#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fqm n GLY 6 N 0.00 2.25 0.02 -1.67 0.00 0.11 -5.00 105.19 100.90 1fqm n GLY 6 Ca 0.00 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.62 1fqm n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fqm n TYR 7 N 0.00 0.00 -2.27 1.61 4.01 -1.26 -3.59 117.16 115.66 1fqm n TYR 7 Ca 0.00 -0.44 -0.25 0.00 -0.16 0.00 0.00 57.90 57.05 1fqm n TYR 7 Cb 0.00 -0.05 0.15 0.00 -0.31 0.00 0.00 39.34 39.14 1fqm n TYR 7 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fqm n GLY 8 N -0.48 -0.34 0.34 2.72 0.00 -1.26 -4.66 105.19 101.50 1fqm n GLY 8 Ca 0.01 -1.88 0.04 0.00 0.00 0.00 0.00 46.02 44.19 1fqm n GLY 8 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1fqm h LYS 9 N 0.00 0.92 -0.62 1.61 1.63 -1.97 0.26 116.57 118.40 1fqm h LYS 9 Ca -0.37 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.38 1fqm h LYS 9 Cb 1.17 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 1fqm h LYS 9 CO 0.32 0.61 0.00 0.72 -3.45 0.00 0.00 179.45 177.65 1fqm n HIS 10 N -4.64 0.90 -1.66 1.91 8.25 -1.26 -4.44 115.22 114.28 1fqm n HIS 10 Ca 0.15 -0.52 0.00 0.00 -0.26 0.00 0.00 57.72 57.10 1fqm n HIS 10 Cb 0.26 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.34 1fqm n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1fqm n ASN 11 N 1.28 0.00 -2.91 0.41 6.94 -1.12 -5.00 115.26 114.87 1fqm n ASN 11 Ca 0.21 -1.02 -0.13 0.00 -0.02 0.00 0.00 54.58 53.62 1fqm n ASN 11 Cb 0.60 -0.00 0.10 0.00 -2.36 0.00 0.00 39.78 38.12 1fqm n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1fqm n GLY 12 N 0.00 -1.85 0.50 4.83 0.00 0.91 0.07 105.19 109.66 1fqm n GLY 12 Ca 0.00 -1.59 0.34 0.00 0.00 0.00 0.00 46.02 44.77 1fqm n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1fqm h PRO 13 N 0.00 0.13 0.00 1.61 0.11 -1.84 0.13 132.00 132.14 1fqm h PRO 13 Ca -0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1fqm h PRO 13 Cb 0.55 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.63 1fqm h PRO 13 CO 0.13 0.09 0.00 -0.85 -0.21 0.00 0.00 178.00 177.16 1fqm n GLU 14 N -4.42 0.22 -0.01 1.05 0.00 -1.26 -3.05 120.64 113.18 1fqm n GLU 14 Ca 0.31 0.32 0.09 0.00 0.00 0.00 0.00 57.16 57.89 1fqm n GLU 14 Cb 1.29 -1.84 -0.13 0.00 0.00 0.00 0.00 31.44 30.76 1fqm n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1fqm n HIS 15 N -2.23 0.00 -0.34 -1.84 8.25 0.43 -4.70 115.22 114.79 1fqm n HIS 15 Ca 0.04 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.67 1fqm n HIS 15 Cb 0.32 -0.30 0.38 0.00 1.12 0.00 0.00 29.99 31.51 1fqm n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 1fqm h TRP 16 N 0.00 0.99 -0.16 4.41 6.55 -1.45 -2.38 115.95 123.91 1fqm h TRP 16 Ca 0.00 0.04 0.05 0.00 0.95 0.00 0.00 58.89 59.92 1fqm h TRP 16 Cb 0.73 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 28.74 1fqm h TRP 16 CO 0.00 0.05 0.17 1.12 -1.05 0.00 0.00 178.44 178.74 1fqm h HIS 17 N 0.57 0.00 -0.69 0.49 2.07 -1.80 -0.48 115.15 115.30 1fqm h HIS 17 Ca 0.64 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 58.12 1fqm h HIS 17 Cb 1.22 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.17 1fqm h HIS 17 CO -0.01 0.00 0.27 0.87 -3.07 0.00 0.00 177.93 175.99 1fqm h LYS 18 N 0.00 1.03 0.00 5.12 1.57 -1.79 -1.65 116.57 120.85 1fqm h LYS 18 Ca 0.08 -0.19 -0.28 0.00 -1.87 0.00 0.00 60.65 58.39 1fqm h LYS 18 Cb 0.42 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.52 1fqm h LYS 18 CO -0.00 0.85 -1.86 -0.25 -0.57 0.00 0.00 179.45 177.62 1fqm n ASP 19 N -4.38 0.59 -3.60 0.86 9.92 -1.02 -4.61 116.55 114.31 1fqm n ASP 19 Ca 0.05 0.28 -0.27 0.00 -0.53 0.00 0.00 54.79 54.32 1fqm n ASP 19 Cb 0.18 0.35 -0.10 0.00 -0.64 0.00 0.00 41.12 40.90 1fqm n ASP 19 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1fqm n PHE 20 N -2.91 1.31 0.23 1.24 3.72 -0.22 -4.96 117.46 115.87 1fqm n PHE 20 Ca -0.20 -3.83 0.08 0.00 -0.05 0.00 0.00 57.45 53.45 1fqm n PHE 20 Cb 1.03 -0.24 0.45 0.00 -0.94 0.00 0.00 39.48 39.79 1fqm n PHE 20 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1fqm h PRO 21 N 5.28 0.00 0.00 -1.08 0.13 -1.52 -0.39 132.00 134.42 1fqm h PRO 21 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1fqm h PRO 21 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1fqm h PRO 21 CO 0.57 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.85 1fqm n ILE 22 N -2.32 1.03 0.07 -3.56 0.13 -1.26 -2.18 119.36 111.28 1fqm n ILE 22 Ca -0.01 0.41 0.20 0.00 -1.10 0.00 0.00 62.75 62.25 1fqm n ILE 22 Cb 0.41 -1.34 0.74 0.00 -0.84 0.00 0.00 39.64 38.61 1fqm n ILE 22 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1fqm h ALA 23 N 2.19 2.21 -0.61 1.51 0.00 -1.37 0.37 119.26 123.57 1fqm h ALA 23 Ca 0.00 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 1fqm h ALA 23 Cb 0.20 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 17.87 1fqm h ALA 23 CO 0.00 -0.60 0.22 1.63 0.00 0.00 0.00 179.25 180.49 1fqm n LYS 24 N -3.97 2.42 -1.13 0.00 5.02 -0.93 -4.92 118.16 114.66 1fqm n LYS 24 Ca 0.07 -3.08 -0.24 0.00 -2.02 0.00 0.00 58.31 53.04 1fqm n LYS 24 Cb 0.57 -2.00 0.19 0.00 -0.02 0.00 0.00 35.03 33.77 1fqm n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1fqm n GLY 25 N -0.89 -2.19 0.01 0.72 0.00 0.13 -4.98 105.19 97.98 1fqm n GLY 25 Ca 0.41 -1.57 0.14 0.00 0.00 0.00 0.00 46.02 44.99 1fqm n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fqm n GLU 26 N -3.82 0.05 -3.05 1.61 -0.58 -1.26 -4.27 120.64 109.31 1fqm n GLU 26 Ca 0.13 -0.01 -0.15 0.00 -0.42 0.00 0.00 57.16 56.70 1fqm n GLU 26 Cb 0.47 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.85 1fqm n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 1fqm n ARG 27 N -1.47 0.98 -3.28 3.49 1.85 -1.26 -4.72 116.66 112.26 1fqm n ARG 27 Ca 0.07 -2.94 -0.31 0.00 -1.00 0.00 0.00 57.85 53.67 1fqm n ARG 27 Cb 0.33 -1.50 -0.05 0.00 -1.05 0.00 0.00 32.46 30.19 1fqm n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1fqm s GLN 28 N -1.60 3.82 0.24 2.89 -1.52 -1.26 -2.52 119.66 119.70 1fqm s GLN 28 Ca 0.35 0.34 0.12 0.00 -1.95 0.00 0.00 55.36 54.21 1fqm s GLN 28 Cb 0.33 -2.57 -0.05 0.00 -0.22 0.00 0.00 33.01 30.50 1fqm s GLN 28 CO -0.07 0.22 -0.21 -1.12 -0.25 0.00 0.00 175.29 173.86 1fqm s SER 29 N -2.56 3.55 0.85 5.90 0.01 -1.26 -4.63 113.70 115.56 1fqm s SER 29 Ca 0.49 -0.94 -0.06 0.00 1.31 0.00 0.00 55.95 56.75 1fqm s SER 29 Cb -0.11 -0.30 0.11 0.00 0.21 0.00 0.00 66.02 65.93 1fqm s SER 29 CO 0.23 0.08 0.67 -0.81 0.41 0.00 0.00 173.24 173.81 1fqm n PRO 30 N -0.21 -0.39 -4.11 12.44 -0.04 -1.26 -4.65 135.00 136.78 1fqm n PRO 30 Ca -0.09 -1.26 -0.10 0.00 -0.04 0.00 0.00 63.50 62.02 1fqm n PRO 30 Cb 0.58 -0.62 -0.09 0.00 -0.04 0.00 0.00 33.50 33.33 1fqm n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1fqm s VAL 31 N -2.25 0.09 0.05 0.52 -7.23 -1.26 0.44 120.40 110.76 1fqm s VAL 31 Ca 0.40 -1.80 -0.23 0.00 -1.81 0.00 0.00 61.98 58.54 1fqm s VAL 31 Cb -0.01 -2.01 -0.06 0.00 0.56 0.00 0.00 36.38 34.86 1fqm s VAL 31 CO 0.27 -0.42 0.70 -0.62 -0.31 0.00 0.00 175.10 174.72 1fqm s ASP 32 N -3.03 7.15 -0.49 4.85 2.15 -1.26 -3.07 116.67 122.98 1fqm s ASP 32 Ca 0.23 1.37 -0.15 0.00 0.43 0.00 0.00 52.55 54.43 1fqm s ASP 32 Cb 0.07 -2.43 0.09 0.00 -0.30 0.00 0.00 42.92 40.34 1fqm s ASP 32 CO 0.02 0.10 0.41 -0.63 -0.17 0.00 0.00 175.17 174.90 1fqm s ILE 33 N -0.37 5.12 -0.67 4.11 1.01 0.61 -4.92 121.20 126.08 1fqm s ILE 33 Ca 0.35 -1.23 -0.27 0.00 0.00 0.00 0.00 60.65 59.49 1fqm s ILE 33 Cb -0.20 -4.13 0.03 0.00 0.01 0.00 0.00 42.46 38.17 1fqm s ILE 33 CO 0.21 -0.66 1.27 -0.62 0.00 0.00 0.00 174.94 175.15 1fqm s ASP 34 N 2.84 6.23 0.65 3.58 2.15 -1.26 -0.69 116.67 130.17 1fqm s ASP 34 Ca 0.04 -0.21 0.33 0.00 0.43 0.00 0.00 52.55 53.14 1fqm s ASP 34 Cb -0.26 -2.56 1.83 0.00 -0.30 0.00 0.00 42.92 41.63 1fqm s ASP 34 CO 0.05 -1.73 2.06 0.74 -0.17 0.00 0.00 175.17 176.12 1fqm h THR 35 N 6.11 0.10 0.00 1.71 2.02 -1.95 -1.74 112.91 119.17 1fqm h THR 35 Ca -0.27 0.00 -0.28 0.00 0.77 0.00 0.00 66.41 66.63 1fqm h THR 35 Cb 1.06 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 1fqm h THR 35 CO 1.24 0.00 -1.58 0.45 0.37 0.00 0.00 175.52 176.00 1fqm h HIS 36 N 0.00 0.01 -0.20 3.16 3.86 -2.03 -3.35 115.15 116.60 1fqm h HIS 36 Ca 0.03 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1fqm h HIS 36 Cb 0.51 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.98 1fqm h HIS 36 CO 0.00 1.01 0.00 0.25 0.86 0.00 0.00 177.93 180.05 1fqm n THR 37 N -3.11 0.24 -2.53 2.45 -2.24 -0.69 -4.86 114.28 103.54 1fqm n THR 37 Ca -0.14 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.74 1fqm n THR 37 Cb 1.03 0.77 -0.03 0.00 -2.10 0.00 0.00 70.33 70.00 1fqm n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fqm s ALA 38 N -1.76 3.32 -0.42 6.98 0.00 -0.97 -4.81 121.76 124.10 1fqm s ALA 38 Ca 0.34 0.75 -0.21 0.00 0.00 0.00 0.00 51.96 52.84 1fqm s ALA 38 Cb 0.20 -3.39 0.02 0.00 0.00 0.00 0.00 23.12 19.95 1fqm s ALA 38 CO 0.30 -0.33 0.69 0.21 0.00 0.00 0.00 175.76 176.63 1fqm s LYS 39 N 0.78 3.43 0.22 0.00 2.47 -0.56 -4.80 119.74 121.29 1fqm s LYS 39 Ca 0.55 -0.16 -0.31 0.00 -1.56 0.00 0.00 55.97 54.49 1fqm s LYS 39 Cb -0.27 -3.91 -0.10 0.00 -1.46 0.00 0.00 37.83 32.09 1fqm s LYS 39 CO 0.30 -0.97 1.51 -0.47 0.16 0.00 0.00 175.35 175.87 1fqm s TYR 40 N 2.95 3.00 -0.34 4.03 5.04 -1.26 -0.25 117.35 130.52 1fqm s TYR 40 Ca 0.26 0.85 0.04 0.00 -2.44 0.00 0.00 57.07 55.77 1fqm s TYR 40 Cb -0.14 -3.89 0.10 0.00 0.35 0.00 0.00 41.96 38.38 1fqm s TYR 40 CO 0.19 -3.06 0.05 0.34 -1.34 0.00 0.00 175.55 171.73 1fqm s ASP 41 N 0.67 4.73 0.00 4.32 3.68 -0.35 -4.83 116.67 124.89 1fqm s ASP 41 Ca 0.64 -2.14 0.19 0.00 2.13 0.00 0.00 52.55 53.36 1fqm s ASP 41 Cb -0.43 -1.59 1.11 0.00 -1.45 0.00 0.00 42.92 40.55 1fqm s ASP 41 CO 0.39 -0.38 1.51 -0.81 0.13 0.00 0.00 175.17 176.01 1fqm n PRO 42 N 4.27 0.57 -0.22 4.34 -0.04 -1.26 -2.97 135.00 139.68 1fqm n PRO 42 Ca 0.04 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.61 1fqm n PRO 42 Cb 0.42 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.61 1fqm n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1fqm n SER 43 N -1.01 3.49 -4.74 3.54 3.41 -1.26 -4.94 113.62 112.11 1fqm n SER 43 Ca 0.14 -1.97 -0.40 0.00 -0.26 0.00 0.00 58.87 56.37 1fqm n SER 43 Cb 0.07 -0.29 -0.05 0.00 -0.26 0.00 0.00 64.21 63.67 1fqm n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1fqm s LEU 44 N -1.32 4.53 0.54 1.04 1.43 -1.16 -5.04 118.68 118.70 1fqm s LEU 44 Ca 0.39 1.72 -0.17 0.00 -1.03 0.00 0.00 54.13 55.04 1fqm s LEU 44 Cb 0.22 -3.46 -0.06 0.00 0.03 0.00 0.00 46.19 42.91 1fqm s LEU 44 CO 0.30 0.03 1.02 -0.75 0.23 0.00 0.00 176.35 177.18 1fqm s LYS 45 N -0.38 3.71 0.60 1.70 2.47 -1.24 -4.91 119.74 121.69 1fqm s LYS 45 Ca 0.42 1.10 -0.19 0.00 -1.56 0.00 0.00 55.97 55.74 1fqm s LYS 45 Cb -0.23 -2.09 -0.04 0.00 -1.46 0.00 0.00 37.83 34.01 1fqm s LYS 45 CO 0.28 -0.48 1.20 -2.30 0.16 0.00 0.00 175.35 174.21 1fqm n PRO 46 N -1.63 1.21 -2.47 4.03 -0.02 -1.26 -0.92 135.00 133.94 1fqm n PRO 46 Ca 0.08 0.46 -0.41 0.00 -2.02 0.00 0.00 63.50 61.61 1fqm n PRO 46 Cb 0.53 -2.41 -0.04 0.00 -0.02 0.00 0.00 33.50 31.56 1fqm n PRO 46 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1fqm s LEU 47 N -3.25 4.49 -0.25 2.45 0.20 -1.26 -1.92 118.68 119.13 1fqm s LEU 47 Ca 0.77 2.15 -0.02 0.00 0.69 0.00 0.00 54.13 57.72 1fqm s LEU 47 Cb -0.41 -3.61 0.03 0.00 -0.43 0.00 0.00 46.19 41.77 1fqm s LEU 47 CO 0.45 -0.25 -0.06 -0.55 -0.29 0.00 0.00 176.35 175.65 1fqm s SER 48 N -0.13 4.30 -0.41 3.68 0.15 0.13 -4.85 113.70 116.57 1fqm s SER 48 Ca 0.50 -0.87 -0.07 0.00 0.70 0.00 0.00 55.95 56.20 1fqm s SER 48 Cb -0.30 -1.66 0.08 0.00 -1.71 0.00 0.00 66.02 62.43 1fqm s SER 48 CO 0.36 -0.13 0.23 -0.69 1.20 0.00 0.00 173.24 174.21 1fqm s VAL 49 N 1.32 3.96 -0.97 4.45 1.01 -1.26 -0.82 120.40 128.08 1fqm s VAL 49 Ca 0.00 -1.53 -0.04 0.00 0.00 0.00 0.00 61.98 60.41 1fqm s VAL 49 Cb -0.17 -3.46 0.24 0.00 0.00 0.00 0.00 36.38 32.99 1fqm s VAL 49 CO -0.05 -0.51 0.90 -0.44 0.00 0.00 0.00 175.10 175.00 1fqm s SER 50 N 2.02 6.47 -0.01 3.32 0.01 -0.07 -4.81 113.70 120.63 1fqm s SER 50 Ca 0.03 -3.68 0.17 0.00 1.31 0.00 0.00 55.95 53.78 1fqm s SER 50 Cb -0.23 -2.02 0.50 0.00 0.21 0.00 0.00 66.02 64.49 1fqm s SER 50 CO 0.01 -0.22 1.41 -1.22 0.41 0.00 0.00 173.24 173.63 1fqm n TYR 51 N 2.46 0.77 -0.38 2.43 4.01 -1.26 -1.59 117.16 123.61 1fqm n TYR 51 Ca 0.22 -0.38 -0.08 0.00 -0.16 0.00 0.00 57.90 57.50 1fqm n TYR 51 Cb 0.38 -0.01 -0.06 0.00 -0.31 0.00 0.00 39.34 39.33 1fqm n TYR 51 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1fqm n ASP 52 N 1.13 -0.88 -2.65 7.72 4.64 -1.26 -1.94 116.55 123.31 1fqm n ASP 52 Ca 0.19 1.62 -0.30 0.00 -1.38 0.00 0.00 54.79 54.91 1fqm n ASP 52 Cb 0.49 -0.25 0.01 0.00 -1.04 0.00 0.00 41.12 40.33 1fqm n ASP 52 CO 0.00 0.00 0.00 1.67 -0.82 0.00 0.00 177.20 178.05 1fqm n GLN 53 N -5.19 3.33 -1.35 -0.67 0.00 -1.23 -5.04 117.38 107.23 1fqm n GLN 53 Ca 0.04 -4.34 -0.34 0.00 -0.00 0.00 0.00 57.00 52.35 1fqm n GLN 53 Cb 0.27 -2.26 0.10 0.00 0.00 0.00 0.00 30.24 28.35 1fqm n GLN 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1fqm s ALA 54 N -3.67 2.04 -0.35 1.69 0.00 -0.82 -4.45 121.76 116.20 1fqm s ALA 54 Ca 0.49 0.92 -0.00 0.00 0.00 0.00 0.00 51.96 53.36 1fqm s ALA 54 Cb 0.39 -3.49 0.13 0.00 0.00 0.00 0.00 23.12 20.15 1fqm s ALA 54 CO -0.23 -2.01 0.19 0.99 0.00 0.00 0.00 175.76 174.70 1fqm s THR 55 N -1.96 0.44 0.68 0.00 2.01 -1.26 -4.96 115.64 110.58 1fqm s THR 55 Ca 0.75 -1.66 -0.13 0.00 0.31 0.00 0.00 61.69 60.96 1fqm s THR 55 Cb -0.30 -1.33 0.01 0.00 0.01 0.00 0.00 72.50 70.89 1fqm s THR 55 CO 0.47 -0.89 1.07 -0.94 -0.69 0.00 0.00 174.62 173.64 1fqm s SER 56 N 1.19 5.25 0.14 3.53 1.04 -1.26 -0.48 113.70 123.11 1fqm s SER 56 Ca 0.15 1.78 0.00 0.00 0.48 0.00 0.00 55.95 58.36 1fqm s SER 56 Cb -0.21 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.39 1fqm s SER 56 CO -0.09 -1.53 0.00 0.18 0.98 0.00 0.00 173.24 172.78 1fqm n LEU 57 N -2.81 0.41 -3.91 2.42 4.77 0.73 -4.18 117.00 114.43 1fqm n LEU 57 Ca 0.09 0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 56.19 1fqm n LEU 57 Cb 0.53 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.54 1fqm n LEU 57 CO 0.52 -0.70 -0.08 -0.13 -1.33 0.00 0.00 177.39 175.66 1fqm s ARG 58 N -1.73 0.95 0.01 3.23 0.52 -1.23 -1.03 118.95 119.66 1fqm s ARG 58 Ca 0.00 -1.05 0.08 0.00 -0.52 0.00 0.00 55.73 54.23 1fqm s ARG 58 Cb 0.00 0.35 -0.02 0.00 0.52 0.00 0.00 34.95 35.79 1fqm s ARG 58 CO 0.00 -0.32 -0.24 -1.50 0.02 0.00 0.00 175.30 173.26 1fqm s ILE 59 N -3.91 1.91 -0.01 1.52 2.07 0.26 -0.56 121.20 122.49 1fqm s ILE 59 Ca 0.10 -1.17 -0.05 0.00 -1.41 0.00 0.00 60.65 58.12 1fqm s ILE 59 Cb 0.04 -1.62 0.00 0.00 0.13 0.00 0.00 42.46 41.02 1fqm s ILE 59 CO -0.07 0.41 0.10 -0.22 -1.91 0.00 0.00 174.94 173.26 1fqm s LEU 60 N -0.90 1.67 -0.47 8.50 2.96 -0.28 -0.38 118.68 129.79 1fqm s LEU 60 Ca 0.10 -0.14 -0.11 0.00 -0.22 0.00 0.00 54.13 53.75 1fqm s LEU 60 Cb -0.09 0.51 0.10 0.00 0.50 0.00 0.00 46.19 47.21 1fqm s LEU 60 CO 0.01 -0.27 0.35 0.21 -1.32 0.00 0.00 176.35 175.32 1fqm s ASN 61 N -1.03 5.81 -0.01 3.68 3.84 -0.65 -0.08 114.94 126.51 1fqm s ASN 61 Ca -0.11 -1.71 0.11 0.00 0.21 0.00 0.00 52.86 51.35 1fqm s ASN 61 Cb -0.06 -2.06 0.34 0.00 -0.55 0.00 0.00 41.25 38.92 1fqm s ASN 61 CO 0.01 -0.67 1.26 -0.46 -2.79 0.00 0.00 177.10 174.44 1fqm n ASN 62 N 5.00 2.17 0.00 -4.21 0.23 -1.10 0.23 115.26 117.58 1fqm n ASN 62 Ca -0.10 -2.06 0.00 0.00 -0.53 0.00 0.00 54.58 51.89 1fqm n ASN 62 Cb 0.42 -0.29 0.00 0.00 -2.08 0.00 0.00 39.78 37.82 1fqm n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1fqm n GLY 63 N 1.00 1.21 0.01 4.83 0.00 -1.26 -4.79 105.19 106.18 1fqm n GLY 63 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1fqm n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fqm n HIS 64 N -2.00 0.00 -3.77 1.61 8.25 -1.26 -4.65 115.22 113.40 1fqm n HIS 64 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.48 1fqm n HIS 64 Cb 0.00 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.03 1fqm n HIS 64 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fqm s ALA 65 N -2.13 -2.33 0.20 -1.41 0.00 -1.26 -4.93 121.76 109.89 1fqm s ALA 65 Ca -0.01 0.43 -0.14 0.00 0.00 0.00 0.00 51.96 52.23 1fqm s ALA 65 Cb 0.01 0.57 -0.07 0.00 0.00 0.00 0.00 23.12 23.63 1fqm s ALA 65 CO 0.10 -1.09 0.60 -0.59 0.00 0.00 0.00 175.76 174.79 1fqm s PHE 66 N -2.23 3.55 -0.11 0.00 -0.71 -1.26 -2.73 117.98 114.50 1fqm s PHE 66 Ca 0.20 1.11 -0.02 0.00 -1.04 0.00 0.00 56.93 57.17 1fqm s PHE 66 Cb 0.03 -2.41 0.04 0.00 -1.21 0.00 0.00 43.02 39.46 1fqm s PHE 66 CO -0.03 0.34 0.04 -0.80 -1.34 0.00 0.00 175.22 173.44 1fqm s ASN 67 N -1.89 1.90 -0.26 1.98 -0.87 0.89 -3.77 114.94 112.92 1fqm s ASN 67 Ca 0.42 -0.30 -0.18 0.00 -1.57 0.00 0.00 52.86 51.24 1fqm s ASN 67 Cb -0.14 -0.37 -0.03 0.00 -0.02 0.00 0.00 41.25 40.70 1fqm s ASN 67 CO 0.20 -0.26 0.52 -0.69 -2.57 0.00 0.00 177.10 174.30 1fqm s VAL 68 N 2.03 5.07 -0.02 1.60 1.01 0.48 -1.12 120.40 129.45 1fqm s VAL 68 Ca 0.03 0.90 -0.02 0.00 0.00 0.00 0.00 61.98 62.89 1fqm s VAL 68 Cb -0.14 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1fqm s VAL 68 CO -0.06 0.09 0.15 -0.70 0.00 0.00 0.00 175.10 174.58 1fqm s GLU 69 N 2.27 3.34 0.24 2.72 2.56 0.28 -1.36 118.70 128.75 1fqm s GLU 69 Ca 0.22 -0.35 0.11 0.00 0.00 0.00 0.00 54.97 54.94 1fqm s GLU 69 Cb -0.16 -3.04 -0.05 0.00 2.00 0.00 0.00 34.13 32.88 1fqm s GLU 69 CO 0.09 0.67 -0.19 -0.06 -0.56 0.00 0.00 175.26 175.22 1fqm s PHE 70 N -1.27 2.11 -0.46 5.30 0.40 0.26 -0.19 117.98 124.13 1fqm s PHE 70 Ca 0.25 -0.40 -0.27 0.00 -0.60 0.00 0.00 56.93 55.91 1fqm s PHE 70 Cb -0.12 -0.95 0.03 0.00 0.51 0.00 0.00 43.02 42.49 1fqm s PHE 70 CO 0.16 0.58 1.01 0.34 0.70 0.00 0.00 175.22 178.01 1fqm s ASP 71 N -3.32 6.56 -0.29 1.36 -1.08 0.37 -4.82 116.67 115.46 1fqm s ASP 71 Ca 0.26 0.28 0.11 0.00 -0.52 0.00 0.00 52.55 52.68 1fqm s ASP 71 Cb -0.04 -2.49 0.57 0.00 -1.46 0.00 0.00 42.92 39.50 1fqm s ASP 71 CO 0.12 -1.11 1.57 -0.90 0.52 0.00 0.00 175.17 175.36 1fqm n ASP 72 N 7.39 3.41 0.24 -0.34 5.75 -1.26 -4.68 116.55 127.06 1fqm n ASP 72 Ca 0.08 -3.46 0.12 0.00 -0.01 0.00 0.00 54.79 51.53 1fqm n ASP 72 Cb 0.49 -0.65 0.60 0.00 -1.03 0.00 0.00 41.12 40.52 1fqm n ASP 72 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1fqm h SER 73 N 1.49 0.00 -5.27 -1.12 4.64 -1.95 -3.46 113.55 107.89 1fqm h SER 73 Ca 0.22 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.44 1fqm h SER 73 Cb 1.86 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.88 1fqm h SER 73 CO 0.49 0.17 -0.07 0.00 -0.87 0.00 0.00 176.83 176.55 1fqm s GLN 74 N -3.88 1.75 -1.11 4.77 -2.07 -1.26 -5.09 119.66 112.78 1fqm s GLN 74 Ca -0.01 -1.40 -0.23 0.00 -1.82 0.00 0.00 55.36 51.90 1fqm s GLN 74 Cb 0.11 0.49 -0.12 0.00 -1.09 0.00 0.00 33.01 32.40 1fqm s GLN 74 CO 0.60 -0.75 1.95 -0.25 -1.32 0.00 0.00 175.29 175.53 1fqm n ASP 75 N -0.80 2.74 -0.07 12.60 10.43 -1.26 -4.70 116.55 135.48 1fqm n ASP 75 Ca -0.02 -2.66 -0.07 0.00 2.57 0.00 0.00 54.79 54.61 1fqm n ASP 75 Cb 0.61 -1.65 -0.02 0.00 1.84 0.00 0.00 41.12 41.90 1fqm n ASP 75 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1fqm n LYS 76 N 8.13 0.45 -3.90 -1.24 5.02 -1.26 -4.84 118.16 120.52 1fqm n LYS 76 Ca 0.45 0.30 -0.34 0.00 -2.02 0.00 0.00 58.31 56.70 1fqm n LYS 76 Cb 0.46 -1.43 -0.13 0.00 -0.02 0.00 0.00 35.03 33.90 1fqm n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fqm s ALA 77 N -2.86 2.94 0.28 7.82 0.00 -1.26 -3.51 121.76 125.18 1fqm s ALA 77 Ca -0.22 -2.23 0.07 0.00 0.00 0.00 0.00 51.96 49.58 1fqm s ALA 77 Cb 0.03 -2.10 -0.06 0.00 0.00 0.00 0.00 23.12 21.00 1fqm s ALA 77 CO 0.32 -1.56 -0.07 0.14 0.00 0.00 0.00 175.76 174.58 1fqm s VAL 78 N 1.12 1.75 -0.08 0.00 -7.23 -0.62 -1.15 120.40 114.18 1fqm s VAL 78 Ca 0.03 -2.15 0.03 0.00 -1.81 0.00 0.00 61.98 58.08 1fqm s VAL 78 Cb -0.21 -2.44 0.01 0.00 0.56 0.00 0.00 36.38 34.30 1fqm s VAL 78 CO -0.04 -0.31 -0.16 -0.22 -0.31 0.00 0.00 175.10 174.06 1fqm s LEU 79 N -3.46 1.78 0.32 1.32 2.96 0.28 -0.89 118.68 120.99 1fqm s LEU 79 Ca 0.29 -0.40 0.05 0.00 -0.22 0.00 0.00 54.13 53.86 1fqm s LEU 79 Cb 0.03 -1.04 -0.03 0.00 0.50 0.00 0.00 46.19 45.65 1fqm s LEU 79 CO 0.12 0.06 0.28 -0.54 -1.32 0.00 0.00 176.35 174.96 1fqm s LYS 80 N 0.64 1.72 2.47 1.98 1.02 -0.00 -1.09 119.74 126.48 1fqm s LYS 80 Ca -0.14 -1.95 0.00 0.00 0.02 0.00 0.00 55.97 53.90 1fqm s LYS 80 Cb -0.16 0.33 0.00 0.00 -0.52 0.00 0.00 37.83 37.48 1fqm s LYS 80 CO 0.04 -0.64 0.00 0.41 -0.92 0.00 0.00 175.35 174.24 1fqm n GLY 81 N -0.58 -0.21 7.00 -3.33 0.00 -1.26 0.19 105.19 107.00 1fqm n GLY 81 Ca 0.06 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1fqm n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fqm n GLY 82 N 0.00 3.46 0.18 -0.02 0.00 -0.09 -0.35 105.19 108.37 1fqm n GLY 82 Ca 0.00 -0.14 0.15 0.00 0.00 0.00 0.00 46.02 46.03 1fqm n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fqm n PRO 83 N 14.00 1.06 -2.78 1.61 -0.04 -1.26 -3.70 135.00 143.89 1fqm n PRO 83 Ca 0.00 -0.37 -0.41 0.00 -0.04 0.00 0.00 63.50 62.68 1fqm n PRO 83 Cb 0.00 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 1fqm n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fqm s LEU 84 N -2.20 4.54 -0.22 1.53 1.43 0.53 -5.04 118.68 119.24 1fqm s LEU 84 Ca 0.37 1.79 -0.07 0.00 -1.03 0.00 0.00 54.13 55.19 1fqm s LEU 84 Cb 0.21 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.86 1fqm s LEU 84 CO 0.40 0.02 0.07 -1.81 0.23 0.00 0.00 176.35 175.27 1fqm s ASP 85 N -0.41 5.36 0.00 2.29 1.01 -1.26 -4.14 116.67 119.52 1fqm s ASP 85 Ca 0.44 -0.08 0.00 0.00 0.71 0.00 0.00 52.55 53.62 1fqm s ASP 85 Cb -0.24 -1.94 0.00 0.00 1.01 0.00 0.00 42.92 41.75 1fqm s ASP 85 CO 0.29 0.05 0.00 0.61 0.21 0.00 0.00 175.17 176.34 1fqm n GLY 86 N 4.33 -1.43 3.25 0.21 0.00 -1.26 -4.95 105.19 105.35 1fqm n GLY 86 Ca -0.16 -1.63 -0.28 0.00 0.00 0.00 0.00 46.02 43.94 1fqm n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fqm s THR 87 N 0.00 1.76 -0.11 2.61 2.01 -1.26 -4.43 115.64 116.22 1fqm s THR 87 Ca 0.00 -1.01 0.02 0.00 0.31 0.00 0.00 61.69 61.01 1fqm s THR 87 Cb 0.00 -1.48 0.02 0.00 0.01 0.00 0.00 72.50 71.05 1fqm s THR 87 CO 0.00 0.45 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.92 1fqm s TYR 88 N -0.57 2.00 -0.07 4.92 1.51 -0.25 -1.50 117.35 123.39 1fqm s TYR 88 Ca 0.09 -0.96 -0.22 0.00 -1.01 0.00 0.00 57.07 54.97 1fqm s TYR 88 Cb -0.09 -1.44 -0.04 0.00 -0.11 0.00 0.00 41.96 40.28 1fqm s TYR 88 CO -0.00 -0.50 0.64 1.03 -1.11 0.00 0.00 175.55 175.61 1fqm s ARG 89 N 1.03 4.40 0.08 -0.62 0.52 0.42 -0.56 118.95 124.21 1fqm s ARG 89 Ca -0.06 0.77 -0.31 0.00 -0.52 0.00 0.00 55.73 55.61 1fqm s ARG 89 Cb -0.15 -3.43 -0.07 0.00 0.52 0.00 0.00 34.95 31.82 1fqm s ARG 89 CO -0.02 0.14 1.42 -1.17 0.02 0.00 0.00 175.30 175.68 1fqm s LEU 90 N 0.59 4.35 -0.03 2.53 2.96 -0.30 -1.30 118.68 127.48 1fqm s LEU 90 Ca 0.34 2.28 0.01 0.00 -0.22 0.00 0.00 54.13 56.53 1fqm s LEU 90 Cb -0.17 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.92 1fqm s LEU 90 CO 0.16 -0.70 -0.02 0.00 -1.32 0.00 0.00 176.35 174.48 1fqm n ILE 91 N 4.24 0.19 -3.52 6.68 3.06 -0.20 -4.44 119.36 125.36 1fqm n ILE 91 Ca 0.12 -0.08 -0.14 0.00 -2.50 0.00 0.00 62.75 60.15 1fqm n ILE 91 Cb 0.43 -0.69 -0.05 0.00 0.54 0.00 0.00 39.64 39.87 1fqm n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1fqm s GLN 92 N -2.07 1.10 -0.07 9.51 -2.07 -1.18 -0.57 119.66 124.32 1fqm s GLN 92 Ca -0.04 -0.18 0.02 0.00 -1.82 0.00 0.00 55.36 53.34 1fqm s GLN 92 Cb 0.01 0.51 0.02 0.00 -1.09 0.00 0.00 33.01 32.45 1fqm s GLN 92 CO 0.08 -0.41 -0.11 0.42 -1.32 0.00 0.00 175.29 173.96 1fqm s ILE 93 N -2.48 1.05 0.19 3.63 1.01 -0.47 -0.34 121.20 123.78 1fqm s ILE 93 Ca -0.05 -0.41 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 1fqm s ILE 93 Cb -0.01 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.45 1fqm s ILE 93 CO -0.02 0.34 0.16 -1.38 0.00 0.00 0.00 174.94 174.04 1fqm s HIS 94 N 0.83 0.94 -0.02 3.97 -3.43 -0.86 -0.38 115.29 116.34 1fqm s HIS 94 Ca -0.12 -1.23 0.04 0.00 -0.80 0.00 0.00 55.06 52.96 1fqm s HIS 94 Cb -0.15 -0.42 -0.01 0.00 -1.43 0.00 0.00 32.58 30.57 1fqm s HIS 94 CO 0.02 -0.66 -0.14 1.41 -2.00 0.00 0.00 174.74 173.37 1fqm s MET 95 N -4.10 1.20 -0.19 -0.38 1.75 -1.25 -1.10 119.30 115.22 1fqm s MET 95 Ca 0.32 -0.49 -0.07 0.00 -1.25 0.00 0.00 55.69 54.19 1fqm s MET 95 Cb 0.06 -1.13 -0.04 0.00 2.84 0.00 0.00 34.83 36.56 1fqm s MET 95 CO 0.08 0.28 0.06 -1.01 -0.65 0.00 0.00 175.02 173.78 1fqm s HIS 96 N -0.23 3.22 0.05 4.11 3.76 0.33 -4.65 115.29 121.88 1fqm s HIS 96 Ca 0.03 -0.00 0.03 0.00 -0.15 0.00 0.00 55.06 54.97 1fqm s HIS 96 Cb -0.06 -2.11 -0.03 0.00 1.11 0.00 0.00 32.58 31.49 1fqm s HIS 96 CO -0.00 0.07 -0.09 0.54 -0.85 0.00 0.00 174.74 174.41 1fqm s VAL 97 N 0.58 0.66 0.52 -0.90 0.11 -1.25 -0.35 120.40 119.77 1fqm s VAL 97 Ca 0.03 -1.16 0.08 0.00 -2.93 0.00 0.00 61.98 58.01 1fqm s VAL 97 Cb -0.13 -0.74 0.05 0.00 -1.53 0.00 0.00 36.38 34.03 1fqm s VAL 97 CO 0.01 -0.37 0.63 -0.83 -3.33 0.00 0.00 175.10 171.21 1fqm s GLY 98 N -1.67 1.94 0.16 6.54 0.00 -0.99 0.50 107.32 113.79 1fqm s GLY 98 Ca -0.08 -1.86 0.23 0.00 0.00 0.00 0.00 44.72 43.01 1fqm s GLY 98 CO 0.01 -1.70 1.09 -1.14 0.00 0.00 0.00 173.10 171.36 1fqm n SER 99 N -2.00 0.76 -4.21 1.64 3.41 -1.26 -4.37 113.62 107.60 1fqm n SER 99 Ca 0.10 0.20 -0.16 0.00 -0.26 0.00 0.00 58.87 58.75 1fqm n SER 99 Cb 0.62 0.47 -0.11 0.00 -0.26 0.00 0.00 64.21 64.93 1fqm n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1fqm s LEU 100 N -4.90 2.42 0.51 1.04 1.43 -1.26 -5.05 118.68 112.87 1fqm s LEU 100 Ca 0.01 -0.83 0.20 0.00 -1.03 0.00 0.00 54.13 52.48 1fqm s LEU 100 Cb 0.11 -0.40 1.30 0.00 0.03 0.00 0.00 46.19 47.23 1fqm s LEU 100 CO 0.78 -0.23 2.07 0.44 0.23 0.00 0.00 176.35 179.64 1fqm h ASP 101 N 3.46 0.04 -0.26 2.29 5.19 -1.93 -2.59 116.42 122.62 1fqm h ASP 101 Ca -0.38 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 55.99 1fqm h ASP 101 Cb 1.19 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 40.67 1fqm h ASP 101 CO 0.53 0.03 0.05 0.61 -3.12 0.00 0.00 179.24 177.34 1fqm n GLY 102 N -1.58 2.28 3.42 2.75 0.00 -1.26 -3.11 105.19 107.69 1fqm n GLY 102 Ca 0.04 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 1fqm n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1fqm s GLN 103 N -1.62 1.20 0.00 1.61 -2.07 -0.98 -4.59 119.66 113.22 1fqm s GLN 103 Ca 0.22 -0.38 0.00 0.00 -1.82 0.00 0.00 55.36 53.38 1fqm s GLN 103 Cb 0.17 0.55 0.00 0.00 -1.09 0.00 0.00 33.01 32.65 1fqm s GLN 103 CO 0.06 -0.50 0.00 0.41 -1.32 0.00 0.00 175.29 173.94 1fqm n GLY 104 N -0.12 4.44 3.81 2.60 0.00 -1.04 -3.44 105.19 111.44 1fqm n GLY 104 Ca -0.17 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.82 1fqm n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fqm s SER 105 N 0.00 5.79 -0.20 1.61 1.04 -0.66 -3.82 113.70 117.45 1fqm s SER 105 Ca 0.00 1.77 -0.18 0.00 0.48 0.00 0.00 55.95 58.02 1fqm s SER 105 Cb 0.00 -2.53 -0.15 0.00 0.10 0.00 0.00 66.02 63.45 1fqm s SER 105 CO 0.00 -1.16 0.06 -0.62 0.98 0.00 0.00 173.24 172.50 1fqm n GLU 106 N -2.15 0.54 -2.66 4.02 1.02 -1.26 -4.83 120.64 115.33 1fqm n GLU 106 Ca 0.08 0.53 -0.34 0.00 -0.02 0.00 0.00 57.16 57.41 1fqm n GLU 106 Cb 0.53 -1.70 -0.05 0.00 -0.02 0.00 0.00 31.44 30.20 1fqm n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1fqm s HIS 107 N -2.37 3.15 0.14 -0.32 3.76 -1.26 -4.24 115.29 114.15 1fqm s HIS 107 Ca -0.27 1.60 0.08 0.00 -0.15 0.00 0.00 55.06 56.32 1fqm s HIS 107 Cb 0.06 -2.98 -0.04 0.00 1.11 0.00 0.00 32.58 30.73 1fqm s HIS 107 CO 0.50 -0.52 -0.18 0.95 -0.85 0.00 0.00 174.74 174.64 1fqm s THR 108 N -2.03 1.70 -0.27 1.30 -4.23 -1.17 -4.74 115.64 106.20 1fqm s THR 108 Ca 0.64 -1.75 -0.00 0.00 -1.18 0.00 0.00 61.69 59.40 1fqm s THR 108 Cb -0.14 -1.69 0.04 0.00 1.34 0.00 0.00 72.50 72.06 1fqm s THR 108 CO 0.18 -0.24 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.27 1fqm s VAL 109 N -1.74 2.69 -1.53 2.29 1.01 -0.53 -0.29 120.40 122.31 1fqm s VAL 109 Ca 0.11 -1.30 -0.13 0.00 0.00 0.00 0.00 61.98 60.66 1fqm s VAL 109 Cb -0.07 -2.47 0.09 0.00 0.00 0.00 0.00 36.38 33.92 1fqm s VAL 109 CO 0.05 0.05 0.91 0.47 0.00 0.00 0.00 175.10 176.59 1fqm n ASP 110 N 4.59 -4.10 0.00 3.32 8.00 0.13 -0.72 116.55 127.78 1fqm n ASP 110 Ca -0.15 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.53 1fqm n ASP 110 Cb 0.45 -3.71 0.00 0.00 -0.02 0.00 0.00 41.12 37.84 1fqm n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1fqm n LYS 111 N -4.60 0.00 -2.49 -1.24 4.76 -1.26 -4.99 118.16 108.34 1fqm n LYS 111 Ca 0.00 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.03 1fqm n LYS 111 Cb 0.54 -1.83 -0.04 0.00 -1.84 0.00 0.00 35.03 31.86 1fqm n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1fqm s LYS 112 N -0.01 4.57 0.01 1.97 2.20 0.11 -4.97 119.74 123.61 1fqm s LYS 112 Ca 0.00 1.74 0.02 0.00 -0.36 0.00 0.00 55.97 57.37 1fqm s LYS 112 Cb 0.00 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1fqm s LYS 112 CO 0.00 0.03 -0.01 0.15 -0.36 0.00 0.00 175.35 175.15 1fqm s LYS 113 N -0.25 2.72 0.40 4.03 1.02 -1.26 -1.45 119.74 124.94 1fqm s LYS 113 Ca 0.50 -0.65 0.08 0.00 0.02 0.00 0.00 55.97 55.92 1fqm s LYS 113 Cb -0.30 -2.62 0.00 0.00 -0.52 0.00 0.00 37.83 34.39 1fqm s LYS 113 CO 0.35 0.61 0.53 0.71 -0.92 0.00 0.00 175.35 176.63 1fqm s TYR 114 N -1.08 2.86 0.33 3.18 2.02 -1.26 -4.50 117.35 118.90 1fqm s TYR 114 Ca 0.19 -0.37 0.27 0.00 -0.37 0.00 0.00 57.07 56.79 1fqm s TYR 114 Cb -0.11 -2.27 1.30 0.00 -0.40 0.00 0.00 41.96 40.47 1fqm s TYR 114 CO 0.10 -0.30 2.00 0.00 -1.57 0.00 0.00 175.55 175.78 1fqm h ALA 115 N 0.74 1.19 -2.29 3.71 0.00 -1.41 -1.69 119.26 119.51 1fqm h ALA 115 Ca -0.41 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 54.51 1fqm h ALA 115 Cb 1.27 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.92 1fqm h ALA 115 CO 0.48 0.19 0.50 0.00 0.00 0.00 0.00 179.25 180.42 1fqm s ALA 116 N -4.01 -1.76 -0.04 0.00 0.00 -1.23 -2.35 121.76 112.38 1fqm s ALA 116 Ca -0.02 0.59 -0.02 0.00 0.00 0.00 0.00 51.96 52.52 1fqm s ALA 116 Cb 0.12 0.52 0.03 0.00 0.00 0.00 0.00 23.12 23.79 1fqm s ALA 116 CO 0.60 -0.86 0.05 -2.00 0.00 0.00 0.00 175.76 173.54 1fqm s GLU 117 N -3.18 -0.02 0.03 0.00 2.12 0.52 -1.68 118.70 116.49 1fqm s GLU 117 Ca 0.09 0.32 -0.19 0.00 0.36 0.00 0.00 54.97 55.55 1fqm s GLU 117 Cb -0.01 -0.49 -0.06 0.00 0.26 0.00 0.00 34.13 33.83 1fqm s GLU 117 CO -0.04 -0.30 0.54 -1.17 -0.54 0.00 0.00 175.26 173.75 1fqm s LEU 118 N 1.94 4.47 -0.13 2.70 2.96 -0.37 -0.51 118.68 129.74 1fqm s LEU 118 Ca 0.02 1.15 0.02 0.00 -0.22 0.00 0.00 54.13 55.09 1fqm s LEU 118 Cb -0.12 -2.82 0.01 0.00 0.50 0.00 0.00 46.19 43.76 1fqm s LEU 118 CO -0.03 0.23 -0.18 -1.00 -1.32 0.00 0.00 176.35 174.05 1fqm s HIS 119 N -0.76 2.29 -0.39 5.38 3.76 -0.26 -1.59 115.29 123.72 1fqm s HIS 119 Ca 0.28 -1.17 -0.06 0.00 -0.15 0.00 0.00 55.06 53.96 1fqm s HIS 119 Cb -0.18 -1.62 0.08 0.00 1.11 0.00 0.00 32.58 31.97 1fqm s HIS 119 CO 0.17 -0.58 0.19 -0.51 -0.85 0.00 0.00 174.74 173.15 1fqm s LEU 120 N 1.05 4.89 -0.13 0.89 1.02 -0.22 -2.04 118.68 124.15 1fqm s LEU 120 Ca -0.04 -1.57 -0.25 0.00 0.02 0.00 0.00 54.13 52.29 1fqm s LEU 120 Cb -0.15 -1.89 -0.02 0.00 0.02 0.00 0.00 46.19 44.15 1fqm s LEU 120 CO -0.04 -0.47 0.81 -0.69 0.02 0.00 0.00 176.35 175.97 1fqm s VAL 121 N 1.32 4.92 0.09 -1.59 1.01 0.54 -0.83 120.40 125.86 1fqm s VAL 121 Ca 0.03 1.62 0.07 0.00 0.00 0.00 0.00 61.98 63.70 1fqm s VAL 121 Cb -0.22 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 1fqm s VAL 121 CO -0.00 0.10 -0.18 -1.00 0.00 0.00 0.00 175.10 174.02 1fqm s HIS 122 N 1.68 1.58 0.12 5.22 3.76 -0.15 -1.04 115.29 126.46 1fqm s HIS 122 Ca 0.39 -0.43 0.10 0.00 -0.15 0.00 0.00 55.06 54.98 1fqm s HIS 122 Cb -0.17 -0.88 -0.04 0.00 1.11 0.00 0.00 32.58 32.60 1fqm s HIS 122 CO 0.15 0.14 -0.25 1.67 -0.85 0.00 0.00 174.74 175.60 1fqm s TRP 123 N -1.16 2.16 -0.15 1.40 1.48 -0.42 -0.84 118.94 121.41 1fqm s TRP 123 Ca 0.03 -0.39 -0.29 0.00 -1.06 0.00 0.00 56.10 54.39 1fqm s TRP 123 Cb -0.10 -1.17 -0.03 0.00 -1.16 0.00 0.00 33.47 31.01 1fqm s TRP 123 CO 0.03 0.29 1.49 1.21 -4.06 0.00 0.00 176.95 175.92 1fqm s ASN 124 N -1.98 6.67 0.20 -2.66 3.84 0.19 -0.44 114.94 120.76 1fqm s ASN 124 Ca 0.12 1.81 0.18 0.00 0.21 0.00 0.00 52.86 55.18 1fqm s ASN 124 Cb -0.10 -2.53 0.84 0.00 -0.55 0.00 0.00 41.25 38.90 1fqm s ASN 124 CO 0.05 -0.98 1.54 0.35 -2.79 0.00 0.00 177.10 175.27 1fqm n THR 125 N 5.76 1.13 1.37 -5.21 -2.24 -0.56 -1.99 114.28 112.53 1fqm n THR 125 Ca 0.16 0.46 0.11 0.00 -2.27 0.00 0.00 64.05 62.52 1fqm n THR 125 Cb 0.44 -1.41 0.66 0.00 -2.10 0.00 0.00 70.33 67.93 1fqm n THR 125 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1fqm n LYS 127 N -2.02 0.65 -0.00 -0.78 2.85 -1.26 -3.42 118.16 114.18 1fqm n LYS 127 Ca 0.01 0.01 0.06 0.00 -1.05 0.00 0.00 58.31 57.34 1fqm n LYS 127 Cb 0.11 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 32.91 1fqm n LYS 127 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1fqm n TYR 128 N -1.04 0.00 0.00 5.58 4.01 -0.84 -5.04 117.16 119.83 1fqm n TYR 128 Ca 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.90 1fqm n TYR 128 Cb 0.09 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 1fqm n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fqm n GLY 129 N 1.32 2.76 3.76 2.72 0.00 -1.22 -4.55 105.19 109.99 1fqm n GLY 129 Ca 0.03 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 1fqm n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fqm s ASP 130 N 0.00 0.10 0.20 1.61 1.47 -1.26 -5.04 116.67 113.75 1fqm s ASP 130 Ca 0.00 -1.11 -0.11 0.00 1.18 0.00 0.00 52.55 52.51 1fqm s ASP 130 Cb 0.00 0.80 0.18 0.00 -0.34 0.00 0.00 42.92 43.56 1fqm s ASP 130 CO 0.00 -1.56 1.81 0.15 0.68 0.00 0.00 175.17 176.25 1fqm h PHE 131 N 2.03 0.62 -0.87 2.11 3.57 -1.94 -0.27 116.94 122.19 1fqm h PHE 131 Ca -0.29 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.24 1fqm h PHE 131 Cb 1.25 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 39.75 1fqm h PHE 131 CO 1.21 0.32 0.57 0.78 -2.23 0.00 0.00 178.31 178.96 1fqm h GLY 132 N 0.65 1.23 0.96 2.40 0.00 -1.97 -1.52 103.07 104.82 1fqm h GLY 132 Ca 0.26 -0.45 -0.13 0.00 0.00 0.00 0.00 47.33 47.01 1fqm h GLY 132 CO -0.15 0.42 -0.36 0.50 0.00 0.00 0.00 176.54 176.95 1fqm h LYS 133 N 1.15 0.66 -0.77 4.80 1.79 -1.77 -3.25 116.57 119.18 1fqm h LYS 133 Ca 0.33 -0.40 0.06 0.00 -2.18 0.00 0.00 60.65 58.45 1fqm h LYS 133 Cb -0.09 0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 30.55 1fqm h LYS 133 CO -0.08 1.01 0.50 0.00 -1.08 0.00 0.00 179.45 179.81 1fqm h ALA 134 N 0.64 1.62 0.00 3.86 0.00 -0.63 -2.12 119.26 122.63 1fqm h ALA 134 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fqm h ALA 134 Cb 0.95 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1fqm h ALA 134 CO 0.08 0.27 0.00 1.33 0.00 0.00 0.00 179.25 180.94 1fqm n VAL 135 N -4.47 0.00 0.01 0.00 0.24 -0.61 -1.26 118.33 112.23 1fqm n VAL 135 Ca 0.11 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.46 1fqm n VAL 135 Cb 0.19 -0.19 0.11 0.00 -1.47 0.00 0.00 33.84 32.47 1fqm n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fqm n GLN 136 N -0.32 2.17 -5.23 7.34 6.02 -0.80 -4.93 117.38 121.63 1fqm n GLN 136 Ca 0.00 -1.74 -0.30 0.00 -0.01 0.00 0.00 57.00 54.95 1fqm n GLN 136 Cb 0.06 -1.23 -0.16 0.00 1.02 0.00 0.00 30.24 29.93 1fqm n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1fqm s GLN 137 N -0.95 2.03 0.46 -1.09 -1.52 -0.39 -5.02 119.66 113.18 1fqm s GLN 137 Ca 0.18 -0.93 0.31 0.00 -1.95 0.00 0.00 55.36 52.98 1fqm s GLN 137 Cb 0.10 -1.99 1.57 0.00 -0.22 0.00 0.00 33.01 32.48 1fqm s GLN 137 CO 0.14 0.54 1.95 -1.00 -0.25 0.00 0.00 175.29 176.67 1fqm h PRO 138 N 5.43 0.00 -0.27 2.91 0.13 -1.85 -1.85 132.00 136.50 1fqm h PRO 138 Ca -0.43 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.48 1fqm h PRO 138 Cb 1.12 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.99 1fqm h PRO 138 CO 0.47 0.00 -0.80 -0.40 -0.23 0.00 0.00 178.00 177.04 1fqm n ASP 139 N -2.66 2.42 0.19 1.44 5.75 -1.25 -4.13 116.55 118.30 1fqm n ASP 139 Ca -0.01 -3.18 0.10 0.00 -0.01 0.00 0.00 54.79 51.70 1fqm n ASP 139 Cb 0.13 -0.42 0.13 0.00 -1.03 0.00 0.00 41.12 39.93 1fqm n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1fqm h GLY 140 N 1.57 0.00 -2.73 6.12 0.00 -1.01 -3.43 103.07 103.60 1fqm h GLY 140 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.92 1fqm h GLY 140 CO 0.26 0.00 -0.74 1.08 0.00 0.00 0.00 176.54 177.14 1fqm s LEU 141 N -6.19 2.53 -0.08 3.11 1.43 -0.16 0.54 118.68 119.86 1fqm s LEU 141 Ca 0.06 -0.99 -0.03 0.00 -1.03 0.00 0.00 54.13 52.14 1fqm s LEU 141 Cb 0.06 -0.65 0.04 0.00 0.03 0.00 0.00 46.19 45.67 1fqm s LEU 141 CO 0.69 -0.17 0.11 0.00 0.23 0.00 0.00 176.35 177.21 1fqm s ALA 142 N -2.84 0.10 -0.13 4.21 0.00 -0.02 -1.40 121.76 121.68 1fqm s ALA 142 Ca 0.20 0.25 0.01 0.00 0.00 0.00 0.00 51.96 52.42 1fqm s ALA 142 Cb -0.01 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.32 1fqm s ALA 142 CO 0.06 -0.65 -0.15 0.08 0.00 0.00 0.00 175.76 175.10 1fqm s VAL 143 N 2.22 2.79 -0.42 0.00 1.01 -0.83 -0.97 120.40 124.20 1fqm s VAL 143 Ca 0.04 -0.75 -0.19 0.00 0.00 0.00 0.00 61.98 61.08 1fqm s VAL 143 Cb -0.13 -2.16 0.02 0.00 0.00 0.00 0.00 36.38 34.11 1fqm s VAL 143 CO -0.05 0.53 0.55 -0.22 0.00 0.00 0.00 175.10 175.91 1fqm s LEU 144 N 0.48 4.60 -0.18 3.92 2.96 -0.01 -1.44 118.68 129.01 1fqm s LEU 144 Ca -0.11 -0.41 -0.10 0.00 -0.22 0.00 0.00 54.13 53.30 1fqm s LEU 144 Cb -0.16 -2.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.89 1fqm s LEU 144 CO 0.05 -0.67 0.14 -0.83 -1.32 0.00 0.00 176.35 173.72 1fqm s GLY 145 N 1.90 2.07 -0.10 7.98 0.00 0.23 -1.06 107.32 118.35 1fqm s GLY 145 Ca 0.18 -0.67 -0.00 0.00 0.00 0.00 0.00 44.72 44.23 1fqm s GLY 145 CO 0.16 0.04 -0.06 -0.42 0.00 0.00 0.00 173.10 172.83 1fqm s ILE 146 N 0.08 0.83 0.60 0.90 1.01 -0.62 -0.97 121.20 123.02 1fqm s ILE 146 Ca 0.10 -0.18 -0.15 0.00 0.00 0.00 0.00 60.65 60.42 1fqm s ILE 146 Cb -0.11 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 1fqm s ILE 146 CO -0.01 0.33 1.04 -0.36 0.00 0.00 0.00 174.94 175.95 1fqm s PHE 147 N 1.69 3.12 -0.08 3.97 0.08 -1.26 -1.24 117.98 124.26 1fqm s PHE 147 Ca 0.03 1.48 0.04 0.00 0.12 0.00 0.00 56.93 58.61 1fqm s PHE 147 Cb -0.13 -2.94 -0.00 0.00 -0.57 0.00 0.00 43.02 39.39 1fqm s PHE 147 CO -0.06 -0.98 -0.22 -0.51 -0.10 0.00 0.00 175.22 173.35 1fqm s LEU 148 N -4.61 2.00 0.02 -0.37 1.02 -0.67 -0.74 118.68 115.33 1fqm s LEU 148 Ca 0.61 -0.48 0.04 0.00 0.02 0.00 0.00 54.13 54.33 1fqm s LEU 148 Cb -0.14 -1.26 -0.02 0.00 0.02 0.00 0.00 46.19 44.79 1fqm s LEU 148 CO 0.39 0.16 -0.13 -1.59 0.02 0.00 0.00 176.35 175.21 1fqm s LYS 149 N 0.21 0.92 0.16 1.70 -2.85 -0.34 -2.43 119.74 117.11 1fqm s LYS 149 Ca -0.12 -0.63 -0.31 0.00 -1.00 0.00 0.00 55.97 53.91 1fqm s LYS 149 Cb -0.16 -0.91 -0.10 0.00 -2.06 0.00 0.00 37.83 34.61 1fqm s LYS 149 CO 0.06 0.23 1.55 0.08 0.10 0.00 0.00 175.35 177.37 1fqm s VAL 150 N -0.65 2.69 0.00 1.79 1.01 -1.25 -1.00 120.40 122.97 1fqm s VAL 150 Ca 0.02 0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.50 1fqm s VAL 150 Cb -0.07 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 33.00 1fqm s VAL 150 CO 0.01 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.76 1fqm n GLY 151 N 3.67 2.03 3.84 4.51 0.00 0.10 -4.76 105.19 114.58 1fqm n GLY 151 Ca 0.13 0.13 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 1fqm n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fqm s SER 152 N 2.00 6.60 0.34 1.61 1.04 -1.26 -3.60 113.70 120.43 1fqm s SER 152 Ca 0.00 1.54 -0.29 0.00 0.48 0.00 0.00 55.95 57.69 1fqm s SER 152 Cb 0.00 -2.50 -0.12 0.00 0.10 0.00 0.00 66.02 63.50 1fqm s SER 152 CO 0.00 -0.59 1.41 0.00 0.98 0.00 0.00 173.24 175.04 1fqm n ALA 153 N -1.63 1.81 -2.66 5.32 0.00 -1.26 -3.17 120.51 118.92 1fqm n ALA 153 Ca 0.06 0.36 -0.44 0.00 0.00 0.00 0.00 53.44 53.43 1fqm n ALA 153 Cb 0.54 -2.34 -0.08 0.00 0.00 0.00 0.00 19.45 17.57 1fqm n ALA 153 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1fqm s LYS 154 N -1.61 3.04 0.24 0.00 2.47 -1.25 -4.86 119.74 117.76 1fqm s LYS 154 Ca 0.57 -1.04 -0.06 0.00 -1.56 0.00 0.00 55.97 53.89 1fqm s LYS 154 Cb -0.54 -4.05 0.43 0.00 -1.46 0.00 0.00 37.83 32.21 1fqm s LYS 154 CO 0.60 -0.96 1.71 -1.35 0.16 0.00 0.00 175.35 175.50 1fqm h PRO 155 N 8.77 0.32 -0.63 4.03 0.11 -1.92 -1.48 132.00 141.20 1fqm h PRO 155 Ca -0.27 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.84 1fqm h PRO 155 Cb 1.11 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 1fqm h PRO 155 CO 0.84 0.21 0.42 0.78 -0.21 0.00 0.00 178.00 180.04 1fqm h GLY 156 N 0.33 0.86 2.00 -0.55 0.00 -1.92 -1.61 103.07 102.18 1fqm h GLY 156 Ca 0.40 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 1fqm h GLY 156 CO -0.45 0.27 -0.41 1.41 0.00 0.00 0.00 176.54 177.36 1fqm h LEU 157 N 0.77 0.00 -1.67 3.11 3.38 -1.51 -3.27 115.31 116.13 1fqm h LEU 157 Ca 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1fqm h LEU 157 Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1fqm h LEU 157 CO -0.06 0.41 0.05 -0.61 0.09 0.00 0.00 178.44 178.32 1fqm h GLN 158 N 0.00 0.27 -0.65 1.13 5.75 -0.48 0.93 115.11 122.05 1fqm h GLN 158 Ca -0.00 -0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.53 1fqm h GLN 158 Cb 1.27 -0.05 -0.06 0.00 1.07 0.00 0.00 27.48 29.71 1fqm h GLN 158 CO 0.05 0.25 0.35 0.87 -2.65 0.00 0.00 178.83 177.70 1fqm h LYS 159 N 0.27 0.62 -0.06 1.69 6.56 -1.58 -1.22 116.57 122.84 1fqm h LYS 159 Ca 0.07 -0.04 -0.03 0.00 -1.06 0.00 0.00 60.65 59.59 1fqm h LYS 159 Cb 0.10 -0.14 -0.00 0.00 -0.57 0.00 0.00 32.23 31.62 1fqm h LYS 159 CO -0.00 0.41 -0.08 0.28 -2.06 0.00 0.00 179.45 178.00 1fqm h VAL 160 N 0.63 1.39 -0.79 0.50 2.07 -1.08 -3.23 116.25 115.74 1fqm h VAL 160 Ca 0.30 -1.28 0.18 0.00 0.82 0.00 0.00 66.70 66.72 1fqm h VAL 160 Cb 0.22 2.10 -0.14 0.00 -1.52 0.00 0.00 31.29 31.95 1fqm h VAL 160 CO -0.20 0.35 0.00 0.58 0.02 0.00 0.00 177.57 178.33 1fqm h VAL 161 N -0.30 0.30 0.00 2.57 2.07 -0.61 -0.78 116.25 119.50 1fqm h VAL 161 Ca 0.01 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1fqm h VAL 161 Cb 0.61 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1fqm h VAL 161 CO 0.02 0.02 0.00 0.47 0.02 0.00 0.00 177.57 178.10 1fqm n ASP 162 N -5.36 0.00 0.00 0.57 8.00 -0.50 -2.34 116.55 116.92 1fqm n ASP 162 Ca 0.15 -0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.64 1fqm n ASP 162 Cb 0.50 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 1fqm n ASP 162 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1fqm n VAL 163 N -1.17 0.00 -0.27 2.53 3.14 -0.31 -4.76 118.33 117.49 1fqm n VAL 163 Ca 0.05 -0.40 0.09 0.00 -2.96 0.00 0.00 64.34 61.12 1fqm n VAL 163 Cb 0.05 1.17 0.34 0.00 -1.06 0.00 0.00 33.84 34.34 1fqm n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1fqm h LEU 164 N 0.00 0.73 -1.22 6.55 3.38 -1.34 -1.27 115.31 122.13 1fqm h LEU 164 Ca 0.00 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1fqm h LEU 164 Cb 0.09 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1fqm h LEU 164 CO 0.00 0.41 -0.08 -0.78 0.09 0.00 0.00 178.44 178.08 1fqm h ASP 165 N 0.79 0.41 -0.81 -0.43 3.58 -1.86 -2.13 116.42 115.98 1fqm h ASP 165 Ca 0.42 -0.09 0.01 0.00 0.42 0.00 0.00 57.03 57.79 1fqm h ASP 165 Cb 0.52 -0.11 -0.04 0.00 1.72 0.00 0.00 39.33 41.42 1fqm h ASP 165 CO -0.18 0.54 0.54 0.28 -2.88 0.00 0.00 179.24 177.54 1fqm h SER 166 N 0.41 0.92 -0.77 2.28 0.02 -1.58 -2.94 113.55 111.89 1fqm h SER 166 Ca 0.08 -0.02 -0.51 0.00 -0.84 0.00 0.00 61.79 60.50 1fqm h SER 166 Cb 0.40 -0.23 -0.30 0.00 0.14 0.00 0.00 62.40 62.42 1fqm h SER 166 CO 0.02 0.66 0.05 2.30 -1.14 0.00 0.00 176.83 178.72 1fqm n ILE 167 N -4.53 2.98 -0.30 3.27 -5.35 -0.97 -4.77 119.36 109.70 1fqm n ILE 167 Ca 0.09 -3.28 0.04 0.00 -0.27 0.00 0.00 62.75 59.32 1fqm n ILE 167 Cb 0.03 -0.92 0.18 0.00 -1.74 0.00 0.00 39.64 37.19 1fqm n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1fqm h LYS 168 N 1.77 0.75 -6.14 6.28 3.64 -1.21 -3.42 116.57 118.25 1fqm h LYS 168 Ca 0.44 -0.05 -0.53 0.00 -1.27 0.00 0.00 60.65 59.25 1fqm h LYS 168 Cb 1.40 -0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 32.98 1fqm h LYS 168 CO 1.00 0.50 -0.53 0.95 -2.27 0.00 0.00 179.45 179.09 1fqm s THR 169 N -6.02 3.36 0.07 1.00 -4.23 -1.26 -0.09 115.64 108.47 1fqm s THR 169 Ca -0.12 -1.63 -0.33 0.00 -1.18 0.00 0.00 61.69 58.42 1fqm s THR 169 Cb 0.20 -3.05 -0.12 0.00 1.34 0.00 0.00 72.50 70.87 1fqm s THR 169 CO 0.78 -0.23 1.74 1.17 -0.54 0.00 0.00 174.62 177.54 1fqm n LYS 170 N -1.16 2.32 0.00 3.99 4.81 0.16 -2.36 118.16 125.92 1fqm n LYS 170 Ca -0.04 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 1fqm n LYS 170 Cb 0.60 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 32.98 1fqm n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fqm n GLY 171 N 3.93 0.04 3.76 3.14 0.00 0.14 -4.52 105.19 111.68 1fqm n GLY 171 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 1fqm n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fqm s LYS 172 N -0.97 4.43 0.13 1.61 1.02 -1.00 -4.90 119.74 120.07 1fqm s LYS 172 Ca 0.00 0.95 0.04 0.00 0.02 0.00 0.00 55.97 56.98 1fqm s LYS 172 Cb 0.00 -3.34 -0.04 0.00 -0.52 0.00 0.00 37.83 33.93 1fqm s LYS 172 CO 0.00 0.36 -0.09 -1.54 -0.92 0.00 0.00 175.35 173.16 1fqm s SER 173 N -0.27 1.57 0.06 2.83 1.04 -1.26 -1.63 113.70 116.05 1fqm s SER 173 Ca 0.35 -1.00 -0.09 0.00 0.48 0.00 0.00 55.95 55.69 1fqm s SER 173 Cb -0.20 0.02 0.00 0.00 0.10 0.00 0.00 66.02 65.95 1fqm s SER 173 CO 0.21 -0.37 0.20 0.00 0.98 0.00 0.00 173.24 174.26 1fqm s ALA 174 N -3.39 -0.32 0.35 5.32 0.00 0.49 -4.90 121.76 119.31 1fqm s ALA 174 Ca 0.15 -0.43 -0.28 0.00 0.00 0.00 0.00 51.96 51.39 1fqm s ALA 174 Cb 0.03 0.39 -0.11 0.00 0.00 0.00 0.00 23.12 23.43 1fqm s ALA 174 CO -0.01 -0.44 1.38 0.34 0.00 0.00 0.00 175.76 177.03 1fqm s ASP 175 N -2.47 6.61 -0.29 0.00 -1.08 -1.26 -0.57 116.67 117.60 1fqm s ASP 175 Ca -0.00 2.83 0.20 0.00 -0.52 0.00 0.00 52.55 55.05 1fqm s ASP 175 Cb 0.02 -2.66 0.48 0.00 -1.46 0.00 0.00 42.92 39.30 1fqm s ASP 175 CO -0.07 -0.67 1.16 0.33 0.52 0.00 0.00 175.17 176.43 1fqm n PHE 176 N 0.68 0.51 -1.51 -5.34 7.35 -0.20 -4.65 117.46 114.30 1fqm n PHE 176 Ca 0.00 -2.21 -0.31 0.00 -0.76 0.00 0.00 57.45 54.18 1fqm n PHE 176 Cb 0.41 0.12 0.07 0.00 0.35 0.00 0.00 39.48 40.42 1fqm n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1fqm s THR 177 N -2.83 3.60 -1.29 -2.13 -4.23 -1.22 -3.70 115.64 103.84 1fqm s THR 177 Ca 0.24 0.52 -0.01 0.00 -1.18 0.00 0.00 61.69 61.26 1fqm s THR 177 Cb 0.38 -3.22 0.00 0.00 1.34 0.00 0.00 72.50 71.00 1fqm s THR 177 CO -0.04 -0.68 0.19 0.59 -0.54 0.00 0.00 174.62 174.15 1fqm n ASN 178 N -3.30 -4.88 -4.59 3.99 3.02 -1.26 -4.97 115.26 103.27 1fqm n ASN 178 Ca 0.08 -0.10 -0.37 0.00 -0.03 0.00 0.00 54.58 54.15 1fqm n ASN 178 Cb 0.54 -3.89 -0.11 0.00 -0.61 0.00 0.00 39.78 35.71 1fqm n ASN 178 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1fqm s PHE 179 N -2.89 3.22 -0.53 3.10 5.36 -1.26 -5.06 117.98 119.93 1fqm s PHE 179 Ca 0.10 0.06 -0.19 0.00 -0.96 0.00 0.00 56.93 55.93 1fqm s PHE 179 Cb -0.04 -2.32 0.07 0.00 -0.34 0.00 0.00 43.02 40.39 1fqm s PHE 179 CO 0.12 -0.12 0.67 0.34 -1.46 0.00 0.00 175.22 174.77 1fqm s ASP 180 N 1.49 6.22 0.00 6.13 2.15 -1.26 -4.46 116.67 126.94 1fqm s ASP 180 Ca 0.07 -0.98 0.04 0.00 0.43 0.00 0.00 52.55 52.11 1fqm s ASP 180 Cb -0.15 -2.30 0.21 0.00 -0.30 0.00 0.00 42.92 40.38 1fqm s ASP 180 CO 0.08 -0.97 1.04 -0.81 -0.17 0.00 0.00 175.17 174.33 1fqm n PRO 181 N 6.32 0.04 0.25 4.34 -0.04 -1.26 -2.17 135.00 142.48 1fqm n PRO 181 Ca -0.07 0.31 0.13 0.00 -0.04 0.00 0.00 63.50 63.83 1fqm n PRO 181 Cb 0.45 -1.50 0.62 0.00 -0.04 0.00 0.00 33.50 33.03 1fqm n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fqm h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.91 -2.69 114.38 113.40 1fqm h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1fqm h ARG 182 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1fqm h ARG 182 CO 0.00 0.15 0.00 0.41 -1.07 0.00 0.00 179.97 179.46 1fqm n GLY 183 N -0.22 -0.89 0.64 0.04 0.00 -0.92 -2.81 105.19 101.03 1fqm n GLY 183 Ca -0.01 -0.09 0.07 0.00 0.00 0.00 0.00 46.02 45.99 1fqm n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fqm n LEU 184 N -0.75 2.50 -4.87 0.99 4.77 -1.02 -3.34 117.00 115.27 1fqm n LEU 184 Ca 0.11 -1.33 -0.37 0.00 -0.03 0.00 0.00 56.01 54.38 1fqm n LEU 184 Cb 0.05 -0.10 -0.06 0.00 -2.33 0.00 0.00 43.42 40.98 1fqm n LEU 184 CO 0.08 0.53 -0.17 -0.76 -1.33 0.00 0.00 177.39 175.74 1fqm s LEU 185 N -1.11 4.38 0.90 2.23 1.43 -1.12 -4.93 118.68 120.45 1fqm s LEU 185 Ca 0.21 0.46 -0.13 0.00 -1.03 0.00 0.00 54.13 53.64 1fqm s LEU 185 Cb 0.13 -2.07 0.13 0.00 0.03 0.00 0.00 46.19 44.41 1fqm s LEU 185 CO 0.18 0.41 1.17 -2.16 0.23 0.00 0.00 176.35 176.18 1fqm s PRO 186 N -1.00 1.25 0.12 1.29 0.04 -1.26 -4.97 135.00 130.47 1fqm s PRO 186 Ca 0.15 0.14 -0.19 0.00 0.04 0.00 0.00 61.00 61.13 1fqm s PRO 186 Cb -0.12 -1.87 -0.06 0.00 0.04 0.00 0.00 34.50 32.49 1fqm s PRO 186 CO 0.04 -2.09 1.78 0.93 0.04 0.00 0.00 177.00 177.69 1fqm h GLU 187 N -1.42 0.27 -6.26 4.56 5.08 -1.92 -3.43 114.58 111.47 1fqm h GLU 187 Ca -0.48 -0.02 -0.57 0.00 -1.00 0.00 0.00 59.36 57.29 1fqm h GLU 187 Cb 1.32 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.47 1fqm h GLU 187 CO 0.59 0.18 -0.09 0.45 -1.00 0.00 0.00 179.01 179.15 1fqm s SER 188 N -5.38 6.89 -0.20 1.42 0.15 -1.26 -4.99 113.70 110.33 1fqm s SER 188 Ca -0.13 1.11 0.15 0.00 0.70 0.00 0.00 55.95 57.79 1fqm s SER 188 Cb 0.09 -2.30 0.68 0.00 -1.71 0.00 0.00 66.02 62.77 1fqm s SER 188 CO 0.69 0.18 1.59 0.18 1.20 0.00 0.00 173.24 177.08 1fqm n LEU 189 N 1.18 4.80 -4.77 3.45 4.77 -1.26 -4.73 117.00 120.45 1fqm n LEU 189 Ca -0.08 -2.91 -0.41 0.00 -0.03 0.00 0.00 56.01 52.58 1fqm n LEU 189 Cb 0.52 -0.61 -0.02 0.00 -2.33 0.00 0.00 43.42 40.98 1fqm n LEU 189 CO 0.42 0.67 1.03 -1.81 -1.33 0.00 0.00 177.39 176.36 1fqm s ASP 190 N -1.30 6.64 0.20 -1.43 1.01 -1.26 -4.90 116.67 115.63 1fqm s ASP 190 Ca 0.48 2.79 -0.10 0.00 0.71 0.00 0.00 52.55 56.43 1fqm s ASP 190 Cb 0.37 -2.65 -0.01 0.00 1.01 0.00 0.00 42.92 41.64 1fqm s ASP 190 CO 0.13 -0.64 0.36 -0.72 0.21 0.00 0.00 175.17 174.51 1fqm s TYR 191 N -1.03 0.41 0.01 4.23 -0.85 -1.26 -1.23 117.35 117.63 1fqm s TYR 191 Ca 0.51 -0.75 0.06 0.00 -0.52 0.00 0.00 57.07 56.37 1fqm s TYR 191 Cb -0.42 0.02 -0.03 0.00 0.38 0.00 0.00 41.96 41.91 1fqm s TYR 191 CO 0.55 -0.82 -0.17 -1.58 -1.52 0.00 0.00 175.55 172.00 1fqm s TRP 192 N -3.99 2.59 0.01 -3.49 0.51 -0.17 -1.07 118.94 113.32 1fqm s TRP 192 Ca 0.20 -0.24 -0.02 0.00 -2.12 0.00 0.00 56.10 53.93 1fqm s TRP 192 Cb 0.02 -1.51 -0.01 0.00 -0.81 0.00 0.00 33.47 31.16 1fqm s TRP 192 CO 0.04 0.22 0.02 -0.08 -0.51 0.00 0.00 176.95 176.64 1fqm s THR 193 N -0.86 0.07 0.00 2.01 -1.32 -0.04 -0.90 115.64 114.60 1fqm s THR 193 Ca 0.14 -0.60 -0.28 0.00 -1.21 0.00 0.00 61.69 59.74 1fqm s THR 193 Cb -0.11 -0.23 0.10 0.00 -1.51 0.00 0.00 72.50 70.76 1fqm s THR 193 CO 0.04 -0.33 0.87 -0.72 -2.21 0.00 0.00 174.62 172.27 1fqm s TYR 194 N -1.00 -0.36 -0.20 9.09 1.13 -1.11 -1.06 117.35 123.84 1fqm s TYR 194 Ca -0.11 0.25 -0.27 0.00 -1.41 0.00 0.00 57.07 55.53 1fqm s TYR 194 Cb -0.07 0.54 -0.00 0.00 -1.10 0.00 0.00 41.96 41.32 1fqm s TYR 194 CO -0.00 -0.56 0.92 -1.25 -2.51 0.00 0.00 175.55 172.14 1fqm s PRO 195 N -3.07 4.27 0.00 -3.49 0.04 -1.26 -1.78 135.00 129.71 1fqm s PRO 195 Ca 0.04 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.23 1fqm s PRO 195 Cb -0.01 -3.61 0.00 0.00 0.04 0.00 0.00 34.50 30.92 1fqm s PRO 195 CO -0.09 -0.47 0.00 0.41 0.04 0.00 0.00 177.00 176.89 1fqm n GLY 196 N 3.45 5.47 3.43 0.56 0.00 0.69 -4.81 105.19 113.99 1fqm n GLY 196 Ca 0.08 -1.14 -0.23 0.00 0.00 0.00 0.00 46.02 44.72 1fqm n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fqm s SER 197 N 1.00 2.35 0.59 1.61 1.04 -1.05 -2.46 113.70 116.78 1fqm s SER 197 Ca 0.00 -1.70 -0.16 0.00 0.48 0.00 0.00 55.95 54.57 1fqm s SER 197 Cb 0.00 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.62 1fqm s SER 197 CO 0.00 -0.98 1.06 -0.76 0.98 0.00 0.00 173.24 173.54 1fqm s LEU 198 N -3.52 3.51 0.00 2.42 1.43 -0.70 -4.50 118.68 117.31 1fqm s LEU 198 Ca 0.30 1.83 0.23 0.00 -1.03 0.00 0.00 54.13 55.46 1fqm s LEU 198 Cb 0.02 -4.54 0.46 0.00 0.03 0.00 0.00 46.19 42.17 1fqm s LEU 198 CO 0.19 -1.17 1.42 0.35 0.23 0.00 0.00 176.35 177.37 1fqm n THR 199 N -2.00 0.59 -4.18 5.49 -2.24 -1.26 -4.45 114.28 106.22 1fqm n THR 199 Ca 0.09 -0.79 -0.18 0.00 -2.27 0.00 0.00 64.05 60.90 1fqm n THR 199 Cb 0.53 0.91 -0.12 0.00 -2.10 0.00 0.00 70.33 69.55 1fqm n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1fqm s THR 200 N -1.41 0.98 0.37 4.28 -4.23 -1.26 -4.74 115.64 109.64 1fqm s THR 200 Ca 0.40 -1.17 -0.24 0.00 -1.18 0.00 0.00 61.69 59.50 1fqm s THR 200 Cb 0.23 -0.95 -0.13 0.00 1.34 0.00 0.00 72.50 73.00 1fqm s THR 200 CO 0.32 -0.20 0.73 -2.65 -0.54 0.00 0.00 174.62 172.28 1fqm n PRO 201 N 1.48 0.83 0.00 3.99 -0.02 -1.26 0.28 135.00 140.29 1fqm n PRO 201 Ca -0.21 0.30 0.04 0.00 -2.02 0.00 0.00 63.50 61.61 1fqm n PRO 201 Cb 0.54 -1.63 0.27 0.00 -0.02 0.00 0.00 33.50 32.66 1fqm n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1fqm n PRO 202 N 0.56 0.73 -3.21 0.52 -0.04 -1.26 -4.99 135.00 127.31 1fqm n PRO 202 Ca 0.11 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.34 1fqm n PRO 202 Cb 0.37 -1.19 0.02 0.00 -0.04 0.00 0.00 33.50 32.65 1fqm n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1fqm n LEU 203 N -0.69 -2.13 -4.74 1.53 4.77 0.14 -4.88 117.00 111.00 1fqm n LEU 203 Ca 0.07 -0.35 -0.42 0.00 -0.03 0.00 0.00 56.01 55.29 1fqm n LEU 203 Cb 0.03 -2.55 -0.02 0.00 -2.33 0.00 0.00 43.42 38.55 1fqm n LEU 203 CO 0.05 0.21 1.13 -0.76 -1.33 0.00 0.00 177.39 176.68 1fqm s LEU 204 N -6.60 4.38 -1.28 2.23 1.43 -1.26 -4.33 118.68 113.25 1fqm s LEU 204 Ca 0.36 2.64 -0.14 0.00 -1.03 0.00 0.00 54.13 55.95 1fqm s LEU 204 Cb -0.18 -3.62 0.12 0.00 0.03 0.00 0.00 46.19 42.55 1fqm s LEU 204 CO 0.44 -0.72 1.68 -0.62 0.23 0.00 0.00 176.35 177.36 1fqm n GLU 205 N 2.74 3.30 0.00 1.70 1.02 -1.26 -1.73 120.64 126.41 1fqm n GLU 205 Ca 0.08 -3.49 0.00 0.00 -0.02 0.00 0.00 57.16 53.74 1fqm n GLU 205 Cb 0.40 -3.20 0.00 0.00 -0.02 0.00 0.00 31.44 28.62 1fqm n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1fqm s VAL 207 N -0.12 3.64 -0.47 0.00 0.11 -1.03 -0.99 120.40 121.55 1fqm s VAL 207 Ca 0.00 -0.51 -0.16 0.00 -2.93 0.00 0.00 61.98 58.37 1fqm s VAL 207 Cb 0.00 -2.48 0.06 0.00 -1.53 0.00 0.00 36.38 32.43 1fqm s VAL 207 CO 0.00 0.59 0.45 -0.89 -3.33 0.00 0.00 175.10 171.92 1fqm s THR 208 N -0.81 5.14 0.10 5.04 2.01 -0.49 -0.22 115.64 126.41 1fqm s THR 208 Ca 0.12 -0.83 -0.26 0.00 0.31 0.00 0.00 61.69 61.04 1fqm s THR 208 Cb -0.11 -4.15 -0.07 0.00 0.01 0.00 0.00 72.50 68.19 1fqm s THR 208 CO 0.01 -0.60 0.81 0.26 -0.69 0.00 0.00 174.62 174.41 1fqm s TRP 209 N 1.93 3.82 -0.29 4.92 0.52 -0.73 -1.96 118.94 127.14 1fqm s TRP 209 Ca 0.08 1.60 -0.01 0.00 0.02 0.00 0.00 56.10 57.78 1fqm s TRP 209 Cb -0.22 -2.85 0.09 0.00 -1.15 0.00 0.00 33.47 29.35 1fqm s TRP 209 CO 0.09 0.35 0.09 0.42 0.02 0.00 0.00 176.95 177.92 1fqm s ILE 210 N -0.46 0.81 -0.32 2.03 1.01 -0.52 -2.74 121.20 121.01 1fqm s ILE 210 Ca 0.39 -1.26 -0.11 0.00 0.00 0.00 0.00 60.65 59.68 1fqm s ILE 210 Cb -0.22 -1.56 -0.01 0.00 0.01 0.00 0.00 42.46 40.67 1fqm s ILE 210 CO 0.26 -0.60 0.19 -0.69 0.00 0.00 0.00 174.94 174.10 1fqm s VAL 211 N 1.66 4.92 0.21 2.92 1.01 -0.07 -0.60 120.40 130.44 1fqm s VAL 211 Ca 0.08 -0.29 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 1fqm s VAL 211 Cb -0.17 -3.50 -0.09 0.00 0.00 0.00 0.00 36.38 32.62 1fqm s VAL 211 CO -0.23 0.05 1.23 -0.76 0.00 0.00 0.00 175.10 175.40 1fqm s LEU 212 N 1.67 4.45 0.15 3.92 1.43 -0.15 -1.00 118.68 129.15 1fqm s LEU 212 Ca 0.05 2.32 -0.11 0.00 -1.03 0.00 0.00 54.13 55.36 1fqm s LEU 212 Cb -0.17 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.44 1fqm s LEU 212 CO 0.08 -0.41 1.56 0.50 0.23 0.00 0.00 176.35 178.31 1fqm h LYS 213 N 5.02 0.94 -5.64 1.70 3.64 -1.51 -3.42 116.57 117.31 1fqm h LYS 213 Ca -0.45 -0.37 -0.61 0.00 -1.27 0.00 0.00 60.65 57.94 1fqm h LYS 213 Cb 1.21 -0.05 -0.12 0.00 -0.41 0.00 0.00 32.23 32.87 1fqm h LYS 213 CO 0.74 1.04 0.27 -2.00 -2.27 0.00 0.00 179.45 177.23 1fqm s GLU 214 N -4.77 3.88 0.68 1.90 2.12 -1.26 -4.99 118.70 116.25 1fqm s GLU 214 Ca -0.12 0.38 -0.11 0.00 0.36 0.00 0.00 54.97 55.48 1fqm s GLU 214 Cb 0.12 -3.75 0.00 0.00 0.26 0.00 0.00 34.13 30.76 1fqm s GLU 214 CO 0.85 -0.67 1.06 -1.25 -0.54 0.00 0.00 175.26 174.71 1fqm s PRO 215 N 2.82 3.01 0.20 4.30 0.04 -1.26 -4.67 135.00 139.45 1fqm s PRO 215 Ca 0.29 0.97 -0.01 0.00 0.04 0.00 0.00 61.00 62.29 1fqm s PRO 215 Cb -0.14 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 1fqm s PRO 215 CO 0.13 -1.04 0.39 0.96 0.04 0.00 0.00 177.00 177.48 1fqm s ILE 216 N -2.99 5.21 0.17 0.56 -4.36 0.08 -4.87 121.20 114.99 1fqm s ILE 216 Ca 0.58 -0.38 -0.03 0.00 -0.26 0.00 0.00 60.65 60.57 1fqm s ILE 216 Cb -0.14 -3.74 -0.05 0.00 1.25 0.00 0.00 42.46 39.79 1fqm s ILE 216 CO 0.53 -0.17 0.37 -0.44 0.24 0.00 0.00 174.94 175.47 1fqm s SER 217 N -3.18 6.43 0.01 4.36 0.01 -1.26 -1.20 113.70 118.87 1fqm s SER 217 Ca 0.38 0.48 0.01 0.00 1.31 0.00 0.00 55.95 58.13 1fqm s SER 217 Cb -0.11 -2.04 -0.01 0.00 0.21 0.00 0.00 66.02 64.07 1fqm s SER 217 CO 0.29 0.01 -0.03 0.68 0.41 0.00 0.00 173.24 174.60 1fqm s VAL 218 N -1.75 0.22 0.72 3.43 -7.23 -0.17 -3.83 120.40 111.79 1fqm s VAL 218 Ca 0.39 -0.46 -0.11 0.00 -1.81 0.00 0.00 61.98 60.00 1fqm s VAL 218 Cb -0.12 -0.26 0.03 0.00 0.56 0.00 0.00 36.38 36.59 1fqm s VAL 218 CO 0.27 -0.16 1.07 -0.94 -0.31 0.00 0.00 175.10 175.04 1fqm s SER 219 N -0.65 5.08 0.35 4.85 1.04 -1.22 0.00 113.70 123.15 1fqm s SER 219 Ca -0.05 1.65 0.03 0.00 0.48 0.00 0.00 55.95 58.06 1fqm s SER 219 Cb -0.05 -2.47 0.65 0.00 0.10 0.00 0.00 66.02 64.25 1fqm s SER 219 CO -0.00 -1.64 1.99 0.28 0.98 0.00 0.00 173.24 174.85 1fqm h SER 220 N -0.86 0.73 -0.41 7.02 0.02 -1.95 -1.45 113.55 116.64 1fqm h SER 220 Ca -0.44 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.46 1fqm h SER 220 Cb 1.22 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 1fqm h SER 220 CO 0.55 0.51 0.10 -0.33 -1.14 0.00 0.00 176.83 176.52 1fqm h GLU 221 N 0.85 0.65 -0.09 3.45 3.07 -1.96 -1.81 114.58 118.74 1fqm h GLU 221 Ca 0.26 -0.16 -0.00 0.00 -0.50 0.00 0.00 59.36 58.96 1fqm h GLU 221 Cb 0.01 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 27.83 1fqm h GLU 221 CO -0.07 0.67 0.05 1.96 -1.40 0.00 0.00 179.01 180.22 1fqm h GLN 222 N 0.52 0.13 -0.48 2.33 4.20 -1.75 -2.42 115.11 117.63 1fqm h GLN 222 Ca 0.13 -0.02 0.09 0.00 0.06 0.00 0.00 58.65 58.91 1fqm h GLN 222 Cb 0.31 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 27.99 1fqm h GLN 222 CO 0.00 0.19 0.02 0.28 -0.67 0.00 0.00 178.83 178.66 1fqm h VAL 223 N 0.03 0.65 -0.99 -0.54 2.07 -1.13 -0.12 116.25 116.22 1fqm h VAL 223 Ca 0.03 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.53 1fqm h VAL 223 Cb 0.10 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.31 1fqm h VAL 223 CO -0.00 0.03 0.65 -0.07 0.02 0.00 0.00 177.57 178.19 1fqm h LEU 224 N 0.14 1.09 -0.70 2.57 3.38 -1.28 -1.78 115.31 118.74 1fqm h LEU 224 Ca 0.24 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 58.09 1fqm h LEU 224 Cb 0.36 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1fqm h LEU 224 CO -0.38 0.76 -0.16 0.11 0.09 0.00 0.00 178.44 178.86 1fqm h LYS 225 N 1.27 0.84 0.00 1.13 1.57 -0.60 -2.47 116.57 118.31 1fqm h LYS 225 Ca 0.38 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1fqm h LYS 225 Cb -0.05 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1fqm h LYS 225 CO -0.11 0.94 0.00 0.74 -0.57 0.00 0.00 179.45 180.45 1fqm h PHE 226 N 0.74 0.00 -0.29 -1.35 0.05 -0.24 -1.43 116.94 114.41 1fqm h PHE 226 Ca 0.11 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.90 1fqm h PHE 226 Cb 0.68 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.63 1fqm h PHE 226 CO 0.04 0.00 0.00 0.54 -0.18 0.00 0.00 178.31 178.71 1fqm n ARG 227 N -2.74 2.10 0.00 1.51 1.74 -0.90 -4.18 116.66 114.19 1fqm n ARG 227 Ca 0.00 -1.67 0.13 0.00 -0.77 0.00 0.00 57.85 55.53 1fqm n ARG 227 Cb 0.20 -1.44 0.26 0.00 -1.02 0.00 0.00 32.46 30.46 1fqm n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1fqm n LYS 228 N 0.89 1.30 -1.26 5.56 5.02 -0.54 -4.49 118.16 124.64 1fqm n LYS 228 Ca 0.17 -0.92 -0.29 0.00 -2.02 0.00 0.00 58.31 55.25 1fqm n LYS 228 Cb 0.46 -1.48 0.15 0.00 -0.02 0.00 0.00 35.03 34.13 1fqm n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1fqm s LEU 229 N -2.33 2.05 0.08 -0.35 1.43 -1.26 -4.87 118.68 113.43 1fqm s LEU 229 Ca 0.26 1.32 0.08 0.00 -1.03 0.00 0.00 54.13 54.76 1fqm s LEU 229 Cb 0.19 -3.67 -0.03 0.00 0.03 0.00 0.00 46.19 42.71 1fqm s LEU 229 CO 0.47 -2.73 -0.22 0.20 0.23 0.00 0.00 176.35 174.30 1fqm s ASN 230 N -3.54 2.63 0.06 2.29 0.02 0.87 -0.37 114.94 116.90 1fqm s ASN 230 Ca 0.64 -0.62 -0.10 0.00 -1.02 0.00 0.00 52.86 51.76 1fqm s ASN 230 Cb -0.17 -0.18 -0.32 0.00 0.02 0.00 0.00 41.25 40.60 1fqm s ASN 230 CO 0.57 0.12 1.08 -0.26 0.02 0.00 0.00 177.10 178.63 1fqm h PHE 231 N 4.42 0.74 -4.23 2.20 0.04 -0.90 -3.36 116.94 115.85 1fqm h PHE 231 Ca -0.45 -0.54 -0.50 0.00 2.80 0.00 0.00 57.97 59.28 1fqm h PHE 231 Cb 1.17 -0.03 0.13 0.00 2.20 0.00 0.00 35.95 39.42 1fqm h PHE 231 CO 0.56 1.42 0.30 0.54 -0.60 0.00 0.00 178.31 180.53 1fqm s ASN 232 N -7.36 4.19 0.55 2.17 4.22 -1.25 -4.33 114.94 113.12 1fqm s ASN 232 Ca -0.06 1.68 -0.05 0.00 -2.14 0.00 0.00 52.86 52.28 1fqm s ASN 232 Cb 0.06 -2.38 0.00 0.00 1.28 0.00 0.00 41.25 40.21 1fqm s ASN 232 CO 0.92 -2.21 0.84 -0.83 -2.04 0.00 0.00 177.10 173.77 1fqm s GLY 233 N -3.45 1.59 0.30 0.45 0.00 -1.26 -0.67 107.32 104.28 1fqm s GLY 233 Ca 0.62 -0.74 -0.29 0.00 0.00 0.00 0.00 44.72 44.30 1fqm s GLY 233 CO 0.56 -0.50 1.50 1.85 0.00 0.00 0.00 173.10 176.51 1fqm s GLU 234 N -4.87 4.19 0.00 2.90 2.12 -1.26 -2.14 118.70 119.63 1fqm s GLU 234 Ca 0.52 2.45 0.00 0.00 0.36 0.00 0.00 54.97 58.30 1fqm s GLU 234 Cb -0.10 -3.05 0.00 0.00 0.26 0.00 0.00 34.13 31.24 1fqm s GLU 234 CO 0.44 -0.50 0.00 0.41 -0.54 0.00 0.00 175.26 175.06 1fqm n GLY 235 N 1.73 1.62 3.98 -1.50 0.00 -1.26 -5.05 105.19 104.71 1fqm n GLY 235 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 1fqm n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fqm s GLU 236 N -0.50 2.80 0.29 1.61 2.02 -0.91 -5.02 118.70 118.99 1fqm s GLU 236 Ca 0.00 -0.87 -0.30 0.00 0.02 0.00 0.00 54.97 53.82 1fqm s GLU 236 Cb 0.00 -2.62 -0.12 0.00 0.10 0.00 0.00 34.13 31.50 1fqm s GLU 236 CO 0.00 -0.40 1.59 -2.30 0.02 0.00 0.00 175.26 174.17 1fqm n PRO 237 N -2.07 2.68 -2.01 0.39 -0.02 -1.26 -4.89 135.00 127.83 1fqm n PRO 237 Ca 0.05 0.95 -0.42 0.00 -2.02 0.00 0.00 63.50 62.07 1fqm n PRO 237 Cb 0.59 -2.73 -0.03 0.00 -0.02 0.00 0.00 33.50 31.31 1fqm n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1fqm s GLU 238 N -0.53 4.21 -0.31 -0.52 2.12 -1.26 -4.74 118.70 117.68 1fqm s GLU 238 Ca 0.64 2.22 0.00 0.00 0.36 0.00 0.00 54.97 58.19 1fqm s GLU 238 Cb -0.50 -3.66 0.10 0.00 0.26 0.00 0.00 34.13 30.33 1fqm s GLU 238 CO 0.49 -0.72 0.08 -1.21 -0.54 0.00 0.00 175.26 173.36 1fqm s GLU 239 N 2.82 0.95 0.25 4.30 2.02 -1.26 -5.04 118.70 122.75 1fqm s GLU 239 Ca 0.71 -1.25 -0.31 0.00 0.02 0.00 0.00 54.97 54.14 1fqm s GLU 239 Cb -0.37 -2.32 -0.13 0.00 0.10 0.00 0.00 34.13 31.41 1fqm s GLU 239 CO 0.30 -0.95 1.44 1.28 0.02 0.00 0.00 175.26 177.36 1fqm n LEU 240 N 4.70 3.38 -4.57 1.80 4.77 -1.26 -0.29 117.00 125.52 1fqm n LEU 240 Ca -0.01 1.14 -0.40 0.00 -0.03 0.00 0.00 56.01 56.72 1fqm n LEU 240 Cb 0.42 -1.46 -0.02 0.00 -2.33 0.00 0.00 43.42 40.03 1fqm n LEU 240 CO 0.14 -0.36 1.66 -0.32 -1.33 0.00 0.00 177.39 177.18 1fqm s MET 241 N -0.47 3.58 0.04 3.23 -2.45 0.50 -4.59 119.30 119.14 1fqm s MET 241 Ca 0.67 -1.39 0.01 0.00 -1.25 0.00 0.00 55.69 53.73 1fqm s MET 241 Cb -0.61 -5.40 -0.02 0.00 1.25 0.00 0.00 34.83 30.04 1fqm s MET 241 CO 0.50 -2.44 -0.05 0.14 1.05 0.00 0.00 175.02 174.21 1fqm s VAL 242 N 5.51 0.36 -1.19 10.11 -7.23 -1.26 -4.71 120.40 121.99 1fqm s VAL 242 Ca 0.52 -1.13 -0.08 0.00 -1.81 0.00 0.00 61.98 59.49 1fqm s VAL 242 Cb 0.01 -0.62 0.01 0.00 0.56 0.00 0.00 36.38 36.34 1fqm s VAL 242 CO -0.01 -0.51 1.04 0.47 -0.31 0.00 0.00 175.10 175.78 1fqm n ASP 243 N 1.31 -5.74 -3.06 4.85 8.00 0.18 -4.85 116.55 117.25 1fqm n ASP 243 Ca -0.22 -0.48 -0.34 0.00 0.71 0.00 0.00 54.79 54.46 1fqm n ASP 243 Cb 0.56 -4.49 -0.03 0.00 -0.02 0.00 0.00 41.12 37.14 1fqm n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1fqm n ASN 244 N -2.48 7.38 -4.16 -2.24 6.94 -1.13 -4.88 115.26 114.68 1fqm n ASN 244 Ca -0.00 -3.15 -0.20 0.00 -0.02 0.00 0.00 54.58 51.21 1fqm n ASN 244 Cb 0.56 -1.31 -0.13 0.00 -2.36 0.00 0.00 39.78 36.53 1fqm n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 1fqm s TRP 245 N -1.30 1.29 -0.05 -2.53 1.48 -1.26 -4.61 118.94 111.97 1fqm s TRP 245 Ca 0.56 -0.37 -0.14 0.00 -1.06 0.00 0.00 56.10 55.10 1fqm s TRP 245 Cb 0.27 -0.76 -0.05 0.00 -1.16 0.00 0.00 33.47 31.76 1fqm s TRP 245 CO -0.14 0.05 0.36 0.50 -4.06 0.00 0.00 176.95 173.65 1fqm s ARG 246 N -1.22 3.92 0.91 3.25 3.52 -1.26 -4.96 118.95 123.12 1fqm s ARG 246 Ca 0.02 0.29 -0.12 0.00 -0.13 0.00 0.00 55.73 55.79 1fqm s ARG 246 Cb -0.08 -3.26 0.14 0.00 -1.56 0.00 0.00 34.95 30.18 1fqm s ARG 246 CO 0.01 0.60 1.09 -1.25 -0.81 0.00 0.00 175.30 174.95 1fqm s PRO 247 N -0.73 1.16 0.41 5.12 0.04 -1.26 -4.63 135.00 135.10 1fqm s PRO 247 Ca 0.22 0.72 -0.27 0.00 0.04 0.00 0.00 61.00 61.71 1fqm s PRO 247 Cb -0.15 -1.81 -0.10 0.00 0.04 0.00 0.00 34.50 32.48 1fqm s PRO 247 CO 0.10 -2.28 1.40 0.00 0.04 0.00 0.00 177.00 176.26 1fqm n ALA 248 N -3.90 1.90 -2.74 8.56 0.00 -1.26 -4.24 120.51 118.82 1fqm n ALA 248 Ca 0.07 0.30 -0.23 0.00 0.00 0.00 0.00 53.44 53.57 1fqm n ALA 248 Cb 0.56 -2.36 -0.06 0.00 0.00 0.00 0.00 19.45 17.59 1fqm n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1fqm s GLN 249 N -2.21 2.65 0.21 0.00 -1.52 0.17 -4.91 119.66 114.04 1fqm s GLN 249 Ca 0.58 -1.19 -0.32 0.00 -1.95 0.00 0.00 55.36 52.47 1fqm s GLN 249 Cb -0.49 -2.40 -0.12 0.00 -0.22 0.00 0.00 33.01 29.78 1fqm s GLN 249 CO 0.60 0.39 1.66 -2.30 -0.25 0.00 0.00 175.29 175.40 1fqm n PRO 250 N -0.97 2.60 0.13 2.91 -0.02 -1.26 -4.61 135.00 133.78 1fqm n PRO 250 Ca -0.07 0.94 0.12 0.00 -2.02 0.00 0.00 63.50 62.46 1fqm n PRO 250 Cb 0.58 -2.75 0.48 0.00 -0.02 0.00 0.00 33.50 31.79 1fqm n PRO 250 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1fqm n LEU 251 N 3.49 0.67 0.00 2.45 7.94 -1.26 -4.66 117.00 125.63 1fqm n LEU 251 Ca 0.15 0.65 0.00 0.00 -1.11 0.00 0.00 56.01 55.70 1fqm n LEU 251 Cb 0.34 -0.55 0.00 0.00 0.53 0.00 0.00 43.42 43.73 1fqm n LEU 251 CO 0.64 -0.52 0.00 0.29 -1.11 0.00 0.00 177.39 176.69 1fqm n LYS 252 N -2.23 0.00 -0.92 1.96 4.76 -1.26 -1.95 118.16 118.52 1fqm n LYS 252 Ca 0.02 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.51 1fqm n LYS 252 Cb 0.25 0.00 0.39 0.00 -1.84 0.00 0.00 35.03 33.82 1fqm n LYS 252 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1fqm n ASN 253 N 2.27 5.58 -4.78 4.39 4.13 -1.26 -4.99 115.26 120.60 1fqm n ASN 253 Ca 0.00 -2.99 -0.33 0.00 1.68 0.00 0.00 54.58 52.94 1fqm n ASN 253 Cb 0.00 -0.70 0.03 0.00 -1.54 0.00 0.00 39.78 37.58 1fqm n ASN 253 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1fqm s ARG 254 N -2.82 2.99 -0.11 3.52 0.52 -0.82 -5.05 118.95 117.17 1fqm s ARG 254 Ca 0.55 1.35 0.02 0.00 -0.52 0.00 0.00 55.73 57.13 1fqm s ARG 254 Cb 0.42 -1.98 -0.01 0.00 0.52 0.00 0.00 34.95 33.91 1fqm s ARG 254 CO 0.15 -1.10 -0.18 -1.14 0.02 0.00 0.00 175.30 173.06 1fqm s GLN 255 N -4.03 3.21 -0.17 3.54 0.74 -1.26 -5.05 119.66 116.63 1fqm s GLN 255 Ca 0.66 -0.77 -0.11 0.00 0.05 0.00 0.00 55.36 55.19 1fqm s GLN 255 Cb -0.19 -2.48 -0.05 0.00 1.10 0.00 0.00 33.01 31.39 1fqm s GLN 255 CO 0.39 0.21 0.20 0.42 -0.55 0.00 0.00 175.29 175.97 1fqm s ILE 256 N 0.31 5.37 0.19 -2.34 1.01 -1.26 -4.65 121.20 119.83 1fqm s ILE 256 Ca -0.14 0.35 0.06 0.00 0.00 0.00 0.00 60.65 60.92 1fqm s ILE 256 Cb -0.17 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 1fqm s ILE 256 CO 0.07 0.44 0.13 -0.54 0.00 0.00 0.00 174.94 175.04 1fqm s LYS 257 N 0.27 2.83 0.14 2.79 1.02 -0.22 -1.49 119.74 125.07 1fqm s LYS 257 Ca 0.12 -0.97 0.09 0.00 0.02 0.00 0.00 55.97 55.24 1fqm s LYS 257 Cb -0.12 -2.57 -0.04 0.00 -0.52 0.00 0.00 37.83 34.58 1fqm s LYS 257 CO 0.01 0.45 -0.22 0.00 -0.92 0.00 0.00 175.35 174.67 1fqm s ALA 258 N -1.87 2.09 -2.70 5.17 0.00 0.66 -0.86 121.76 124.25 1fqm s ALA 258 Ca 0.31 -1.41 0.25 0.00 0.00 0.00 0.00 51.96 51.11 1fqm s ALA 258 Cb -0.09 -0.28 0.47 0.00 0.00 0.00 0.00 23.12 23.22 1fqm s ALA 258 CO 0.23 0.39 1.41 -1.13 0.00 0.00 0.00 175.76 176.66 1fqm n SER 259 N 0.75 2.35 -4.24 0.00 3.41 -0.24 -1.22 113.62 114.44 1fqm n SER 259 Ca -0.17 -1.75 -0.14 0.00 -0.26 0.00 0.00 58.87 56.56 1fqm n SER 259 Cb 0.55 0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 64.44 1fqm n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1fqm s PHE 260 N -2.07 1.20 -2.56 7.33 -0.71 -1.26 -4.88 117.98 115.03 1fqm s PHE 260 Ca 0.30 -0.80 0.28 0.00 -1.04 0.00 0.00 56.93 55.67 1fqm s PHE 260 Cb 0.20 -0.63 0.95 0.00 -1.21 0.00 0.00 43.02 42.33 1fqm s PHE 260 CO 0.35 0.03 1.69 1.17 -1.34 0.00 0.00 175.22 177.11