 97 N 0.67 4.62 0.14 6.12 1.43 -1.24 -3.87 118.68 126.55 1fhs s LEU 97 Ca -0.08 -0.95 -0.02 0.00 -1.03 0.00 0.00 54.13 52.04 1fhs s LEU 97 Cb -0.12 -2.47 -0.05 0.00 0.03 0.00 0.00 46.19 43.58 1fhs s LEU 97 CO -0.00 -1.26 0.33 -0.60 0.23 0.00 0.00 176.35 175.06 1fhs s ARG 98 N 3.56 3.53 0.00 1.70 6.06 -1.04 -4.95 118.95 127.81 1fhs s ARG 98 Ca 0.20 -0.29 0.00 0.00 -2.50 0.00 0.00 55.73 53.15 1fhs s ARG 98 Cb -0.18 -2.90 0.00 0.00 0.06 0.00 0.00 34.95 31.93 1fhs s ARG 98 CO 0.11 0.48 0.86 -0.40 -2.50 0.00 0.00 175.30 173.86 1fhs n ASP 99 N -0.14 2.43 0.00 -2.12 5.75 -1.26 -2.59 116.55 118.61 1fhs n ASP 99 Ca -0.04 -1.49 0.00 0.00 -0.01 0.00 0.00 54.79 53.25 1fhs n ASP 99 Cb 0.52 -0.46 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 1fhs n ASP 99 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1fhs n ILE 100 N 1.05 0.00 -1.15 2.12 3.06 -1.26 -0.93 119.36 122.25 1fhs n ILE 100 Ca 0.00 0.00 -0.23 0.00 -2.50 0.00 0.00 62.75 60.02 1fhs n ILE 100 Cb 0.31 0.00 0.02 0.00 0.54 0.00 0.00 39.64 40.52 1fhs n ILE 100 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 1fhs n GLU 101 N 9.58 2.14 -3.76 9.51 1.02 -1.26 -4.76 120.64 133.11 1fhs n GLU 101 Ca 0.00 -2.14 -0.28 0.00 -0.02 0.00 0.00 57.16 54.72 1fhs n GLU 101 Cb 0.00 -1.88 -0.16 0.00 -0.02 0.00 0.00 31.44 29.38 1fhs n GLU 101 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1fhs s GLN 102 N -2.26 0.78 -0.30 3.49 2.00 -0.10 -5.09 119.66 118.18 1fhs s GLN 102 Ca 0.44 -0.58 -0.22 0.00 -2.00 0.00 0.00 55.36 53.00 1fhs s GLN 102 Cb 0.33 -2.14 0.20 0.00 0.80 0.00 0.00 33.01 32.20 1fhs s GLN 102 CO -0.07 -0.69 1.40 0.54 -0.50 0.00 0.00 175.29 175.97 1fhs s VAL 103 N 1.77 0.00 -1.11 1.34 0.11 -1.26 -4.81 120.40 116.44 1fhs s VAL 103 Ca -0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1fhs s VAL 103 Cb -0.17 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.68 1fhs s VAL 103 CO -0.10 0.00 0.24 -2.65 -3.33 0.00 0.00 175.10 169.26 1fhs n PRO 104 N 2.06 0.00 -1.45 1.54 -0.02 -1.26 -4.78 135.00 131.09 1fhs n PRO 104 Ca -0.13 0.00 -0.56 0.00 -2.02 0.00 0.00 63.50 60.79 1fhs n PRO 104 Cb 0.57 -1.44 -0.08 0.00 -0.02 0.00 0.00 33.50 32.52 1fhs n PRO 104 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1fhs n GLN 105 N -0.72 0.00 -4.04 -0.52 1.13 -1.26 -4.90 117.38 107.07 1fhs n GLN 105 Ca 0.00 0.00 -0.28 0.00 -1.94 0.00 0.00 57.00 54.78 1fhs n GLN 105 Cb 0.00 -1.28 -0.05 0.00 0.11 0.00 0.00 30.24 29.02 1fhs n GLN 105 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1fhs s GLN 106 N 2.05 2.99 0.00 -1.09 -0.21 -1.26 -5.06 119.66 117.07 1fhs s GLN 106 Ca 0.87 -0.74 -0.30 0.00 0.02 0.00 0.00 55.36 55.21 1fhs s GLN 106 Cb -1.24 -2.74 -0.06 0.00 1.00 0.00 0.00 33.01 29.97 1fhs s GLN 106 CO 0.66 0.53 1.53 -1.25 -2.12 0.00 0.00 175.29 174.63 1fhs s PRO 107 N -2.79 4.23 -0.27 2.91 0.04 -1.26 -4.84 135.00 133.02 1fhs s PRO 107 Ca 0.31 2.11 -0.29 0.00 0.04 0.00 0.00 61.00 63.17 1fhs s PRO 107 Cb -0.11 -3.68 -0.13 0.00 0.04 0.00 0.00 34.50 30.62 1fhs s PRO 107 CO 0.24 -0.69 0.96 2.41 0.04 0.00 0.00 177.00 179.95 1fhs n THR 108 N 4.90 0.00 -1.68 1.26 -1.04 -1.26 -4.66 114.28 111.80 1fhs n THR 108 Ca 0.15 0.00 -0.46 0.00 -2.04 0.00 0.00 64.05 61.70 1fhs n THR 108 Cb 0.43 -0.27 -0.04 0.00 -1.82 0.00 0.00 70.33 68.63 1fhs n THR 108 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1fhs n TYR 109 N 2.28 2.39 -3.89 -1.42 4.02 -1.26 -4.94 117.16 114.35 1fhs n TYR 109 Ca 0.18 0.01 -0.35 0.00 -0.01 0.00 0.00 57.90 57.73 1fhs n TYR 109 Cb -0.02 -2.66 -0.13 0.00 -0.02 0.00 0.00 39.34 36.50 1fhs n TYR 109 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1fhs s VAL 110 N 2.96 3.76 0.00 -0.72 0.11 -1.26 -5.07 120.40 120.18 1fhs s VAL 110 Ca 0.86 -0.36 0.00 0.00 -2.93 0.00 0.00 61.98 59.55 1fhs s VAL 110 Cb -0.62 -2.73 0.00 0.00 -1.53 0.00 0.00 36.38 31.50 1fhs s VAL 110 CO 0.44 0.40 0.00 0.00 -3.33 0.00 0.00 175.10 172.61 1fhs n GLN 111 N 4.76 3.00 0.00 1.54 3.00 -1.26 -5.29 117.38 123.13 1fhs n GLN 111 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.82 1fhs n GLN 111 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.75 1fhs n GLN 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06