#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 3.12 -0.98 -0.61 1.09 -1.26 -3.41 121.20 119.15 1fhs s ILE 2 Ca 0.00 -0.06 -0.16 0.00 -1.10 0.00 0.00 60.65 59.33 1fhs s ILE 2 Cb 0.00 -3.29 0.02 0.00 -1.06 0.00 0.00 42.46 38.13 1fhs s ILE 2 CO 0.00 -0.28 0.30 -1.84 -0.10 0.00 0.00 174.94 173.03 1fhs n GLU 3 N 8.90 -0.63 -2.59 2.79 0.28 -1.26 -4.81 120.64 123.32 1fhs n GLU 3 Ca 0.41 -0.04 -0.30 0.00 -0.16 0.00 0.00 57.16 57.08 1fhs n GLU 3 Cb 0.47 -1.94 -0.01 0.00 1.43 0.00 0.00 31.44 31.39 1fhs n GLU 3 CO 0.00 0.00 0.00 -0.12 -0.16 0.00 0.00 177.13 176.85 1fhs n MET 4 N -3.84 3.46 0.00 3.44 1.56 -1.22 -4.79 117.12 115.73 1fhs n MET 4 Ca -0.14 -4.54 0.00 0.00 -0.27 0.00 0.00 57.70 52.75 1fhs n MET 4 Cb 0.45 -2.27 0.00 0.00 2.15 0.00 0.00 33.22 33.55 1fhs n MET 4 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41 1fhs n LYS 5 N -0.37 0.00 -1.99 2.12 4.81 -1.26 -4.50 118.16 116.96 1fhs n LYS 5 Ca 0.39 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.40 1fhs n LYS 5 Cb 0.49 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.51 1fhs n LYS 5 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1fhs s PRO 6 N 0.00 4.07 0.00 1.64 0.04 -1.26 -4.43 135.00 135.05 1fhs s PRO 6 Ca 0.00 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.15 1fhs s PRO 6 Cb 0.00 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.52 1fhs s PRO 6 CO 0.00 -0.99 0.00 1.58 0.04 0.00 0.00 177.00 177.63 1fhs n HIS 7 N 7.58 -0.15 0.00 0.56 -0.00 -1.26 -4.91 115.22 117.04 1fhs n HIS 7 Ca 0.18 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.36 1fhs n HIS 7 Cb 0.43 0.03 0.00 0.00 -0.12 0.00 0.00 29.99 30.33 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 -1.24 0.00 -1.16 1.57 -0.02 -1.26 -4.97 135.00 127.92 1fhs n PRO 8 Ca 0.00 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.42 1fhs n PRO 8 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.44 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 -0.23 -3.68 6.00 4.27 -1.26 -5.03 117.44 117.51 1fhs n TRP 9 Ca 0.00 -0.60 -0.37 0.00 -3.89 0.00 0.00 57.50 52.64 1fhs n TRP 9 Cb 0.00 0.60 -0.12 0.00 -1.36 0.00 0.00 31.31 30.44 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 0.01 3.15 -0.36 -2.67 0.40 -1.26 -2.96 117.98 114.29 1fhs s PHE 10 Ca 0.01 -0.15 -0.07 0.00 -0.60 0.00 0.00 56.93 56.12 1fhs s PHE 10 Cb 0.05 -2.30 0.05 0.00 0.51 0.00 0.00 43.02 41.33 1fhs s PHE 10 CO -0.01 -0.25 0.15 -0.06 0.70 0.00 0.00 175.22 175.75 1fhs s PHE 11 N 1.66 3.28 0.00 0.36 0.40 -1.08 -4.97 117.98 117.63 1fhs s PHE 11 Ca 0.07 -1.43 0.00 0.00 -0.60 0.00 0.00 56.93 54.97 1fhs s PHE 11 Cb -0.15 -2.47 0.00 0.00 0.51 0.00 0.00 43.02 40.91 1fhs s PHE 11 CO 0.07 -0.75 0.00 0.41 0.70 0.00 0.00 175.22 175.65 1fhs n GLY 12 N 4.85 0.00 2.23 4.36 0.00 -1.26 -2.90 105.19 112.47 1fhs n GLY 12 Ca -0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 1fhs n GLY 12 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1fhs n LYS 13 N 0.00 3.40 -1.57 1.61 2.85 -1.26 0.12 118.16 123.30 1fhs n LYS 13 Ca 0.00 -4.10 -0.50 0.00 -1.05 0.00 0.00 58.31 52.66 1fhs n LYS 13 Cb 0.00 -2.27 -0.06 0.00 -0.65 0.00 0.00 35.03 32.05 1fhs n LYS 13 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 1fhs n ILE 14 N -0.67 0.35 -1.65 0.58 0.13 -1.22 -4.80 119.36 112.08 1fhs n ILE 14 Ca 0.46 -0.21 -0.52 0.00 -1.10 0.00 0.00 62.75 61.38 1fhs n ILE 14 Cb 0.81 -1.79 -0.06 0.00 -0.84 0.00 0.00 39.64 37.76 1fhs n ILE 14 CO 0.00 0.00 0.00 -2.65 2.80 0.00 0.00 176.55 176.70 1fhs n PRO 15 N 7.45 1.44 -0.29 9.51 -0.02 -1.26 -4.58 135.00 147.25 1fhs n PRO 15 Ca 0.32 0.52 0.27 0.00 -2.02 0.00 0.00 63.50 62.59 1fhs n PRO 15 Cb 0.27 -2.22 0.47 0.00 -0.02 0.00 0.00 33.50 31.99 1fhs n PRO 15 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1fhs n ARG 16 N 4.03 -0.04 0.20 -0.52 1.85 -1.26 0.16 116.66 121.08 1fhs n ARG 16 Ca 0.21 0.97 -0.08 0.00 -1.00 0.00 0.00 57.85 57.95 1fhs n ARG 16 Cb 0.20 -1.83 -0.04 0.00 -1.05 0.00 0.00 32.46 29.74 1fhs n ARG 16 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1fhs h ALA 17 N 1.33 -0.67 -0.91 2.89 0.00 -2.00 -2.54 119.26 117.36 1fhs h ALA 17 Ca 0.64 -0.12 0.29 0.00 0.00 0.00 0.00 54.91 55.72 1fhs h ALA 17 Cb 1.87 0.21 -0.17 0.00 0.00 0.00 0.00 17.79 19.70 1fhs h ALA 17 CO -0.46 -0.63 0.17 1.17 0.00 0.00 0.00 179.25 179.50 1fhs n LYS 18 N -4.46 -0.07 0.27 0.00 0.00 0.41 0.15 118.16 114.47 1fhs n LYS 18 Ca -0.07 1.33 -0.18 0.00 0.00 0.00 0.00 58.31 59.39 1fhs n LYS 18 Cb 0.21 -2.20 -0.10 0.00 0.00 0.00 0.00 35.03 32.95 1fhs n LYS 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1fhs h ALA 19 N 1.82 -1.12 -0.94 3.14 0.00 -0.45 0.20 119.26 121.91 1fhs h ALA 19 Ca 0.63 -0.18 0.29 0.00 0.00 0.00 0.00 54.91 55.64 1fhs h ALA 19 Cb 1.44 0.76 -0.16 0.00 0.00 0.00 0.00 17.79 19.83 1fhs h ALA 19 CO -0.81 -1.18 0.28 0.93 0.00 0.00 0.00 179.25 178.48 1fhs h GLU 20 N -0.97 0.14 0.00 0.00 5.08 0.18 0.68 114.58 119.69 1fhs h GLU 20 Ca -0.05 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1fhs h GLU 20 Cb 0.86 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1fhs h GLU 20 CO -0.10 0.09 0.00 0.39 -1.00 0.00 0.00 179.01 178.39 1fhs n GLU 21 N -5.27 0.00 -0.33 2.33 1.02 0.34 0.12 120.64 118.86 1fhs n GLU 21 Ca 0.26 0.00 0.26 0.00 -0.02 0.00 0.00 57.16 57.66 1fhs n GLU 21 Cb 0.84 -0.64 0.50 0.00 -0.02 0.00 0.00 31.44 32.12 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 0.21 -0.48 3.49 -0.00 -1.12 1.17 114.93 118.20 1fhs h MET 22 Ca 0.00 -0.01 -0.06 0.00 -0.00 0.00 0.00 59.70 59.62 1fhs h MET 22 Cb 0.00 -0.05 -0.02 0.00 -0.00 0.00 0.00 31.60 31.53 1fhs h MET 22 CO 0.00 0.14 0.03 1.25 -0.00 0.00 0.00 176.91 178.33 1fhs h LEU 23 N 0.22 0.73 -1.87 -0.10 5.85 0.39 -0.68 115.31 119.85 1fhs h LEU 23 Ca 0.76 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 59.32 1fhs h LEU 23 Cb 1.82 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.65 1fhs h LEU 23 CO -0.66 0.78 0.00 -1.20 -0.34 0.00 0.00 178.44 177.02 1fhs n SER 24 N -4.24 1.81 -2.62 1.25 7.64 0.40 -2.86 113.62 115.01 1fhs n SER 24 Ca 0.03 -1.32 -0.11 0.00 1.01 0.00 0.00 58.87 58.48 1fhs n SER 24 Cb 0.28 -0.33 0.03 0.00 -1.01 0.00 0.00 64.21 63.18 1fhs n SER 24 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1fhs n LYS 25 N 0.60 1.89 -4.10 1.43 5.02 -0.26 -5.02 118.16 117.73 1fhs n LYS 25 Ca 0.00 -3.60 -0.33 0.00 -2.02 0.00 0.00 58.31 52.36 1fhs n LYS 25 Cb 0.31 -1.60 -0.16 0.00 -0.02 0.00 0.00 35.03 33.56 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 -3.43 2.82 -0.44 1.97 -1.52 -1.14 -4.99 119.66 112.93 1fhs s GLN 26 Ca 0.32 -0.95 0.03 0.00 -1.95 0.00 0.00 55.36 52.82 1fhs s GLN 26 Cb 0.41 -2.66 0.60 0.00 -0.22 0.00 0.00 33.01 31.14 1fhs s GLN 26 CO -0.02 -0.30 1.87 -2.13 -0.25 0.00 0.00 175.29 174.46 1fhs n ARG 27 N 4.58 2.20 -0.09 2.91 3.00 -1.26 -4.03 116.66 123.96 1fhs n ARG 27 Ca -0.19 -2.82 0.00 0.00 -0.00 0.00 0.00 57.85 54.84 1fhs n ARG 27 Cb 0.48 -2.10 0.00 0.00 0.00 0.00 0.00 32.46 30.84 1fhs n ARG 27 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1fhs n HIS 28 N -1.00 0.00 -1.68 -0.14 8.25 -1.26 -5.15 115.22 114.24 1fhs n HIS 28 Ca 0.56 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 58.02 1fhs n HIS 28 Cb 1.50 0.07 0.00 0.00 1.12 0.00 0.00 29.99 32.69 1fhs n HIS 28 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1fhs n ASP 29 N 0.00 -8.69 0.00 0.41 -0.08 -1.26 -4.79 116.55 102.14 1fhs n ASP 29 Ca 0.00 1.39 0.00 0.00 -1.51 0.00 0.00 54.79 54.67 1fhs n ASP 29 Cb 0.52 -5.13 0.00 0.00 2.34 0.00 0.00 41.12 38.85 1fhs n ASP 29 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1fhs n GLY 30 N -1.21 3.39 3.63 0.27 0.00 -0.90 -4.74 105.19 105.63 1fhs n GLY 30 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.57 -0.62 -2.31 4.61 0.00 -0.90 -2.97 120.51 116.74 1fhs n ALA 31 Ca 0.00 0.38 -0.15 0.00 0.00 0.00 0.00 53.44 53.67 1fhs n ALA 31 Cb 0.00 -2.06 -0.10 0.00 0.00 0.00 0.00 19.45 17.29 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 3.98 1.31 0.03 0.00 -0.71 -1.15 -1.65 117.98 119.79 1fhs s PHE 32 Ca 1.07 -0.70 -0.17 0.00 -1.04 0.00 0.00 56.93 56.09 1fhs s PHE 32 Cb -1.36 -0.66 0.03 0.00 -1.21 0.00 0.00 43.02 39.82 1fhs s PHE 32 CO 0.73 0.11 0.37 -0.48 -1.34 0.00 0.00 175.22 174.62 1fhs s LEU 33 N -3.02 0.57 -0.23 -1.99 0.05 -0.99 -4.68 118.68 108.39 1fhs s LEU 33 Ca 0.15 0.00 0.02 0.00 0.05 0.00 0.00 54.13 54.35 1fhs s LEU 33 Cb 0.01 1.57 0.05 0.00 -2.05 0.00 0.00 46.19 45.77 1fhs s LEU 33 CO 0.01 -0.60 -0.12 -0.63 -0.55 0.00 0.00 176.35 174.46 1fhs s ILE 34 N -2.19 1.97 -0.02 1.48 1.01 -1.16 -0.16 121.20 122.14 1fhs s ILE 34 Ca -0.07 -1.30 -0.25 0.00 0.00 0.00 0.00 60.65 59.03 1fhs s ILE 34 Cb -0.02 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 1fhs s ILE 34 CO -0.01 0.14 0.78 0.00 0.00 0.00 0.00 174.94 175.86 1fhs s ARG 35 N 1.24 4.48 -0.90 2.79 3.03 -1.20 -2.64 118.95 125.74 1fhs s ARG 35 Ca -0.04 1.05 -0.20 0.00 2.03 0.00 0.00 55.73 58.58 1fhs s ARG 35 Cb -0.17 -3.43 -0.12 0.00 -1.03 0.00 0.00 34.95 30.20 1fhs s ARG 35 CO -0.08 0.09 1.99 -1.91 -1.13 0.00 0.00 175.30 174.27 1fhs n GLU 36 N 3.56 1.77 0.00 3.89 4.07 0.33 -4.18 120.64 130.09 1fhs n GLU 36 Ca 0.00 -1.96 0.00 0.00 -0.06 0.00 0.00 57.16 55.14 1fhs n GLU 36 Cb 0.51 -2.96 0.00 0.00 -0.06 0.00 0.00 31.44 28.93 1fhs n GLU 36 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1fhs n SER 37 N 7.08 0.00 0.00 4.31 3.41 -0.93 -4.56 113.62 122.93 1fhs n SER 37 Ca 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.11 1fhs n SER 37 Cb 0.39 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1fhs n SER 37 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1fhs n GLU 38 N 0.79 0.00 -2.62 4.33 2.13 -1.26 -4.54 120.64 119.46 1fhs n GLU 38 Ca 0.00 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.73 1fhs n GLU 38 Cb 0.00 0.00 0.03 0.00 0.27 0.00 0.00 31.44 31.74 1fhs n GLU 38 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1fhs n SER 39 N -2.42 2.37 -0.02 4.31 2.88 -1.26 -4.92 113.62 114.56 1fhs n SER 39 Ca 0.00 -2.66 -0.00 0.00 -1.33 0.00 0.00 58.87 54.88 1fhs n SER 39 Cb 0.00 -0.47 -0.00 0.00 -0.75 0.00 0.00 64.21 62.99 1fhs n SER 39 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fhs h ALA 40 N 2.65 0.00 -0.02 -1.46 0.00 -1.92 -3.48 119.26 115.03 1fhs h ALA 40 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fhs h ALA 40 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1fhs h ALA 40 CO 0.43 0.00 -0.14 -0.35 0.00 0.00 0.00 179.25 179.20 1fhs n PRO 41 N -3.35 1.47 -1.14 0.00 -0.04 -1.26 -4.95 135.00 125.74 1fhs n PRO 41 Ca -0.00 -0.99 -0.26 0.00 -0.04 0.00 0.00 63.50 62.21 1fhs n PRO 41 Cb 0.00 -1.48 -0.09 0.00 -0.04 0.00 0.00 33.50 31.89 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 1.29 3.61 2.73 0.55 0.00 -1.26 -4.36 105.19 107.75 1fhs n GLY 42 Ca 0.15 -1.33 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 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 2.14 3.85 -0.17 1.61 1.01 -1.26 -4.89 116.67 118.97 1fhs s ASP 43 Ca 0.67 -2.18 -0.03 0.00 0.71 0.00 0.00 52.55 51.72 1fhs s ASP 43 Cb 0.24 -0.98 -0.02 0.00 1.01 0.00 0.00 42.92 43.17 1fhs s ASP 43 CO -0.03 -0.34 -0.05 -0.36 0.21 0.00 0.00 175.17 174.60 1fhs s PHE 44 N 0.93 2.97 -0.06 4.23 0.40 -1.26 -2.19 117.98 122.98 1fhs s PHE 44 Ca 0.14 -0.52 0.04 0.00 -0.60 0.00 0.00 56.93 55.99 1fhs s PHE 44 Cb -0.21 -1.98 0.00 0.00 0.51 0.00 0.00 43.02 41.34 1fhs s PHE 44 CO -0.10 -0.20 -0.18 -1.54 0.70 0.00 0.00 175.22 173.90 1fhs s SER 45 N 0.66 2.30 -0.37 1.36 1.04 -1.26 -1.42 113.70 116.01 1fhs s SER 45 Ca -0.03 -0.39 -0.20 0.00 0.48 0.00 0.00 55.95 55.81 1fhs s SER 45 Cb -0.15 -0.87 0.00 0.00 0.10 0.00 0.00 66.02 65.10 1fhs s SER 45 CO 0.02 0.12 0.61 -0.22 0.98 0.00 0.00 173.24 174.75 1fhs s LEU 46 N 0.30 4.32 0.20 2.42 0.20 0.13 -3.26 118.68 122.99 1fhs s LEU 46 Ca -0.11 0.02 -0.03 0.00 0.69 0.00 0.00 54.13 54.70 1fhs s LEU 46 Cb -0.15 -2.73 -0.05 0.00 -0.43 0.00 0.00 46.19 42.84 1fhs s LEU 46 CO 0.04 -0.60 0.42 -0.44 -0.29 0.00 0.00 176.35 175.49 1fhs s SER 47 N 1.82 6.44 -0.18 3.68 0.01 0.78 0.12 113.70 126.36 1fhs s SER 47 Ca 0.23 0.54 -0.14 0.00 1.31 0.00 0.00 55.95 57.88 1fhs s SER 47 Cb -0.15 -2.07 0.05 0.00 0.21 0.00 0.00 66.02 64.07 1fhs s SER 47 CO 0.15 -0.04 0.47 -0.69 0.41 0.00 0.00 173.24 173.53 1fhs s VAL 48 N -1.84 -0.01 -0.54 3.43 1.01 0.32 -2.35 120.40 120.41 1fhs s VAL 48 Ca 0.41 0.03 -0.26 0.00 0.00 0.00 0.00 61.98 62.15 1fhs s VAL 48 Cb -0.11 -0.67 0.03 0.00 0.00 0.00 0.00 36.38 35.63 1fhs s VAL 48 CO 0.28 0.01 1.05 -0.75 0.00 0.00 0.00 175.10 175.69 1fhs s LYS 49 N 0.74 3.46 0.00 2.72 2.20 -0.66 -0.62 119.74 127.58 1fhs s LYS 49 Ca -0.04 0.06 0.00 0.00 -0.36 0.00 0.00 55.97 55.63 1fhs s LYS 49 Cb -0.05 -4.01 0.00 0.00 -1.51 0.00 0.00 37.83 32.26 1fhs s LYS 49 CO -0.05 -1.51 0.13 0.34 -0.36 0.00 0.00 175.35 173.89 1fhs n PHE 50 N 7.80 0.00 0.00 4.03 7.35 -1.13 -2.11 117.46 133.40 1fhs n PHE 50 Ca 0.06 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.75 1fhs n PHE 50 Cb 0.48 -0.03 0.00 0.00 0.35 0.00 0.00 39.48 40.29 1fhs n PHE 50 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1fhs n GLY 51 N 1.76 0.19 0.02 7.13 0.00 -1.26 -4.68 105.19 108.34 1fhs n GLY 51 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.61 3.41 -4.66 1.61 5.15 -1.26 -5.02 115.26 112.89 1fhs n ASN 52 Ca 0.00 0.00 -0.25 0.00 -0.60 0.00 0.00 54.58 53.73 1fhs n ASN 52 Cb 0.00 1.03 -0.07 0.00 -0.53 0.00 0.00 39.78 40.21 1fhs n ASN 52 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1fhs s ASP 53 N -3.23 4.69 -0.58 1.20 1.01 -1.26 -5.04 116.67 113.46 1fhs s ASP 53 Ca -0.03 -0.49 -0.26 0.00 0.71 0.00 0.00 52.55 52.48 1fhs s ASP 53 Cb 0.03 -0.95 0.04 0.00 1.01 0.00 0.00 42.92 43.05 1fhs s ASP 53 CO 0.28 0.05 1.07 -0.69 0.21 0.00 0.00 175.17 176.09 1fhs s VAL 54 N -1.95 4.19 0.04 -1.27 1.01 -1.26 -2.82 120.40 118.33 1fhs s VAL 54 Ca 0.29 0.51 -0.06 0.00 0.00 0.00 0.00 61.98 62.72 1fhs s VAL 54 Cb -0.08 -4.65 -0.05 0.00 0.00 0.00 0.00 36.38 31.60 1fhs s VAL 54 CO 0.19 -1.27 0.30 -1.58 0.00 0.00 0.00 175.10 172.73 1fhs s GLN 55 N 4.48 3.60 0.24 2.72 -0.44 0.21 -4.90 119.66 125.57 1fhs s GLN 55 Ca 0.35 -0.07 0.02 0.00 -2.50 0.00 0.00 55.36 53.16 1fhs s GLN 55 Cb -0.10 -3.04 -0.05 0.00 -1.64 0.00 0.00 33.01 28.18 1fhs s GLN 55 CO 0.21 0.61 0.07 -3.38 0.50 0.00 0.00 175.29 173.30 1fhs s HIS 56 N -1.37 1.50 -0.15 1.67 -3.43 -1.26 0.12 115.29 112.37 1fhs s HIS 56 Ca 0.30 -1.12 -0.04 0.00 -0.80 0.00 0.00 55.06 53.40 1fhs s HIS 56 Cb -0.13 -0.88 0.05 0.00 -1.43 0.00 0.00 32.58 30.20 1fhs s HIS 56 CO 0.18 -0.28 0.07 -0.06 -2.00 0.00 0.00 174.74 172.66 1fhs s PHE 57 N -3.69 0.31 -0.48 0.38 0.08 0.31 -4.96 117.98 109.93 1fhs s PHE 57 Ca 0.34 -0.29 -0.29 0.00 0.12 0.00 0.00 56.93 56.82 1fhs s PHE 57 Cb 0.07 -0.71 0.02 0.00 -0.57 0.00 0.00 43.02 41.84 1fhs s PHE 57 CO 0.12 -0.46 1.28 0.15 -0.10 0.00 0.00 175.22 176.20 1fhs s LYS 58 N 2.10 3.59 -0.97 0.44 1.02 -1.26 0.18 119.74 124.84 1fhs s LYS 58 Ca 0.02 0.64 -0.24 0.00 0.02 0.00 0.00 55.97 56.42 1fhs s LYS 58 Cb -0.15 -3.99 -0.00 0.00 -0.52 0.00 0.00 37.83 33.16 1fhs s LYS 58 CO -0.08 -1.56 1.71 0.08 -0.92 0.00 0.00 175.35 174.58 1fhs s VAL 59 N 5.08 3.68 0.45 3.17 1.01 -0.51 -4.86 120.40 128.42 1fhs s VAL 59 Ca 0.53 -0.58 -0.17 0.00 0.00 0.00 0.00 61.98 61.76 1fhs s VAL 59 Cb -0.10 -4.52 -0.09 0.00 0.00 0.00 0.00 36.38 31.67 1fhs s VAL 59 CO 0.31 -1.43 0.92 -0.76 0.00 0.00 0.00 175.10 174.14 1fhs s LEU 60 N 7.63 3.81 0.00 3.92 1.43 -1.14 -4.38 118.68 129.95 1fhs s LEU 60 Ca 0.59 1.53 0.00 0.00 -1.03 0.00 0.00 54.13 55.21 1fhs s LEU 60 Cb -0.03 -4.41 0.00 0.00 0.03 0.00 0.00 46.19 41.77 1fhs s LEU 60 CO -0.05 -0.44 0.00 -1.14 0.23 0.00 0.00 176.35 174.95 1fhs n ARG 61 N -1.06 3.50 0.00 1.70 0.63 -1.25 -0.30 116.66 119.87 1fhs n ARG 61 Ca 0.06 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 1fhs n ARG 61 Cb 0.54 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.45 1fhs n ARG 61 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1fhs n ASP 62 N 0.00 0.00 0.00 6.15 -0.08 -0.06 -4.52 116.55 118.04 1fhs n ASP 62 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1fhs n ASP 62 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1fhs n ASP 62 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1fhs n GLY 63 N -0.30 3.10 0.11 0.27 0.00 -1.26 -4.50 105.19 102.60 1fhs n GLY 63 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.15 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 0.00 2.08 0.33 4.61 0.00 -1.26 -4.75 120.51 121.51 1fhs n ALA 64 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1fhs n ALA 64 Cb 0.00 0.30 0.39 0.00 0.00 0.00 0.00 19.45 20.14 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 2.68 -1.02 7.00 0.00 0.00 -1.26 -4.96 105.19 107.63 1fhs n GLY 65 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.93 0.00 -4.26 1.61 5.02 -1.26 -4.52 118.16 112.82 1fhs n LYS 66 Ca 0.02 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.96 1fhs n LYS 66 Cb 0.15 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.05 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 3.17 0.27 2.13 1.51 -1.15 -0.88 117.35 122.40 1fhs s TYR 67 Ca 0.00 0.03 -0.11 0.00 -1.01 0.00 0.00 57.07 55.98 1fhs s TYR 67 Cb 0.00 -1.93 0.00 0.00 -0.11 0.00 0.00 41.96 39.93 1fhs s TYR 67 CO 0.00 0.25 0.50 -0.59 -1.11 0.00 0.00 175.55 174.60 1fhs s PHE 68 N -0.18 0.46 0.00 2.71 -0.12 0.59 0.15 117.98 121.59 1fhs s PHE 68 Ca 0.05 -0.82 0.00 0.00 -0.05 0.00 0.00 56.93 56.11 1fhs s PHE 68 Cb -0.12 0.19 0.00 0.00 -0.63 0.00 0.00 43.02 42.46 1fhs s PHE 68 CO 0.02 -1.06 0.00 1.28 -0.05 0.00 0.00 175.22 175.41 1fhs n LEU 69 N -0.42 0.00 0.00 -1.99 4.32 -1.26 -2.90 117.00 114.75 1fhs n LEU 69 Ca -0.02 0.00 -0.21 0.00 -0.02 0.00 0.00 56.01 55.76 1fhs n LEU 69 Cb 0.62 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.28 1fhs n LEU 69 CO 0.24 0.00 -0.79 0.79 -1.22 0.00 0.00 177.39 176.41 1fhs n TRP 70 N 0.00 1.27 0.00 -1.77 7.02 -1.26 -4.98 117.44 117.72 1fhs n TRP 70 Ca 0.00 0.28 0.00 0.00 -1.02 0.00 0.00 57.50 56.76 1fhs n TRP 70 Cb 0.00 -1.16 0.00 0.00 -2.42 0.00 0.00 31.31 27.73 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 -3.54 0.00 -1.60 -0.99 0.31 -1.26 -5.10 118.33 106.15 1fhs n VAL 71 Ca -0.32 0.00 -0.49 0.00 -0.01 0.00 0.00 64.34 63.52 1fhs n VAL 71 Cb 1.03 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.91 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 -0.42 0.49 -3.18 2.52 0.24 -1.26 -4.91 118.33 111.81 1fhs n VAL 72 Ca 0.00 -0.12 -0.32 0.00 -2.04 0.00 0.00 64.34 61.86 1fhs n VAL 72 Cb 0.00 -0.94 -0.05 0.00 -1.47 0.00 0.00 33.84 31.37 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 0.04 3.89 0.01 7.34 1.02 -1.26 -4.23 119.74 126.55 1fhs s LYS 73 Ca 0.77 0.50 0.06 0.00 0.02 0.00 0.00 55.97 57.33 1fhs s LYS 73 Cb -0.86 -2.49 -0.02 0.00 -0.52 0.00 0.00 37.83 33.94 1fhs s LYS 73 CO 0.49 0.17 -0.19 -0.06 -0.92 0.00 0.00 175.35 174.84 1fhs s PHE 74 N -2.01 1.68 0.43 3.18 0.08 0.12 -5.01 117.98 116.45 1fhs s PHE 74 Ca 0.51 -0.33 0.13 0.00 0.12 0.00 0.00 56.93 57.36 1fhs s PHE 74 Cb -0.10 -1.05 1.02 0.00 -0.57 0.00 0.00 43.02 42.31 1fhs s PHE 74 CO 0.21 0.01 1.99 -2.95 -0.10 0.00 0.00 175.22 174.38 1fhs h ASN 75 N 5.41 0.37 -5.53 1.36 -1.07 -1.91 -3.03 115.58 111.17 1fhs h ASN 75 Ca -0.39 0.01 0.24 0.00 0.07 0.00 0.00 56.30 56.23 1fhs h ASN 75 Cb 1.15 -0.07 -0.10 0.00 -2.07 0.00 0.00 38.32 37.23 1fhs h ASN 75 CO 0.47 0.23 0.64 -0.44 0.07 0.00 0.00 177.43 178.40 1fhs s SER 76 N -6.30 -0.11 0.30 6.14 0.01 -1.26 -4.69 113.70 107.79 1fhs s SER 76 Ca -0.08 -0.30 0.01 0.00 1.31 0.00 0.00 55.95 56.89 1fhs s SER 76 Cb 0.19 0.34 0.73 0.00 0.21 0.00 0.00 66.02 67.49 1fhs s SER 76 CO 0.75 -0.64 1.55 0.18 0.41 0.00 0.00 173.24 175.49 1fhs n LEU 77 N -0.50 -0.14 -0.10 2.44 7.99 -1.26 0.64 117.00 126.07 1fhs n LEU 77 Ca -0.07 1.68 -0.06 0.00 -0.01 0.00 0.00 56.01 57.56 1fhs n LEU 77 Cb 0.62 -0.60 0.00 0.00 -0.11 0.00 0.00 43.42 43.33 1fhs n LEU 77 CO 0.13 -1.70 0.77 -0.55 -1.51 0.00 0.00 177.39 174.54 1fhs h ASN 78 N 0.00 -0.42 0.32 -1.43 -1.07 -1.98 1.46 115.58 112.46 1fhs h ASN 78 Ca 0.59 0.12 0.00 0.00 0.07 0.00 0.00 56.30 57.07 1fhs h ASN 78 Cb 1.18 0.25 0.00 0.00 -2.07 0.00 0.00 38.32 37.69 1fhs h ASN 78 CO -0.94 -0.15 0.00 -0.08 0.07 0.00 0.00 177.43 176.33 1fhs h GLU 79 N -0.05 0.00 0.00 4.14 4.57 -0.19 0.20 114.58 123.25 1fhs h GLU 79 Ca 0.17 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1fhs h GLU 79 Cb 0.31 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1fhs h GLU 79 CO -0.38 0.00 0.00 -0.11 -1.18 0.00 0.00 179.01 177.34 1fhs n LEU 80 N -2.43 0.14 -0.33 1.64 0.00 0.41 -2.81 117.00 113.62 1fhs n LEU 80 Ca -0.00 0.40 0.29 0.00 0.00 0.00 0.00 56.01 56.70 1fhs n LEU 80 Cb 0.12 -0.47 0.51 0.00 0.00 0.00 0.00 43.42 43.58 1fhs n LEU 80 CO 0.16 -0.47 0.92 0.52 0.00 0.00 0.00 177.39 178.52 1fhs n VAL 81 N -2.00 -0.26 0.00 1.96 0.31 0.35 0.09 118.33 118.79 1fhs n VAL 81 Ca 0.00 1.51 -0.13 0.00 -0.01 0.00 0.00 64.34 65.72 1fhs n VAL 81 Cb 0.00 -2.47 -0.10 0.00 -0.91 0.00 0.00 33.84 30.36 1fhs n VAL 81 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1fhs h ASP 82 N 0.00 -0.04 0.00 4.52 3.58 -0.72 -2.75 116.42 121.01 1fhs h ASP 82 Ca 0.69 -0.49 -0.04 0.00 0.42 0.00 0.00 57.03 57.61 1fhs h ASP 82 Cb 2.07 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 43.12 1fhs h ASP 82 CO -0.47 0.49 -0.07 -1.22 -2.88 0.00 0.00 179.24 175.09 1fhs n TYR 83 N -4.86 0.00 0.00 0.28 4.01 0.11 -2.40 117.16 114.31 1fhs n TYR 83 Ca -0.09 -1.01 0.00 0.00 -0.16 0.00 0.00 57.90 56.64 1fhs n TYR 83 Cb 0.27 -0.69 0.00 0.00 -0.31 0.00 0.00 39.34 38.61 1fhs n TYR 83 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1fhs n HIS 84 N 1.75 0.00 -0.25 -0.72 8.25 -1.17 -4.89 115.22 118.19 1fhs n HIS 84 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1fhs n HIS 84 Cb 0.54 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.65 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 -0.06 0.75 -0.06 -0.41 1.85 -1.01 -2.88 116.66 114.84 1fhs n ARG 85 Ca 0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.74 1fhs n ARG 85 Cb 0.00 -1.12 -0.05 0.00 -1.05 0.00 0.00 32.46 30.24 1fhs n ARG 85 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1fhs n SER 86 N 1.51 1.83 -3.15 2.89 7.64 -1.26 -5.01 113.62 118.06 1fhs n SER 86 Ca 0.00 0.06 0.05 0.00 1.01 0.00 0.00 58.87 59.99 1fhs n SER 86 Cb 0.38 -0.30 -0.01 0.00 -1.01 0.00 0.00 64.21 63.27 1fhs n SER 86 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1fhs s THR 87 N -2.24 -0.50 0.42 0.44 -1.32 -1.14 -5.11 115.64 106.19 1fhs s THR 87 Ca -0.17 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.31 1fhs s THR 87 Cb 0.06 -0.80 0.00 0.00 -1.51 0.00 0.00 72.50 70.25 1fhs s THR 87 CO 0.25 0.00 0.00 -0.24 -2.21 0.00 0.00 174.62 172.42 1fhs n SER 88 N 5.36 -6.02 -2.77 8.08 2.88 -0.71 -4.83 113.62 115.61 1fhs n SER 88 Ca 0.00 0.94 -0.02 0.00 -1.33 0.00 0.00 58.87 58.46 1fhs n SER 88 Cb 0.54 -3.99 0.06 0.00 -0.75 0.00 0.00 64.21 60.07 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 -3.87 0.96 0.00 2.46 3.14 -1.24 -4.79 118.33 114.99 1fhs n VAL 89 Ca -0.05 -2.59 0.00 0.00 -2.96 0.00 0.00 64.34 58.73 1fhs n VAL 89 Cb 0.56 1.12 0.00 0.00 -1.06 0.00 0.00 33.84 34.46 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 -0.63 0.00 -0.75 6.55 2.88 -1.26 -4.97 113.62 115.44 1fhs n SER 90 Ca 0.03 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.62 1fhs n SER 90 Cb 0.82 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 64.43 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 2.03 -2.07 -1.46 5.12 -1.26 -4.88 116.66 114.15 1fhs n ARG 91 Ca 0.00 -1.22 -0.14 0.00 -1.93 0.00 0.00 57.85 54.56 1fhs n ARG 91 Cb 0.00 -1.43 -0.02 0.00 -1.16 0.00 0.00 32.46 29.85 1fhs n ARG 91 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1fhs n ASN 92 N 0.39 -4.49 -2.02 0.55 4.13 -1.26 -4.88 115.26 107.68 1fhs n ASN 92 Ca 0.11 0.07 -0.22 0.00 1.68 0.00 0.00 54.58 56.23 1fhs n ASN 92 Cb 0.39 -3.55 0.05 0.00 -1.54 0.00 0.00 39.78 35.13 1fhs n ASN 92 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1fhs n GLN 93 N -2.43 2.05 -2.96 3.52 1.13 -1.26 -4.88 117.38 112.55 1fhs n GLN 93 Ca -0.17 -2.05 -0.06 0.00 -1.94 0.00 0.00 57.00 52.78 1fhs n GLN 93 Cb 0.59 -1.81 0.01 0.00 0.11 0.00 0.00 30.24 29.14 1fhs n GLN 93 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 1fhs n GLN 94 N -0.00 -2.29 -4.10 -1.09 7.27 -1.26 -5.01 117.38 110.90 1fhs n GLN 94 Ca 0.39 2.00 -0.23 0.00 0.07 0.00 0.00 57.00 59.24 1fhs n GLN 94 Cb 0.60 -3.96 -0.17 0.00 2.41 0.00 0.00 30.24 29.13 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 -1.65 0.69 0.06 1.69 1.01 -1.26 -4.87 121.20 116.88 1fhs s ILE 95 Ca 0.10 -0.16 0.09 0.00 0.00 0.00 0.00 60.65 60.67 1fhs s ILE 95 Cb -0.02 -0.73 -0.03 0.00 0.01 0.00 0.00 42.46 41.69 1fhs s ILE 95 CO 0.60 0.28 -0.24 -0.36 0.00 0.00 0.00 174.94 175.22 1fhs s PHE 96 N 1.25 2.12 -0.51 3.97 0.08 -1.26 -1.73 117.98 121.90 1fhs s PHE 96 Ca -0.05 -0.40 -0.22 0.00 0.12 0.00 0.00 56.93 56.38 1fhs s PHE 96 Cb -0.14 -1.24 0.04 0.00 -0.57 0.00 0.00 43.02 41.11 1fhs s PHE 96 CO -0.02 0.16 0.78 -0.51 -0.10 0.00 0.00 175.22 175.52 1fhs s LEU 97 N -1.40 4.47 0.00 -0.37 1.43 -1.26 -4.21 118.68 117.33 1fhs s LEU 97 Ca 0.10 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1fhs s LEU 97 Cb -0.10 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.42 1fhs s LEU 97 CO 0.03 -1.02 0.00 -1.14 0.23 0.00 0.00 176.35 174.45 1fhs n ARG 98 N 6.78 0.00 0.00 1.70 0.63 -1.16 -5.02 116.66 119.60 1fhs n ARG 98 Ca -0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1fhs n ARG 98 Cb 0.47 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.38 1fhs n ARG 98 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1fhs n ASP 99 N 0.00 0.00 -0.53 6.15 2.03 -1.26 -2.11 116.55 120.83 1fhs n ASP 99 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1fhs n ASP 99 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1fhs n ASP 99 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fhs n ILE 100 N 0.00 0.03 0.00 5.18 3.06 -1.26 -4.35 119.36 122.02 1fhs n ILE 100 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1fhs n ILE 100 Cb 0.00 -0.28 0.00 0.00 0.54 0.00 0.00 39.64 39.90 1fhs n ILE 100 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 1fhs n GLU 101 N 0.28 0.00 -3.74 9.51 2.13 -1.26 -4.94 120.64 122.61 1fhs n GLU 101 Ca 0.00 0.00 -0.27 0.00 0.66 0.00 0.00 57.16 57.55 1fhs n GLU 101 Cb 0.13 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.85 1fhs n GLU 101 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1fhs n GLN 102 N 0.00 -1.61 0.08 5.31 -0.06 -1.26 -4.90 117.38 114.94 1fhs n GLN 102 Ca 0.00 0.87 0.00 0.00 -2.00 0.00 0.00 57.00 55.87 1fhs n GLN 102 Cb 0.00 -2.27 0.00 0.00 -4.06 0.00 0.00 30.24 23.91 1fhs n GLN 102 CO 0.00 0.00 0.00 1.55 -0.20 0.00 0.00 177.06 178.41 1fhs n VAL 103 N -2.24 0.17 -2.74 1.69 3.14 -1.26 -5.07 118.33 112.02 1fhs n VAL 103 Ca -0.28 0.06 -0.42 0.00 -2.96 0.00 0.00 64.34 60.73 1fhs n VAL 103 Cb 0.69 -0.55 -0.03 0.00 -1.06 0.00 0.00 33.84 32.89 1fhs n VAL 103 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1fhs s PRO 104 N -1.63 4.44 0.32 1.45 0.04 -1.26 -1.46 135.00 136.90 1fhs s PRO 104 Ca 0.00 1.32 -0.28 0.00 0.04 0.00 0.00 61.00 62.09 1fhs s PRO 104 Cb 0.00 -3.52 -0.09 0.00 0.04 0.00 0.00 34.50 30.93 1fhs s PRO 104 CO 0.00 -0.23 1.10 -0.65 0.04 0.00 0.00 177.00 177.26 1fhs s GLN 105 N 1.73 4.47 0.00 4.56 -0.21 -1.26 -5.04 119.66 123.91 1fhs s GLN 105 Ca 0.47 1.76 0.00 0.00 0.02 0.00 0.00 55.36 57.62 1fhs s GLN 105 Cb -0.19 -3.00 0.00 0.00 1.00 0.00 0.00 33.01 30.83 1fhs s GLN 105 CO 0.20 0.07 0.00 1.04 -2.12 0.00 0.00 175.29 174.47 1fhs n GLN 106 N 0.80 0.00 -2.20 2.91 6.02 -0.53 -4.82 117.38 119.56 1fhs n GLN 106 Ca 0.01 0.12 -0.42 0.00 -0.01 0.00 0.00 57.00 56.70 1fhs n GLN 106 Cb 0.46 -0.59 -0.03 0.00 1.02 0.00 0.00 30.24 31.10 1fhs n GLN 106 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1fhs s PRO 107 N -0.27 4.23 -0.35 -1.09 0.04 -1.26 -4.89 135.00 131.42 1fhs s PRO 107 Ca 0.00 1.97 -0.44 0.00 0.04 0.00 0.00 61.00 62.56 1fhs s PRO 107 Cb 0.00 -3.77 -0.19 0.00 0.04 0.00 0.00 34.50 30.58 1fhs s PRO 107 CO 0.00 -0.71 1.50 2.41 0.04 0.00 0.00 177.00 180.24 1fhs n THR 108 N 5.14 0.04 -3.73 1.26 -1.04 -1.26 -4.90 114.28 109.79 1fhs n THR 108 Ca 0.15 -0.01 -0.37 0.00 -2.04 0.00 0.00 64.05 61.78 1fhs n THR 108 Cb 0.44 -0.50 -0.12 0.00 -1.82 0.00 0.00 70.33 68.32 1fhs n THR 108 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1fhs s TYR 109 N 2.35 3.11 -0.30 -1.42 2.02 -1.26 -5.04 117.35 116.81 1fhs s TYR 109 Ca 1.00 -0.41 -0.15 0.00 -0.37 0.00 0.00 57.07 57.14 1fhs s TYR 109 Cb -1.38 -2.26 0.16 0.00 -0.40 0.00 0.00 41.96 38.08 1fhs s TYR 109 CO 0.73 -0.36 0.97 0.54 -1.57 0.00 0.00 175.55 175.86 1fhs s VAL 110 N 1.62 -0.41 -0.15 0.71 0.11 -1.26 -5.12 120.40 115.91 1fhs s VAL 110 Ca 0.06 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.82 1fhs s VAL 110 Cb -0.15 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.67 1fhs s VAL 110 CO 0.04 0.00 1.45 -1.58 -3.33 0.00 0.00 175.10 171.69 1fhs s GLN 111 N 2.20 4.11 0.00 1.54 -0.44 -1.26 -5.32 119.66 120.50 1fhs s GLN 111 Ca -0.04 1.80 0.00 0.00 -2.50 0.00 0.00 55.36 54.61 1fhs s GLN 111 Cb -0.06 -3.89 0.00 0.00 -1.64 0.00 0.00 33.01 27.42 1fhs s GLN 111 CO -0.17 -0.89 0.00 0.00 0.50 0.00 0.00 175.29 174.73