#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fhs s ILE 2 N 0.00 -0.07 -0.23 -0.61 -4.36 -1.26 -5.12 121.20 109.55 1fhs s ILE 2 Ca 0.00 0.15 -0.29 0.00 -0.26 0.00 0.00 60.65 60.25 1fhs s ILE 2 Cb 0.00 -0.43 0.01 0.00 1.25 0.00 0.00 42.46 43.28 1fhs s ILE 2 CO 0.00 0.06 1.08 -1.83 0.24 0.00 0.00 174.94 174.49 1fhs s GLU 3 N 1.39 4.24 -0.48 0.37 -1.05 -1.26 -4.96 118.70 116.96 1fhs s GLU 3 Ca -0.08 1.39 -0.28 0.00 -0.15 0.00 0.00 54.97 55.84 1fhs s GLU 3 Cb -0.10 -3.67 0.01 0.00 -0.44 0.00 0.00 34.13 29.93 1fhs s GLU 3 CO -0.09 -0.66 1.42 -1.64 0.95 0.00 0.00 175.26 175.23 1fhs s MET 4 N 3.28 3.45 -0.87 -4.83 -1.94 -1.26 -4.83 119.30 112.30 1fhs s MET 4 Ca 0.46 0.73 -0.25 0.00 -1.71 0.00 0.00 55.69 54.91 1fhs s MET 4 Cb -0.16 -4.07 -0.20 0.00 2.01 0.00 0.00 34.83 32.41 1fhs s MET 4 CO 0.08 -1.73 2.30 1.17 -0.01 0.00 0.00 175.02 176.83 1fhs n LYS 5 N 8.32 0.00 0.00 2.03 4.81 -1.26 -4.85 118.16 127.21 1fhs n LYS 5 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 1fhs n LYS 5 Cb 0.49 -1.26 0.00 0.00 0.02 0.00 0.00 35.03 34.27 1fhs n LYS 5 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1fhs n PRO 6 N 7.14 0.00 -3.76 1.64 -0.02 -1.26 -5.00 135.00 133.74 1fhs n PRO 6 Ca 0.58 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.93 1fhs n PRO 6 Cb 0.04 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.40 1fhs n PRO 6 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1fhs s HIS 7 N 0.00 -0.33 0.00 6.00 2.46 -1.26 -5.15 115.29 117.01 1fhs s HIS 7 Ca 0.00 0.80 0.00 0.00 0.47 0.00 0.00 55.06 56.33 1fhs s HIS 7 Cb 0.00 0.11 0.00 0.00 -0.13 0.00 0.00 32.58 32.56 1fhs s HIS 7 CO 0.00 -0.18 0.00 -2.30 -2.47 0.00 0.00 174.74 169.79 1fhs n PRO 8 N 3.27 0.00 -1.95 2.88 -0.02 -1.26 -4.84 135.00 133.08 1fhs n PRO 8 Ca -0.16 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.31 1fhs n PRO 8 Cb 0.57 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 34.10 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 0.83 -3.79 6.00 -0.00 -1.26 -4.82 117.44 114.40 1fhs n TRP 9 Ca 0.00 -1.47 -0.37 0.00 -0.00 0.00 0.00 57.50 55.66 1fhs n TRP 9 Cb 0.00 -0.22 -0.13 0.00 -0.00 0.00 0.00 31.31 30.97 1fhs n TRP 9 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 177.69 177.81 1fhs s PHE 10 N -2.32 3.28 -0.50 -2.67 2.19 -1.26 0.93 117.98 117.62 1fhs s PHE 10 Ca 0.34 -1.60 -0.10 0.00 0.33 0.00 0.00 56.93 55.90 1fhs s PHE 10 Cb 0.36 -2.32 0.13 0.00 -1.31 0.00 0.00 43.02 39.88 1fhs s PHE 10 CO -0.08 -0.77 0.39 -0.06 1.83 0.00 0.00 175.22 176.53 1fhs s PHE 11 N 1.35 3.42 0.04 10.12 0.40 -0.98 -4.91 117.98 127.42 1fhs s PHE 11 Ca -0.02 -1.84 -0.30 0.00 -0.60 0.00 0.00 56.93 54.17 1fhs s PHE 11 Cb -0.20 -3.55 -0.07 0.00 0.51 0.00 0.00 43.02 39.71 1fhs s PHE 11 CO 0.01 -0.99 1.60 0.20 0.70 0.00 0.00 175.22 176.74 1fhs s GLY 12 N 2.70 1.62 -1.16 4.36 0.00 -1.26 -2.92 107.32 110.65 1fhs s GLY 12 Ca 0.06 1.11 -0.14 0.00 0.00 0.00 0.00 44.72 45.75 1fhs s GLY 12 CO -0.01 2.82 0.36 0.58 0.00 0.00 0.00 173.10 176.85 1fhs n LYS 13 N 5.70 -0.82 -2.13 2.90 2.85 0.41 -4.76 118.16 122.30 1fhs n LYS 13 Ca 0.15 0.09 -0.42 0.00 -1.05 0.00 0.00 58.31 57.08 1fhs n LYS 13 Cb 0.41 -2.90 -0.03 0.00 -0.65 0.00 0.00 35.03 31.86 1fhs n LYS 13 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 177.40 175.85 1fhs s ILE 14 N -2.44 3.35 -0.29 0.58 1.10 -1.15 -4.87 121.20 117.49 1fhs s ILE 14 Ca 0.50 0.87 -0.42 0.00 -0.51 0.00 0.00 60.65 61.10 1fhs s ILE 14 Cb -0.29 -3.56 -0.17 0.00 0.15 0.00 0.00 42.46 38.58 1fhs s ILE 14 CO 0.64 0.03 1.61 -2.65 -2.11 0.00 0.00 174.94 172.45 1fhs n PRO 15 N 4.78 0.71 -0.35 3.50 -0.02 -1.26 -4.53 135.00 137.83 1fhs n PRO 15 Ca 0.13 0.26 0.31 0.00 -2.02 0.00 0.00 63.50 62.18 1fhs n PRO 15 Cb 0.42 -1.87 0.54 0.00 -0.02 0.00 0.00 33.50 32.57 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 4.36 -0.04 0.21 -0.52 0.63 -1.26 0.15 116.66 120.19 1fhs n ARG 16 Ca 0.27 1.09 -0.10 0.00 -0.92 0.00 0.00 57.85 58.18 1fhs n ARG 16 Cb 0.07 -2.08 -0.05 0.00 0.45 0.00 0.00 32.46 30.85 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 1.46 -0.59 -0.77 5.13 0.00 -2.00 -2.93 119.26 119.56 1fhs h ALA 17 Ca 0.73 -0.15 0.16 0.00 0.00 0.00 0.00 54.91 55.64 1fhs h ALA 17 Cb 2.20 0.23 -0.15 0.00 0.00 0.00 0.00 17.79 20.07 1fhs h ALA 17 CO -0.49 -0.57 -0.17 -0.22 0.00 0.00 0.00 179.25 177.80 1fhs h LYS 18 N -1.12 0.01 -0.89 0.00 3.11 0.11 1.29 116.57 119.08 1fhs h LYS 18 Ca -0.06 -0.00 0.14 0.00 -2.81 0.00 0.00 60.65 57.92 1fhs h LYS 18 Cb 0.50 -0.00 -0.15 0.00 -1.00 0.00 0.00 32.23 31.59 1fhs h LYS 18 CO 0.10 0.00 -0.38 0.00 -2.81 0.00 0.00 179.45 176.36 1fhs h ALA 19 N 1.77 0.08 -0.46 5.00 0.00 -0.45 1.19 119.26 126.39 1fhs h ALA 19 Ca 0.38 0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.53 1fhs h ALA 19 Cb 0.59 0.96 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 1fhs h ALA 19 CO -0.78 -0.65 0.29 0.93 0.00 0.00 0.00 179.25 179.03 1fhs h GLU 20 N -0.05 0.62 0.00 0.00 5.08 0.17 -1.80 114.58 118.60 1fhs h GLU 20 Ca 0.31 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1fhs h GLU 20 Cb 0.58 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1fhs h GLU 20 CO -0.91 0.43 0.00 0.39 -1.00 0.00 0.00 179.01 177.92 1fhs n GLU 21 N -4.45 0.00 -0.29 2.33 1.02 0.40 0.13 120.64 119.78 1fhs n GLU 21 Ca 0.04 0.46 -0.03 0.00 -0.02 0.00 0.00 57.16 57.61 1fhs n GLU 21 Cb 0.07 -1.35 0.13 0.00 -0.02 0.00 0.00 31.44 30.27 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 1.17 -0.80 3.49 -0.00 -1.46 0.44 114.93 117.77 1fhs h MET 22 Ca 0.00 -0.13 -0.01 0.00 -0.00 0.00 0.00 59.70 59.56 1fhs h MET 22 Cb 0.00 -0.23 -0.04 0.00 -0.00 0.00 0.00 31.60 31.33 1fhs h MET 22 CO 0.00 0.85 0.46 1.25 -0.00 0.00 0.00 176.91 179.47 1fhs h LEU 23 N 1.18 0.98 -0.88 -0.10 5.85 -1.36 -1.32 115.31 119.66 1fhs h LEU 23 Ca 0.30 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 1fhs h LEU 23 Cb 0.02 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1fhs h LEU 23 CO -0.05 0.78 0.06 0.77 -0.34 0.00 0.00 178.44 179.66 1fhs h SER 24 N 1.10 0.85 0.00 1.25 4.64 0.23 -2.14 113.55 119.48 1fhs h SER 24 Ca 0.28 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1fhs h SER 24 Cb 0.00 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 61.87 1fhs h SER 24 CO -0.05 0.87 0.00 0.29 -0.87 0.00 0.00 176.83 177.07 1fhs n LYS 25 N -4.23 0.55 -4.47 4.77 5.02 0.14 -4.75 118.16 115.20 1fhs n LYS 25 Ca 0.03 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.98 1fhs n LYS 25 Cb 0.28 -1.23 -0.11 0.00 -0.02 0.00 0.00 35.03 33.96 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 0.72 3.20 -0.91 1.97 -1.52 -0.81 -4.98 119.66 117.33 1fhs s GLN 26 Ca 0.00 -0.50 -0.18 0.00 -1.95 0.00 0.00 55.36 52.73 1fhs s GLN 26 Cb 0.00 -2.78 0.15 0.00 -0.22 0.00 0.00 33.01 30.16 1fhs s GLN 26 CO 0.00 0.50 1.07 1.03 -0.25 0.00 0.00 175.29 177.64 1fhs s ARG 27 N -0.34 3.60 0.00 2.91 3.00 -1.26 -4.65 118.95 122.21 1fhs s ARG 27 Ca 0.06 -1.88 0.00 0.00 0.00 0.00 0.00 55.73 53.91 1fhs s ARG 27 Cb -0.12 -4.84 0.00 0.00 0.00 0.00 0.00 34.95 29.99 1fhs s ARG 27 CO 0.02 -1.69 0.00 0.72 0.00 0.00 0.00 175.30 174.35 1fhs n HIS 28 N 6.12 0.00 -1.78 -0.53 8.25 -1.26 -5.06 115.22 120.96 1fhs n HIS 28 Ca 0.22 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.27 1fhs n HIS 28 Cb 0.49 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.57 1fhs n HIS 28 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1fhs s ASP 29 N 0.00 6.41 0.00 0.41 1.01 -1.26 -3.77 116.67 119.48 1fhs s ASP 29 Ca 0.00 2.86 0.00 0.00 0.71 0.00 0.00 52.55 56.12 1fhs s ASP 29 Cb 0.00 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.32 1fhs s ASP 29 CO 0.00 -0.92 0.00 0.61 0.21 0.00 0.00 175.17 175.07 1fhs n GLY 30 N 3.23 2.59 3.31 0.21 0.00 0.41 -4.59 105.19 110.35 1fhs n GLY 30 Ca 0.13 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.61 -3.09 4.61 0.00 -1.25 -1.84 120.51 116.33 1fhs n ALA 31 Ca 0.00 -0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.25 1fhs n ALA 31 Cb 0.00 -1.53 -0.04 0.00 0.00 0.00 0.00 19.45 17.88 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 -1.92 -0.24 0.24 0.00 -0.71 -1.06 0.51 117.98 114.79 1fhs s PHE 32 Ca 0.60 -0.06 0.01 0.00 -1.04 0.00 0.00 56.93 56.43 1fhs s PHE 32 Cb -0.46 0.32 0.01 0.00 -1.21 0.00 0.00 43.02 41.68 1fhs s PHE 32 CO 0.63 -0.74 0.06 1.28 -1.34 0.00 0.00 175.22 175.11 1fhs n LEU 33 N -0.26 0.00 -3.41 -1.99 4.77 -0.66 -4.32 117.00 111.12 1fhs n LEU 33 Ca -0.16 -1.42 -0.16 0.00 -0.03 0.00 0.00 56.01 54.24 1fhs n LEU 33 Cb 0.64 0.11 -0.10 0.00 -2.33 0.00 0.00 43.42 41.74 1fhs n LEU 33 CO 0.16 -0.27 -0.16 -0.63 -1.33 0.00 0.00 177.39 175.16 1fhs s ILE 34 N -1.66 -0.42 0.09 -0.08 1.01 0.26 -2.80 121.20 117.61 1fhs s ILE 34 Ca 0.04 -0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.31 1fhs s ILE 34 Cb -0.00 -0.90 -0.05 0.00 0.01 0.00 0.00 42.46 41.52 1fhs s ILE 34 CO 0.03 -0.37 0.30 0.00 0.00 0.00 0.00 174.94 174.90 1fhs s ARG 35 N 2.38 3.55 -0.00 2.79 1.70 -1.15 -2.31 118.95 125.90 1fhs s ARG 35 Ca 0.09 -0.22 0.05 0.00 -0.47 0.00 0.00 55.73 55.18 1fhs s ARG 35 Cb -0.14 -2.95 -0.03 0.00 -0.57 0.00 0.00 34.95 31.26 1fhs s ARG 35 CO -0.26 0.54 -0.15 -2.00 -1.08 0.00 0.00 175.30 172.35 1fhs s GLU 36 N -2.49 2.33 0.00 3.89 2.12 -1.15 -3.31 118.70 120.09 1fhs s GLU 36 Ca 0.37 -0.82 0.00 0.00 0.36 0.00 0.00 54.97 54.88 1fhs s GLU 36 Cb -0.13 -2.32 0.00 0.00 0.26 0.00 0.00 34.13 31.95 1fhs s GLU 36 CO 0.25 0.58 0.00 0.45 -0.54 0.00 0.00 175.26 176.00 1fhs n SER 37 N 1.85 -1.04 0.00 -1.70 2.88 -1.24 0.16 113.62 114.53 1fhs n SER 37 Ca -0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 1fhs n SER 37 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1fhs n SER 37 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1fhs n GLU 38 N -1.04 0.00 -0.63 -1.46 2.13 -1.26 -3.89 120.64 114.49 1fhs n GLU 38 Ca 0.00 0.04 -0.12 0.00 0.66 0.00 0.00 57.16 57.73 1fhs n GLU 38 Cb 0.00 -0.53 0.09 0.00 0.27 0.00 0.00 31.44 31.26 1fhs n GLU 38 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1fhs n SER 39 N -2.46 3.58 -3.65 4.31 3.41 -1.26 -4.79 113.62 112.77 1fhs n SER 39 Ca 0.00 -2.82 -0.01 0.00 -0.26 0.00 0.00 58.87 55.78 1fhs n SER 39 Cb 0.00 -0.70 -0.07 0.00 -0.26 0.00 0.00 64.21 63.19 1fhs n SER 39 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fhs s ALA 40 N -1.66 -2.41 0.31 7.33 0.00 -1.26 -5.15 121.76 118.92 1fhs s ALA 40 Ca 0.29 1.77 0.00 0.00 0.00 0.00 0.00 51.96 54.01 1fhs s ALA 40 Cb 0.24 -1.88 0.00 0.00 0.00 0.00 0.00 23.12 21.48 1fhs s ALA 40 CO 0.05 -0.17 0.00 -0.35 0.00 0.00 0.00 175.76 175.29 1fhs n PRO 41 N 2.07 3.30 0.00 0.00 -0.04 -1.26 -3.76 135.00 135.30 1fhs n PRO 41 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1fhs n PRO 41 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 1fhs n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fhs n GLY 42 N 3.07 1.10 3.52 0.55 0.00 -1.26 -4.74 105.19 107.43 1fhs n GLY 42 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1fhs n GLY 42 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fhs s ASP 43 N 0.00 6.34 -0.07 1.61 -1.08 -1.26 -4.40 116.67 117.81 1fhs s ASP 43 Ca 0.00 -0.34 -0.00 0.00 -0.52 0.00 0.00 52.55 51.69 1fhs s ASP 43 Cb 0.00 -2.36 0.02 0.00 -1.46 0.00 0.00 42.92 39.13 1fhs s ASP 43 CO 0.00 -0.92 -0.04 -0.36 0.52 0.00 0.00 175.17 174.38 1fhs s PHE 44 N 3.14 0.93 -0.05 -5.34 0.08 -1.24 -3.58 117.98 111.92 1fhs s PHE 44 Ca 0.25 -0.34 0.01 0.00 0.12 0.00 0.00 56.93 56.98 1fhs s PHE 44 Cb -0.14 -0.88 0.02 0.00 -0.57 0.00 0.00 43.02 41.45 1fhs s PHE 44 CO 0.19 -0.33 -0.05 -1.54 -0.10 0.00 0.00 175.22 173.39 1fhs s SER 45 N 1.56 1.10 -0.33 1.36 1.04 -1.21 0.14 113.70 117.36 1fhs s SER 45 Ca -0.00 -0.15 -0.26 0.00 0.48 0.00 0.00 55.95 56.03 1fhs s SER 45 Cb -0.13 -0.49 0.01 0.00 0.10 0.00 0.00 66.02 65.51 1fhs s SER 45 CO -0.04 -0.06 0.90 -0.22 0.98 0.00 0.00 173.24 174.80 1fhs s LEU 46 N 0.99 4.03 0.06 2.42 0.20 0.17 -2.94 118.68 123.61 1fhs s LEU 46 Ca -0.10 0.75 -0.12 0.00 0.69 0.00 0.00 54.13 55.34 1fhs s LEU 46 Cb -0.14 -3.25 -0.06 0.00 -0.43 0.00 0.00 46.19 42.31 1fhs s LEU 46 CO -0.00 -0.75 0.43 -0.44 -0.29 0.00 0.00 176.35 175.30 1fhs s SER 47 N 1.69 6.74 0.00 3.68 0.01 -1.12 -0.64 113.70 124.06 1fhs s SER 47 Ca 0.37 0.90 0.02 0.00 1.31 0.00 0.00 55.95 58.56 1fhs s SER 47 Cb -0.13 -2.22 -0.01 0.00 0.21 0.00 0.00 66.02 63.87 1fhs s SER 47 CO 0.15 0.22 -0.07 -0.69 0.41 0.00 0.00 173.24 173.26 1fhs s VAL 48 N -1.29 0.53 -0.79 3.43 1.01 -0.52 -1.65 120.40 121.11 1fhs s VAL 48 Ca 0.30 -0.40 -0.25 0.00 0.00 0.00 0.00 61.98 61.63 1fhs s VAL 48 Cb -0.15 -0.47 0.05 0.00 0.00 0.00 0.00 36.38 35.81 1fhs s VAL 48 CO 0.16 0.07 1.23 -0.75 0.00 0.00 0.00 175.10 175.81 1fhs s LYS 49 N -0.37 3.28 -0.07 2.72 2.47 0.18 0.74 119.74 128.69 1fhs s LYS 49 Ca 0.01 -0.66 0.01 0.00 -1.56 0.00 0.00 55.97 53.76 1fhs s LYS 49 Cb -0.04 -4.48 -0.03 0.00 -1.46 0.00 0.00 37.83 31.83 1fhs s LYS 49 CO -0.00 -2.06 -0.06 0.12 0.16 0.00 0.00 175.35 173.51 1fhs s PHE 50 N 4.99 2.96 0.34 4.03 5.36 -0.93 0.15 117.98 134.89 1fhs s PHE 50 Ca 0.34 0.04 -0.25 0.00 -0.96 0.00 0.00 56.93 56.10 1fhs s PHE 50 Cb -0.08 -1.72 -0.14 0.00 -0.34 0.00 0.00 43.02 40.74 1fhs s PHE 50 CO 0.07 0.34 0.68 0.41 -1.46 0.00 0.00 175.22 175.27 1fhs n GLY 51 N 2.22 -1.17 4.12 13.12 0.00 -1.26 0.33 105.19 122.54 1fhs n GLY 51 Ca -0.18 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1fhs n GLY 51 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1fhs n ASN 52 N 1.38 0.00 -3.61 1.61 5.15 -1.26 -4.84 115.26 113.69 1fhs n ASN 52 Ca 0.12 0.00 -0.05 0.00 -0.60 0.00 0.00 54.58 54.05 1fhs n ASN 52 Cb 0.35 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.56 1fhs n ASN 52 CO 0.00 0.00 0.00 1.51 1.40 0.00 0.00 177.26 180.17 1fhs s ASP 53 N 0.00 -0.16 -0.01 1.20 1.47 0.15 -5.12 116.67 114.20 1fhs s ASP 53 Ca 0.00 0.10 -0.30 0.00 1.18 0.00 0.00 52.55 53.53 1fhs s ASP 53 Cb 0.00 0.14 -0.05 0.00 -0.34 0.00 0.00 42.92 42.68 1fhs s ASP 53 CO 0.00 -0.19 1.30 -0.69 0.68 0.00 0.00 175.17 176.26 1fhs s VAL 54 N -1.65 3.95 0.49 2.11 1.01 -1.25 -2.18 120.40 122.88 1fhs s VAL 54 Ca 0.07 1.32 -0.03 0.00 0.00 0.00 0.00 61.98 63.34 1fhs s VAL 54 Cb -0.01 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.51 1fhs s VAL 54 CO -0.04 0.01 0.75 -1.58 0.00 0.00 0.00 175.10 174.24 1fhs s GLN 55 N 2.15 3.17 -0.07 2.72 0.74 0.23 -4.87 119.66 123.71 1fhs s GLN 55 Ca 0.60 -0.18 -0.00 0.00 0.05 0.00 0.00 55.36 55.83 1fhs s GLN 55 Cb -0.29 -2.45 0.02 0.00 1.10 0.00 0.00 33.01 31.40 1fhs s GLN 55 CO 0.25 -0.34 -0.04 -1.58 -0.55 0.00 0.00 175.29 173.03 1fhs s HIS 56 N -2.70 0.93 0.05 1.67 5.65 -1.26 -1.44 115.29 118.19 1fhs s HIS 56 Ca 0.49 -0.33 0.08 0.00 0.25 0.00 0.00 55.06 55.55 1fhs s HIS 56 Cb -0.10 -0.87 -0.03 0.00 -1.18 0.00 0.00 32.58 30.40 1fhs s HIS 56 CO 0.41 -0.32 -0.23 -0.06 -0.65 0.00 0.00 174.74 173.89 1fhs s PHE 57 N 1.50 1.97 -0.29 3.88 0.08 0.19 -5.00 117.98 120.31 1fhs s PHE 57 Ca -0.01 -0.39 -0.08 0.00 0.12 0.00 0.00 56.93 56.57 1fhs s PHE 57 Cb -0.13 -1.17 -0.01 0.00 -0.57 0.00 0.00 43.02 41.14 1fhs s PHE 57 CO -0.04 0.11 0.11 0.15 -0.10 0.00 0.00 175.22 175.45 1fhs s LYS 58 N -1.24 3.36 -0.62 0.44 1.02 -1.26 0.45 119.74 121.89 1fhs s LYS 58 Ca 0.09 -0.69 -0.22 0.00 0.02 0.00 0.00 55.97 55.17 1fhs s LYS 58 Cb -0.09 -3.45 0.07 0.00 -0.52 0.00 0.00 37.83 33.84 1fhs s LYS 58 CO 0.02 -0.36 0.89 0.08 -0.92 0.00 0.00 175.35 175.06 1fhs s VAL 59 N 1.58 4.45 0.43 3.17 1.01 0.36 -3.95 120.40 127.46 1fhs s VAL 59 Ca 0.05 -0.38 -0.16 0.00 0.00 0.00 0.00 61.98 61.48 1fhs s VAL 59 Cb -0.17 -4.61 -0.08 0.00 0.00 0.00 0.00 36.38 31.52 1fhs s VAL 59 CO 0.04 -1.31 0.88 -0.76 0.00 0.00 0.00 175.10 173.95 1fhs s LEU 60 N 3.73 3.83 0.00 3.92 1.43 0.81 -3.63 118.68 128.77 1fhs s LEU 60 Ca 0.21 1.44 0.00 0.00 -1.03 0.00 0.00 54.13 54.75 1fhs s LEU 60 Cb -0.18 -4.31 0.00 0.00 0.03 0.00 0.00 46.19 41.73 1fhs s LEU 60 CO 0.11 -0.41 0.00 -2.11 0.23 0.00 0.00 176.35 174.17 1fhs n ARG 61 N -1.05 0.00 0.00 1.70 1.85 -1.26 -3.06 116.66 114.84 1fhs n ARG 61 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.90 1fhs n ARG 61 Cb 0.54 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.95 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 0.00 0.00 2.89 2.03 -0.03 -4.19 116.55 117.26 1fhs n ASP 62 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1fhs n ASP 62 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 0.00 0.00 0.13 0.27 0.00 -1.26 -2.24 105.19 102.08 1fhs n GLY 63 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.65 1.13 0.00 4.61 0.00 -1.26 -4.05 120.51 118.29 1fhs n ALA 64 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.51 1fhs n ALA 64 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.31 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 1.56 -0.31 7.00 0.00 0.00 -1.26 -4.92 105.19 107.26 1fhs n GLY 65 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.30 0.00 -3.56 1.61 5.02 -0.95 -4.31 118.16 114.67 1fhs n LYS 66 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 1fhs n LYS 66 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 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 3.39 0.03 2.13 2.02 0.09 -0.85 117.35 124.16 1fhs s TYR 67 Ca 0.00 0.47 -0.25 0.00 -0.37 0.00 0.00 57.07 56.92 1fhs s TYR 67 Cb 0.00 -2.35 0.06 0.00 -0.40 0.00 0.00 41.96 39.27 1fhs s TYR 67 CO 0.00 0.13 0.58 -0.59 -1.57 0.00 0.00 175.55 174.10 1fhs s PHE 68 N 0.83 -0.51 -0.21 2.71 -0.71 -1.17 0.14 117.98 119.06 1fhs s PHE 68 Ca 0.14 0.68 -0.07 0.00 -1.04 0.00 0.00 56.93 56.63 1fhs s PHE 68 Cb -0.13 0.39 -0.20 0.00 -1.21 0.00 0.00 43.02 41.87 1fhs s PHE 68 CO 0.04 -0.65 0.03 1.28 -1.34 0.00 0.00 175.22 174.58 1fhs n LEU 69 N 0.51 2.54 0.00 -1.99 4.32 -1.25 -0.13 117.00 120.99 1fhs n LEU 69 Ca -0.19 0.14 0.00 0.00 -0.02 0.00 0.00 56.01 55.95 1fhs n LEU 69 Cb 0.60 -0.98 0.00 0.00 -1.62 0.00 0.00 43.42 41.42 1fhs n LEU 69 CO 0.20 0.76 0.00 0.79 -1.22 0.00 0.00 177.39 177.92 1fhs n TRP 70 N -3.66 0.00 0.00 -1.77 7.02 -1.26 -4.82 117.44 112.94 1fhs n TRP 70 Ca -0.40 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.08 1fhs n TRP 70 Cb 0.95 0.09 0.00 0.00 -2.42 0.00 0.00 31.31 29.93 1fhs n TRP 70 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 1fhs n VAL 71 N -1.28 0.00 -1.60 -0.99 0.31 -1.26 -4.98 118.33 108.53 1fhs n VAL 71 Ca 0.00 0.00 -0.50 0.00 -0.01 0.00 0.00 64.34 63.83 1fhs n VAL 71 Cb 0.00 -0.60 -0.05 0.00 -0.91 0.00 0.00 33.84 32.28 1fhs n VAL 71 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1fhs n VAL 72 N -0.65 0.29 -3.28 2.52 0.24 -1.26 -4.94 118.33 111.25 1fhs n VAL 72 Ca 0.00 -0.07 -0.22 0.00 -2.04 0.00 0.00 64.34 62.01 1fhs n VAL 72 Cb 0.00 -0.93 0.05 0.00 -1.47 0.00 0.00 33.84 31.49 1fhs n VAL 72 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1fhs s LYS 73 N 0.25 2.23 -0.15 7.34 1.02 -1.26 -4.30 119.74 124.87 1fhs s LYS 73 Ca 0.80 -1.81 -0.10 0.00 0.02 0.00 0.00 55.97 54.88 1fhs s LYS 73 Cb -0.88 -2.48 0.05 0.00 -0.52 0.00 0.00 37.83 34.00 1fhs s LYS 73 CO 0.47 -0.88 0.37 -0.06 -0.92 0.00 0.00 175.35 174.33 1fhs s PHE 74 N -2.74 -0.49 -1.45 3.18 0.08 0.38 -4.96 117.98 111.98 1fhs s PHE 74 Ca 0.54 1.09 0.14 0.00 0.12 0.00 0.00 56.93 58.83 1fhs s PHE 74 Cb -0.04 0.18 0.73 0.00 -0.57 0.00 0.00 43.02 43.32 1fhs s PHE 74 CO 0.34 -0.27 1.38 0.27 -0.10 0.00 0.00 175.22 176.85 1fhs n ASN 75 N 3.79 0.00 -3.58 1.36 2.04 -1.26 -0.73 115.26 116.88 1fhs n ASN 75 Ca -0.20 0.06 -0.11 0.00 -0.44 0.00 0.00 54.58 53.89 1fhs n ASN 75 Cb 0.56 -0.27 -0.05 0.00 -2.53 0.00 0.00 39.78 37.48 1fhs n ASN 75 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 1fhs s SER 76 N -2.55 -0.40 0.27 0.53 0.01 -1.26 -4.86 113.70 105.45 1fhs s SER 76 Ca 0.14 0.47 -0.01 0.00 1.31 0.00 0.00 55.95 57.86 1fhs s SER 76 Cb 0.10 0.37 0.61 0.00 0.21 0.00 0.00 66.02 67.31 1fhs s SER 76 CO 0.22 -0.35 1.64 -0.07 0.41 0.00 0.00 173.24 175.09 1fhs h LEU 77 N 2.73 -0.14 -0.89 2.44 3.38 -1.95 1.21 115.31 122.10 1fhs h LEU 77 Ca -0.20 0.20 0.12 0.00 0.09 0.00 0.00 57.88 58.09 1fhs h LEU 77 Cb 1.16 0.30 -0.08 0.00 0.09 0.00 0.00 40.66 42.13 1fhs h LEU 77 CO 0.30 -0.17 0.52 -1.13 0.09 0.00 0.00 178.44 178.05 1fhs h ASN 78 N 0.17 0.72 0.01 -0.43 -1.24 -1.98 0.31 115.58 113.15 1fhs h ASN 78 Ca 0.50 0.06 -0.04 0.00 0.71 0.00 0.00 56.30 57.53 1fhs h ASN 78 Cb 0.97 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.94 1fhs h ASN 78 CO -0.67 0.37 -0.11 -0.08 -1.29 0.00 0.00 177.43 175.66 1fhs h GLU 79 N 0.81 0.22 0.08 6.67 4.57 0.10 0.91 114.58 127.94 1fhs h GLU 79 Ca 0.45 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.58 1fhs h GLU 79 Cb 0.50 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1fhs h GLU 79 CO -0.29 0.34 -0.04 1.25 -1.18 0.00 0.00 179.01 179.10 1fhs h LEU 80 N 0.21 -0.09 0.00 1.64 6.46 0.90 -0.70 115.31 123.73 1fhs h LEU 80 Ca 0.04 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.66 1fhs h LEU 80 Cb 0.33 0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.28 1fhs h LEU 80 CO 0.02 0.09 0.00 0.52 -0.62 0.00 0.00 178.44 178.45 1fhs n VAL 81 N -5.06 0.00 -0.25 1.05 0.31 0.59 -0.23 118.33 114.74 1fhs n VAL 81 Ca -0.08 1.25 0.09 0.00 -0.01 0.00 0.00 64.34 65.58 1fhs n VAL 81 Cb 0.13 -2.11 0.18 0.00 -0.91 0.00 0.00 33.84 31.13 1fhs n VAL 81 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1fhs n ASP 82 N -1.43 -0.13 0.09 4.52 2.03 0.30 0.15 116.55 122.08 1fhs n ASP 82 Ca 0.00 1.21 -0.05 0.00 0.52 0.00 0.00 54.79 56.48 1fhs n ASP 82 Cb 0.00 -0.42 0.13 0.00 -0.72 0.00 0.00 41.12 40.11 1fhs n ASP 82 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 1fhs h TYR 83 N 0.00 0.29 -0.01 -0.67 3.20 -0.82 -3.08 116.97 115.88 1fhs h TYR 83 Ca 0.41 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 62.17 1fhs h TYR 83 Cb 0.79 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.01 1fhs h TYR 83 CO -0.41 0.76 -0.63 0.72 -1.64 0.00 0.00 178.16 176.96 1fhs n HIS 84 N -3.88 0.00 -0.48 -3.82 8.25 0.41 -4.27 115.22 111.42 1fhs n HIS 84 Ca -0.02 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.40 1fhs n HIS 84 Cb 0.60 -0.02 0.01 0.00 1.12 0.00 0.00 29.99 31.70 1fhs n HIS 84 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1fhs n ARG 85 N -0.62 1.20 0.00 -0.41 1.85 0.39 -3.37 116.66 115.70 1fhs n ARG 85 Ca 0.08 -0.39 0.00 0.00 -1.00 0.00 0.00 57.85 56.53 1fhs n ARG 85 Cb 0.41 -1.15 0.00 0.00 -1.05 0.00 0.00 32.46 30.66 1fhs n ARG 85 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1fhs n SER 86 N 1.13 0.00 -1.60 2.89 3.41 -1.26 -4.83 113.62 113.36 1fhs n SER 86 Ca 0.08 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.62 1fhs n SER 86 Cb 0.53 0.15 0.02 0.00 -0.26 0.00 0.00 64.21 64.65 1fhs n SER 86 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1fhs n THR 87 N -1.93 2.18 -2.13 6.66 -2.24 -1.26 -4.97 114.28 110.59 1fhs n THR 87 Ca 0.00 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 1fhs n THR 87 Cb 0.00 -1.34 0.00 0.00 -2.10 0.00 0.00 70.33 66.89 1fhs n THR 87 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1fhs n SER 88 N 0.86 -2.43 -2.72 3.42 2.88 -1.22 -4.46 113.62 109.96 1fhs n SER 88 Ca 0.13 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.63 1fhs n SER 88 Cb 0.57 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 64.12 1fhs n SER 88 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 1fhs n VAL 89 N -0.77 0.44 0.00 2.46 3.14 -1.26 -4.73 118.33 117.62 1fhs n VAL 89 Ca 0.00 -1.85 0.00 0.00 -2.96 0.00 0.00 64.34 59.53 1fhs n VAL 89 Cb 0.00 1.03 0.00 0.00 -1.06 0.00 0.00 33.84 33.81 1fhs n VAL 89 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1fhs n SER 90 N -0.92 0.00 0.00 6.55 2.88 -1.26 -4.89 113.62 115.98 1fhs n SER 90 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 1fhs n SER 90 Cb 0.85 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.31 1fhs n SER 90 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1fhs n ARG 91 N 0.00 -0.15 -3.30 -1.46 1.74 -1.26 -3.06 116.66 109.17 1fhs n ARG 91 Ca 0.00 0.04 -0.23 0.00 -0.77 0.00 0.00 57.85 56.89 1fhs n ARG 91 Cb 0.00 -4.50 0.00 0.00 -1.02 0.00 0.00 32.46 26.94 1fhs n ARG 91 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1fhs n ASN 92 N -0.07 -4.04 -2.69 0.55 0.23 -1.26 -4.79 115.26 103.18 1fhs n ASN 92 Ca 0.00 -0.36 -0.05 0.00 -0.53 0.00 0.00 54.58 53.63 1fhs n ASN 92 Cb 0.04 -3.33 0.09 0.00 -2.08 0.00 0.00 39.78 34.50 1fhs n ASN 92 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1fhs n GLN 93 N -3.75 0.53 0.00 -3.83 10.64 -1.17 -4.84 117.38 114.96 1fhs n GLN 93 Ca -0.03 -1.21 0.00 0.00 -1.83 0.00 0.00 57.00 53.93 1fhs n GLN 93 Cb 0.55 -0.40 0.00 0.00 -0.86 0.00 0.00 30.24 29.53 1fhs n GLN 93 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 1fhs n GLN 94 N 0.20 0.00 -3.98 2.61 7.27 -1.26 -5.09 117.38 117.13 1fhs n GLN 94 Ca -0.05 0.00 -0.32 0.00 0.07 0.00 0.00 57.00 56.70 1fhs n GLN 94 Cb 0.73 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 33.33 1fhs n GLN 94 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 1fhs s ILE 95 N -0.60 5.09 -0.14 1.69 -1.09 -1.26 -4.99 121.20 119.90 1fhs s ILE 95 Ca 0.00 -0.38 -0.10 0.00 -2.23 0.00 0.00 60.65 57.94 1fhs s ILE 95 Cb 0.00 -3.40 0.04 0.00 -1.58 0.00 0.00 42.46 37.52 1fhs s ILE 95 CO 0.00 0.26 0.36 -0.36 -1.23 0.00 0.00 174.94 173.97 1fhs s PHE 96 N -1.34 -0.45 -0.28 3.97 0.08 -1.26 -3.47 117.98 115.22 1fhs s PHE 96 Ca 0.28 1.04 -0.20 0.00 0.12 0.00 0.00 56.93 58.17 1fhs s PHE 96 Cb -0.12 0.16 -0.01 0.00 -0.57 0.00 0.00 43.02 42.48 1fhs s PHE 96 CO 0.20 -0.24 0.63 -0.51 -0.10 0.00 0.00 175.22 175.20 1fhs s LEU 97 N 0.71 4.10 0.09 -0.37 1.43 -1.26 -3.78 118.68 119.61 1fhs s LEU 97 Ca -0.04 0.56 0.10 0.00 -1.03 0.00 0.00 54.13 53.72 1fhs s LEU 97 Cb -0.05 -2.84 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 1fhs s LEU 97 CO -0.05 -0.44 -0.25 -0.60 0.23 0.00 0.00 176.35 175.24 1fhs s ARG 98 N 2.58 1.47 -0.07 1.70 6.06 -0.77 -4.87 118.95 125.04 1fhs s ARG 98 Ca 0.26 -1.21 -0.29 0.00 -2.50 0.00 0.00 55.73 51.99 1fhs s ARG 98 Cb -0.15 -1.80 -0.07 0.00 0.06 0.00 0.00 34.95 32.99 1fhs s ARG 98 CO 0.10 0.44 2.02 -0.51 -2.50 0.00 0.00 175.30 174.86 1fhs s ASP 99 N -1.71 6.10 0.00 -2.12 1.01 -1.26 -2.58 116.67 116.12 1fhs s ASP 99 Ca 0.11 2.32 0.00 0.00 0.71 0.00 0.00 52.55 55.69 1fhs s ASP 99 Cb -0.10 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.31 1fhs s ASP 99 CO 0.04 -1.38 0.75 0.00 0.21 0.00 0.00 175.17 174.79 1fhs n ILE 100 N 6.38 0.75 -3.69 0.77 3.06 -1.26 -4.61 119.36 120.75 1fhs n ILE 100 Ca 0.23 -0.07 -0.11 0.00 -2.50 0.00 0.00 62.75 60.30 1fhs n ILE 100 Cb 0.43 -0.92 -0.11 0.00 0.54 0.00 0.00 39.64 39.57 1fhs n ILE 100 CO 0.00 0.00 0.00 -1.61 -2.50 0.00 0.00 176.55 172.44 1fhs s GLU 101 N 0.48 0.31 0.15 9.51 0.41 -1.26 -4.99 118.70 123.31 1fhs s GLU 101 Ca 0.00 0.78 -0.31 0.00 -0.41 0.00 0.00 54.97 55.03 1fhs s GLU 101 Cb 0.00 0.02 -0.10 0.00 -1.78 0.00 0.00 34.13 32.28 1fhs s GLU 101 CO 0.00 -0.19 1.58 -1.14 -0.49 0.00 0.00 175.26 175.02 1fhs s GLN 102 N 1.73 4.21 0.23 1.61 2.00 -1.26 -4.88 119.66 123.30 1fhs s GLN 102 Ca -0.07 2.36 -0.30 0.00 -2.00 0.00 0.00 55.36 55.35 1fhs s GLN 102 Cb -0.10 -3.22 -0.15 0.00 0.80 0.00 0.00 33.01 30.34 1fhs s GLN 102 CO -0.11 -0.62 1.02 1.55 -0.50 0.00 0.00 175.29 176.62 1fhs n VAL 103 N 4.07 1.51 0.00 1.34 3.14 -1.26 -4.71 118.33 122.42 1fhs n VAL 103 Ca 0.14 -0.38 0.00 0.00 -2.96 0.00 0.00 64.34 61.14 1fhs n VAL 103 Cb 0.39 -0.81 0.00 0.00 -1.06 0.00 0.00 33.84 32.36 1fhs n VAL 103 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1fhs n PRO 104 N 1.20 0.00 -1.52 1.45 -0.02 -1.26 -4.89 135.00 129.96 1fhs n PRO 104 Ca 0.13 0.09 0.03 0.00 -2.02 0.00 0.00 63.50 61.73 1fhs n PRO 104 Cb 0.28 -1.63 -0.01 0.00 -0.02 0.00 0.00 33.50 32.12 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 -0.94 -3.67 0.16 -0.52 6.02 -1.26 -4.97 117.38 112.19 1fhs n GLN 105 Ca 0.00 2.87 0.00 0.00 -0.01 0.00 0.00 57.00 59.86 1fhs n GLN 105 Cb 0.13 -3.72 0.00 0.00 1.02 0.00 0.00 30.24 27.67 1fhs n GLN 105 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1fhs n GLN 106 N -2.84 0.00 -1.71 -1.09 6.02 -1.26 -5.01 117.38 111.49 1fhs n GLN 106 Ca -0.01 0.00 -0.58 0.00 -0.01 0.00 0.00 57.00 56.39 1fhs n GLN 106 Cb 0.47 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.66 1fhs n GLN 106 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1fhs n PRO 107 N -3.22 1.02 -1.96 -1.09 -0.02 -1.26 -4.19 135.00 124.28 1fhs n PRO 107 Ca 0.00 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1fhs n PRO 107 Cb 0.00 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1fhs n PRO 107 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1fhs n THR 108 N 4.36-11.21 0.00 3.45 -1.04 -1.26 -5.08 114.28 103.50 1fhs n THR 108 Ca 0.26 2.61 0.00 0.00 -2.04 0.00 0.00 64.05 64.89 1fhs n THR 108 Cb 0.11 -5.26 0.00 0.00 -1.82 0.00 0.00 70.33 63.37 1fhs n THR 108 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1fhs n TYR 109 N 1.48 0.00 -2.68 -1.42 9.36 -1.26 -5.07 117.16 117.58 1fhs n TYR 109 Ca 0.00 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.17 1fhs n TYR 109 Cb 0.00 0.00 0.05 0.00 -0.63 0.00 0.00 39.34 38.76 1fhs n TYR 109 CO 0.00 0.00 0.00 1.55 0.22 0.00 0.00 176.86 178.63 1fhs n VAL 110 N 0.00 0.00 -3.51 2.97 3.14 -1.26 -5.10 118.33 114.57 1fhs n VAL 110 Ca 0.00 -1.00 -0.38 0.00 -2.96 0.00 0.00 64.34 60.00 1fhs n VAL 110 Cb 0.00 0.82 -0.10 0.00 -1.06 0.00 0.00 33.84 33.51 1fhs n VAL 110 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1fhs s GLN 111 N 0.11 4.03 0.00 1.45 -2.07 -1.26 -5.29 119.66 116.62 1fhs s GLN 111 Ca 0.12 -0.12 0.25 0.00 -1.82 0.00 0.00 55.36 53.80 1fhs s GLN 111 Cb 0.21 -3.62 0.50 0.00 -1.09 0.00 0.00 33.01 29.01 1fhs s GLN 111 CO -0.06 -0.15 1.43 0.00 -1.32 0.00 0.00 175.29 175.20