#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fex s ARG 3 N 0.00 2.08 -0.10 -2.82 0.52 -1.26 -1.35 118.95 116.01 2fex s ARG 3 Ca 0.00 -0.60 0.04 0.00 -0.52 0.00 0.00 55.73 54.65 2fex s ARG 3 Cb 0.00 -1.69 0.00 0.00 0.52 0.00 0.00 34.95 33.78 2fex s ARG 3 CO 0.00 0.14 -0.23 0.42 0.02 0.00 0.00 175.30 175.65 2fex s ILE 4 N 0.36 2.03 -0.10 1.52 1.01 -0.28 0.08 121.20 125.82 2fex s ILE 4 Ca -0.12 -1.00 -0.15 0.00 0.00 0.00 0.00 60.65 59.38 2fex s ILE 4 Cb -0.15 -1.76 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 2fex s ILE 4 CO 0.05 0.55 0.39 0.00 0.00 0.00 0.00 174.94 175.92 2fex s ALA 5 N 0.38 3.58 -0.23 9.38 0.00 -0.12 -0.92 121.76 133.84 2fex s ALA 5 Ca -0.18 -0.30 -0.02 0.00 0.00 0.00 0.00 51.96 51.45 2fex s ALA 5 Cb -0.18 -2.47 0.01 0.00 0.00 0.00 0.00 23.12 20.48 2fex s ALA 5 CO 0.08 0.17 -0.07 0.42 0.00 0.00 0.00 175.76 176.36 2fex s ILE 6 N 0.10 2.97 -0.82 0.00 1.01 0.87 -0.41 121.20 124.91 2fex s ILE 6 Ca 0.22 -0.77 -0.18 0.00 0.00 0.00 0.00 60.65 59.91 2fex s ILE 6 Cb -0.15 -2.40 0.14 0.00 0.01 0.00 0.00 42.46 40.07 2fex s ILE 6 CO 0.09 0.35 0.95 0.00 0.00 0.00 0.00 174.94 176.33 2fex s ALA 7 N 1.39 3.53 0.91 9.38 0.00 -0.15 -1.18 121.76 135.63 2fex s ALA 7 Ca 0.04 -2.73 -0.13 0.00 0.00 0.00 0.00 51.96 49.14 2fex s ALA 7 Cb -0.15 -3.81 0.14 0.00 0.00 0.00 0.00 23.12 19.29 2fex s ALA 7 CO -0.05 -2.69 1.16 -0.51 0.00 0.00 0.00 175.76 173.67 2fex s LEU 8 N 2.20 2.11 0.23 0.00 1.43 0.11 -4.08 118.68 120.67 2fex s LEU 8 Ca 0.24 0.84 -0.22 0.00 -1.03 0.00 0.00 54.13 53.97 2fex s LEU 8 Cb -0.11 -3.15 0.04 0.00 0.03 0.00 0.00 46.19 43.01 2fex s LEU 8 CO -0.05 -2.51 0.67 0.00 0.23 0.00 0.00 176.35 174.68 2fex s ALA 9 N -3.38 -1.37 0.30 4.21 0.00 -1.26 -4.19 121.76 116.06 2fex s ALA 9 Ca 0.65 0.02 -0.29 0.00 0.00 0.00 0.00 51.96 52.33 2fex s ALA 9 Cb -0.13 0.87 -0.13 0.00 0.00 0.00 0.00 23.12 23.73 2fex s ALA 9 CO 0.52 -0.93 1.27 0.94 0.00 0.00 0.00 175.76 177.57 2fex n GLN 10 N -0.43 1.94 -2.87 0.00 -0.06 -1.26 -1.65 117.38 113.05 2fex n GLN 10 Ca -0.09 0.68 -0.21 0.00 -2.00 0.00 0.00 57.00 55.38 2fex n GLN 10 Cb 0.62 -2.25 0.03 0.00 -4.06 0.00 0.00 30.24 24.57 2fex n GLN 10 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 2fex n ASP 11 N 1.31 -5.85 -4.76 1.69 8.00 0.41 -4.07 116.55 113.27 2fex n ASP 11 Ca 0.08 -0.23 -0.36 0.00 0.71 0.00 0.00 54.79 54.99 2fex n ASP 11 Cb 0.34 -4.71 0.02 0.00 -0.02 0.00 0.00 41.12 36.74 2fex n ASP 11 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2fex s PHE 12 N -3.12 2.58 -0.53 1.24 -0.12 -0.66 -1.32 117.98 116.05 2fex s PHE 12 Ca 0.24 1.51 -0.28 0.00 -0.05 0.00 0.00 56.93 58.34 2fex s PHE 12 Cb -0.10 -3.46 0.01 0.00 -0.63 0.00 0.00 43.02 38.84 2fex s PHE 12 CO 0.29 -1.98 1.40 0.00 -0.05 0.00 0.00 175.22 174.89 2fex s ALA 13 N -1.57 2.87 0.33 1.99 0.00 -0.06 -4.53 121.76 120.79 2fex s ALA 13 Ca 0.71 -0.56 0.06 0.00 0.00 0.00 0.00 51.96 52.17 2fex s ALA 13 Cb -0.30 -4.06 0.72 0.00 0.00 0.00 0.00 23.12 19.48 2fex s ALA 13 CO 0.35 -2.80 1.86 -0.44 0.00 0.00 0.00 175.76 174.73 2fex h ASP 14 N 10.92 0.76 0.78 0.00 5.19 -1.91 -1.20 116.42 130.95 2fex h ASP 14 Ca -0.27 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 2fex h ASP 14 Cb 1.09 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.50 2fex h ASP 14 CO 1.16 0.39 0.00 -2.67 -3.12 0.00 0.00 179.24 175.00 2fex n TRP 15 N -4.58 0.00 0.05 4.55 2.14 -1.26 -3.89 117.44 114.45 2fex n TRP 15 Ca 0.18 0.00 -0.21 0.00 2.07 0.00 0.00 57.50 59.54 2fex n TRP 15 Cb 0.42 -0.43 -0.15 0.00 -0.81 0.00 0.00 31.31 30.35 2fex n TRP 15 CO 0.00 0.00 0.00 0.93 2.07 0.00 0.00 177.69 180.69 2fex h GLU 16 N 0.00 0.32 -0.03 -2.67 5.08 -1.58 -3.35 114.58 112.35 2fex h GLU 16 Ca 0.00 -0.54 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 2fex h GLU 16 Cb 0.39 0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2fex h GLU 16 CO 0.00 1.26 0.00 -0.35 -1.00 0.00 0.00 179.01 178.92 2fex n PRO 17 N -4.00 2.21 0.12 2.33 -0.04 -1.26 -4.71 135.00 129.66 2fex n PRO 17 Ca -0.18 -1.76 -0.13 0.00 -0.04 0.00 0.00 63.50 61.39 2fex n PRO 17 Cb 0.89 -1.46 -0.08 0.00 -0.04 0.00 0.00 33.50 32.80 2fex n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fex h ALA 18 N 4.64 -0.31 -0.42 0.55 0.00 -1.69 -1.12 119.26 120.91 2fex h ALA 18 Ca 0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 2fex h ALA 18 Cb 0.91 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2fex h ALA 18 CO 0.00 -0.54 -0.11 1.25 0.00 0.00 0.00 179.25 179.85 2fex h LEU 19 N -0.58 0.83 -0.06 0.00 5.85 -1.84 -0.85 115.31 118.67 2fex h LEU 19 Ca -0.03 -0.37 0.03 0.00 0.84 0.00 0.00 57.88 58.35 2fex h LEU 19 Cb 0.42 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2fex h LEU 19 CO 0.05 1.00 -0.17 0.25 -0.34 0.00 0.00 178.44 179.23 2fex h LEU 20 N 0.64 -0.52 -0.32 2.25 6.46 -1.85 -0.78 115.31 121.19 2fex h LEU 20 Ca 0.10 0.08 -0.05 0.00 -0.12 0.00 0.00 57.88 57.90 2fex h LEU 20 Cb 0.65 0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.79 2fex h LEU 20 CO 0.04 -0.23 0.01 0.00 -0.62 0.00 0.00 178.44 177.65 2fex h ALA 21 N 0.72 0.42 -0.29 1.25 0.00 -1.11 -1.09 119.26 119.16 2fex h ALA 21 Ca 0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2fex h ALA 21 Cb 0.35 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2fex h ALA 21 CO -0.20 0.16 0.06 0.00 0.00 0.00 0.00 179.25 179.27 2fex h ALA 22 N 0.86 0.38 -0.10 0.00 0.00 -1.09 -0.50 119.26 118.82 2fex h ALA 22 Ca 0.09 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2fex h ALA 22 Cb 0.42 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2fex h ALA 22 CO 0.01 0.06 -0.07 0.00 0.00 0.00 0.00 179.25 179.26 2fex h ALA 23 N 0.89 0.14 -0.03 0.00 0.00 -1.12 -1.01 119.26 118.12 2fex h ALA 23 Ca 0.09 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.76 2fex h ALA 23 Cb 0.32 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2fex h ALA 23 CO 0.00 -0.06 -0.23 0.00 0.00 0.00 0.00 179.25 178.97 2fex h ALA 24 N 0.61 -0.27 -0.05 0.00 0.00 -1.17 -0.12 119.26 118.25 2fex h ALA 24 Ca 0.02 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2fex h ALA 24 Cb 0.55 0.41 0.01 0.00 0.00 0.00 0.00 17.79 18.75 2fex h ALA 24 CO 0.02 -0.71 -0.38 -0.09 0.00 0.00 0.00 179.25 178.08 2fex h ARG 25 N -0.34 0.35 0.00 0.00 2.43 -1.13 -1.41 114.38 114.28 2fex h ARG 25 Ca 0.07 -0.31 -0.11 0.00 -0.81 0.00 0.00 59.98 58.82 2fex h ARG 25 Cb 0.44 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 2fex h ARG 25 CO -0.23 0.96 -1.08 0.77 -1.51 0.00 0.00 179.97 178.88 2fex h SER 26 N -0.17 0.00 0.00 -3.80 0.02 -1.23 -3.35 113.55 105.03 2fex h SER 26 Ca -0.03 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.77 2fex h SER 26 Cb 1.06 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.57 2fex h SER 26 CO 0.08 0.42 -1.57 -1.22 -1.14 0.00 0.00 176.83 173.40 2fex n TYR 27 N -2.93 0.00 0.08 3.45 4.01 -0.11 -4.79 117.16 116.88 2fex n TYR 27 Ca -0.05 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.73 2fex n TYR 27 Cb 0.75 -0.40 0.07 0.00 -0.31 0.00 0.00 39.34 39.44 2fex n TYR 27 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2fex n LEU 28 N -2.29 2.15 -0.85 7.72 4.77 -0.79 -4.99 117.00 122.72 2fex n LEU 28 Ca -0.13 -1.53 -0.10 0.00 -0.03 0.00 0.00 56.01 54.22 2fex n LEU 28 Cb 0.75 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.72 2fex n LEU 28 CO 0.18 0.50 -0.10 0.61 -1.33 0.00 0.00 177.39 177.25 2fex n GLY 29 N 0.29 0.85 3.78 -0.72 0.00 -0.88 -4.96 105.19 103.56 2fex n GLY 29 Ca 0.06 -0.56 -0.39 0.00 0.00 0.00 0.00 46.02 45.13 2fex n GLY 29 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fex s VAL 30 N -2.40 4.56 -0.05 1.61 1.01 -0.60 -4.66 120.40 119.87 2fex s VAL 30 Ca 0.00 1.50 -0.24 0.00 0.00 0.00 0.00 61.98 63.24 2fex s VAL 30 Cb 0.00 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 2fex s VAL 30 CO 0.00 0.51 0.74 -0.70 0.00 0.00 0.00 175.10 175.65 2fex s GLU 31 N -0.98 4.46 -0.18 2.72 2.12 -0.46 -4.03 118.70 122.35 2fex s GLU 31 Ca 0.33 0.96 -0.05 0.00 0.36 0.00 0.00 54.97 56.57 2fex s GLU 31 Cb -0.21 -3.45 -0.03 0.00 0.26 0.00 0.00 34.13 30.70 2fex s GLU 31 CO 0.23 0.06 -0.01 0.42 -0.54 0.00 0.00 175.26 175.42 2fex s ILE 32 N 0.79 4.07 -0.28 -3.70 -1.09 -1.26 -1.13 121.20 118.61 2fex s ILE 32 Ca 0.39 -0.28 -0.05 0.00 -2.23 0.00 0.00 60.65 58.48 2fex s ILE 32 Cb -0.18 -2.82 0.01 0.00 -1.58 0.00 0.00 42.46 37.89 2fex s ILE 32 CO 0.20 0.46 0.04 -0.69 -1.23 0.00 0.00 174.94 173.71 2fex s VAL 33 N 0.60 3.64 -0.06 2.92 1.01 -0.09 -4.98 120.40 123.43 2fex s VAL 33 Ca -0.01 -0.78 -0.13 0.00 0.00 0.00 0.00 61.98 61.06 2fex s VAL 33 Cb -0.14 -2.86 -0.05 0.00 0.00 0.00 0.00 36.38 33.33 2fex s VAL 33 CO 0.02 0.13 0.34 -1.00 0.00 0.00 0.00 175.10 174.59 2fex s HIS 34 N 1.45 3.64 0.10 5.22 3.76 -1.26 -0.09 115.29 128.10 2fex s HIS 34 Ca 0.02 0.82 0.05 0.00 -0.15 0.00 0.00 55.06 55.79 2fex s HIS 34 Cb -0.17 -2.25 -0.04 0.00 1.11 0.00 0.00 32.58 31.24 2fex s HIS 34 CO 0.00 0.56 -0.12 0.00 -0.85 0.00 0.00 174.74 174.33 2fex s ALA 35 N -0.66 1.27 0.24 -1.40 0.00 -0.33 -0.46 121.76 120.41 2fex s ALA 35 Ca 0.21 -1.19 0.07 0.00 0.00 0.00 0.00 51.96 51.04 2fex s ALA 35 Cb -0.15 -0.03 -0.05 0.00 0.00 0.00 0.00 23.12 22.88 2fex s ALA 35 CO 0.09 0.05 -0.09 0.95 0.00 0.00 0.00 175.76 176.77 2fex s THR 36 N -2.10 1.62 0.31 0.00 -4.23 -1.00 0.04 115.64 110.28 2fex s THR 36 Ca 0.05 -2.16 0.05 0.00 -1.18 0.00 0.00 61.69 58.46 2fex s THR 36 Cb -0.05 -2.24 0.30 0.00 1.34 0.00 0.00 72.50 71.85 2fex s THR 36 CO 0.02 -0.45 1.84 -0.65 -0.54 0.00 0.00 174.62 174.84 2fex h PRO 37 N 2.44 0.82 -0.21 3.99 0.11 -1.91 -1.21 132.00 136.04 2fex h PRO 37 Ca -0.39 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2fex h PRO 37 Cb 1.23 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2fex h PRO 37 CO 0.64 0.54 0.00 -0.40 -0.21 0.00 0.00 178.00 178.58 2fex n ASP 38 N -4.62 2.51 -1.28 -2.05 5.75 -1.26 -3.62 116.55 111.99 2fex n ASP 38 Ca 0.19 -1.92 -0.01 0.00 -0.01 0.00 0.00 54.79 53.04 2fex n ASP 38 Cb 0.43 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.39 2fex n ASP 38 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2fex n GLY 39 N 0.20 0.57 3.89 6.12 0.00 -0.87 -4.83 105.19 110.27 2fex n GLY 39 Ca 0.07 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 2fex n GLY 39 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2fex s PRO 41 N -3.67 3.71 0.21 1.61 0.02 -1.26 -4.67 135.00 130.94 2fex s PRO 41 Ca 0.01 0.20 0.02 0.00 0.02 0.00 0.00 61.00 61.25 2fex s PRO 41 Cb -0.00 -2.55 -0.05 0.00 0.02 0.00 0.00 34.50 31.92 2fex s PRO 41 CO 0.03 0.13 0.01 0.14 -0.33 0.00 0.00 177.00 176.99 2fex s VAL 42 N -2.16 0.79 -0.16 3.83 -7.23 -0.75 -4.97 120.40 109.75 2fex s VAL 42 Ca 0.47 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.65 2fex s VAL 42 Cb -0.11 -2.28 0.01 0.00 0.56 0.00 0.00 36.38 34.57 2fex s VAL 42 CO 0.29 -0.35 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.64 2fex s THR 43 N -3.58 2.13 0.00 5.32 2.01 -1.26 -0.83 115.64 119.43 2fex s THR 43 Ca 0.28 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 61.33 2fex s THR 43 Cb 0.06 -1.87 0.00 0.00 0.01 0.00 0.00 72.50 70.70 2fex s THR 43 CO 0.07 0.54 0.00 -1.54 -0.69 0.00 0.00 174.62 173.00 2fex n SER 44 N 4.28 0.00 0.00 3.53 3.41 0.27 -0.45 113.62 124.67 2fex n SER 44 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 2fex n SER 44 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2fex n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fex n GLY 46 N 1.70 0.00 1.44 5.00 0.00 -1.26 -4.22 105.19 107.85 2fex n GLY 46 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2fex n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fex n GLY 47 N 0.00 0.69 3.71 -0.02 0.00 -1.26 -5.05 105.19 103.26 2fex n GLY 47 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2fex n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fex s LEU 48 N 0.00 4.35 -0.37 0.99 1.43 -1.26 -4.98 118.68 118.85 2fex s LEU 48 Ca 0.00 2.10 -0.19 0.00 -1.03 0.00 0.00 54.13 55.02 2fex s LEU 48 Cb 0.00 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.65 2fex s LEU 48 CO 0.00 -0.58 0.53 -0.75 0.23 0.00 0.00 176.35 175.78 2fex s LYS 49 N 1.44 3.55 -0.10 1.70 2.20 -1.26 -0.56 119.74 126.70 2fex s LYS 49 Ca 0.61 -0.21 0.03 0.00 -0.36 0.00 0.00 55.97 56.04 2fex s LYS 49 Cb -0.31 -3.84 -0.01 0.00 -1.51 0.00 0.00 37.83 32.16 2fex s LYS 49 CO 0.28 -0.71 -0.19 0.08 -0.36 0.00 0.00 175.35 174.45 2fex s VAL 50 N 2.45 2.54 -0.25 4.02 1.01 -0.01 -4.98 120.40 125.17 2fex s VAL 50 Ca 0.19 -0.86 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 2fex s VAL 50 Cb -0.15 -2.00 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 2fex s VAL 50 CO 0.14 0.55 0.16 -0.89 0.00 0.00 0.00 175.10 175.06 2fex s THR 51 N 0.14 5.24 0.85 3.92 2.01 -1.26 -1.81 115.64 124.72 2fex s THR 51 Ca -0.10 0.14 -0.12 0.00 0.31 0.00 0.00 61.69 61.92 2fex s THR 51 Cb -0.16 -3.46 0.13 0.00 0.01 0.00 0.00 72.50 69.02 2fex s THR 51 CO 0.06 0.31 1.20 -2.16 -0.69 0.00 0.00 174.62 173.34 2fex s PRO 52 N 1.34 1.46 0.13 4.92 0.04 -1.26 -4.99 135.00 136.63 2fex s PRO 52 Ca 0.07 -0.24 0.02 0.00 0.04 0.00 0.00 61.00 60.89 2fex s PRO 52 Cb -0.15 -1.97 -0.14 0.00 0.04 0.00 0.00 34.50 32.28 2fex s PRO 52 CO 0.07 -1.85 1.28 -0.44 0.04 0.00 0.00 177.00 176.10 2fex h ASP 53 N -1.18 0.23 -5.03 6.66 3.32 -1.13 -3.49 116.42 115.80 2fex h ASP 53 Ca -0.44 -0.22 0.03 0.00 0.02 0.00 0.00 57.03 56.42 2fex h ASP 53 Cb 1.29 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 2fex h ASP 53 CO 0.52 1.10 0.28 0.28 -1.72 0.00 0.00 179.24 179.70 2fex s THR 54 N -2.91 0.00 0.40 0.35 -1.32 -1.07 -5.04 115.64 106.05 2fex s THR 54 Ca -0.02 -0.97 0.03 0.00 -1.21 0.00 0.00 61.69 59.52 2fex s THR 54 Cb 0.09 -2.53 -0.00 0.00 -1.51 0.00 0.00 72.50 68.55 2fex s THR 54 CO 0.84 0.00 0.58 -0.94 -2.21 0.00 0.00 174.62 172.90 2fex s SER 55 N -3.02 5.87 0.22 8.08 1.04 -1.26 -2.38 113.70 122.24 2fex s SER 55 Ca 0.14 0.06 -0.09 0.00 0.48 0.00 0.00 55.95 56.54 2fex s SER 55 Cb -0.05 -1.37 0.19 0.00 0.10 0.00 0.00 66.02 64.89 2fex s SER 55 CO 0.09 -0.60 1.88 1.88 0.98 0.00 0.00 173.24 177.47 2fex h TYR 56 N 0.61 0.96 0.00 5.02 -1.99 -1.30 -2.52 116.97 117.74 2fex h TYR 56 Ca -0.46 0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.26 2fex h TYR 56 Cb 1.26 -0.32 -0.00 0.00 2.00 0.00 0.00 36.73 39.66 2fex h TYR 56 CO 0.44 0.58 -0.15 -0.44 -0.00 0.00 0.00 178.16 178.58 2fex h ASP 57 N 1.02 0.00 1.09 3.88 3.32 -1.87 -2.52 116.42 121.33 2fex h ASP 57 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2fex h ASP 57 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 2fex h ASP 57 CO -0.09 0.15 -0.46 0.00 -1.72 0.00 0.00 179.24 177.13 2fex h ALA 58 N 1.85 0.70 -2.36 3.45 0.00 -1.85 -3.46 119.26 117.59 2fex h ALA 58 Ca -0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 2fex h ALA 58 Cb 0.34 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.18 2fex h ALA 58 CO 0.02 0.00 0.89 1.28 0.00 0.00 0.00 179.25 181.44 2fex n LEU 59 N -2.23 3.39 -4.05 0.00 4.77 -0.95 -4.98 117.00 112.94 2fex n LEU 59 Ca 0.04 1.06 -0.32 0.00 -0.03 0.00 0.00 56.01 56.76 2fex n LEU 59 Cb 0.45 -1.47 -0.16 0.00 -2.33 0.00 0.00 43.42 39.92 2fex n LEU 59 CO 0.35 -0.13 -0.48 -0.62 -1.33 0.00 0.00 177.39 175.17 2fex s ASP 60 N 1.30 3.52 0.00 -1.43 -1.08 -1.26 -4.99 116.67 112.73 2fex s ASP 60 Ca 0.79 -0.91 0.09 0.00 -0.52 0.00 0.00 52.55 52.00 2fex s ASP 60 Cb -0.63 -1.39 0.40 0.00 -1.46 0.00 0.00 42.92 39.85 2fex s ASP 60 CO 0.37 -0.10 1.29 -0.81 0.52 0.00 0.00 175.17 176.43 2fex n PRO 61 N 4.61 0.01 -0.34 4.34 -0.04 -1.26 -3.30 135.00 139.02 2fex n PRO 61 Ca -0.17 0.33 0.16 0.00 -0.04 0.00 0.00 63.50 63.78 2fex n PRO 61 Cb 0.47 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.81 2fex n PRO 61 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 2fex h VAL 62 N 0.00 0.61 0.00 0.52 3.04 -1.96 -2.89 116.25 115.56 2fex h VAL 62 Ca 0.00 -0.21 -0.11 0.00 -1.01 0.00 0.00 66.70 65.37 2fex h VAL 62 Cb 0.15 -0.07 -0.24 0.00 -2.01 0.00 0.00 31.29 29.12 2fex h VAL 62 CO 0.00 0.11 -0.83 -0.90 -1.01 0.00 0.00 177.57 174.95 2fex n ASP 63 N -4.79 1.27 -4.18 3.17 5.68 -1.21 -5.00 116.55 111.49 2fex n ASP 63 Ca 0.25 -2.73 -0.33 0.00 -0.50 0.00 0.00 54.79 51.48 2fex n ASP 63 Cb 0.69 -0.39 -0.16 0.00 -1.14 0.00 0.00 41.12 40.12 2fex n ASP 63 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 2fex s ILE 64 N -1.25 2.25 -0.40 2.12 1.01 -1.09 -4.61 121.20 119.23 2fex s ILE 64 Ca 0.35 -0.90 0.22 0.00 0.00 0.00 0.00 60.65 60.32 2fex s ILE 64 Cb 0.38 -1.93 0.29 0.00 0.01 0.00 0.00 42.46 41.21 2fex s ILE 64 CO -0.13 0.53 1.56 0.44 0.00 0.00 0.00 174.94 177.34 2fex h ASP 65 N 7.56 0.00 -4.85 3.58 3.32 -0.64 -3.44 116.42 121.95 2fex h ASP 65 Ca -0.37 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.59 2fex h ASP 65 Cb 1.17 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.52 2fex h ASP 65 CO 0.59 0.05 -0.04 0.00 -1.72 0.00 0.00 179.24 178.12 2fex s ALA 66 N -3.19 -1.30 -0.21 3.45 0.00 -1.19 -3.03 121.76 116.28 2fex s ALA 66 Ca 0.06 0.93 -0.03 0.00 0.00 0.00 0.00 51.96 52.93 2fex s ALA 66 Cb 0.06 -0.09 -0.00 0.00 0.00 0.00 0.00 23.12 23.09 2fex s ALA 66 CO 0.68 -0.31 -0.07 -1.17 0.00 0.00 0.00 175.76 174.89 2fex s LEU 67 N -1.05 2.75 -0.14 0.00 2.96 -0.12 -0.94 118.68 122.14 2fex s LEU 67 Ca -0.11 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.36 2fex s LEU 67 Cb -0.03 -1.69 0.00 0.00 0.50 0.00 0.00 46.19 44.98 2fex s LEU 67 CO 0.06 -0.02 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.19 2fex s VAL 68 N 1.44 2.35 -0.28 1.68 1.01 0.45 -0.57 120.40 126.47 2fex s VAL 68 Ca 0.05 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.18 2fex s VAL 68 Cb -0.14 -1.96 0.07 0.00 0.00 0.00 0.00 36.38 34.35 2fex s VAL 68 CO -0.05 0.54 -0.06 -0.63 0.00 0.00 0.00 175.10 174.89 2fex s ILE 69 N 0.75 2.16 0.69 2.22 1.01 0.74 -0.98 121.20 127.79 2fex s ILE 69 Ca -0.08 -1.81 -0.11 0.00 0.00 0.00 0.00 60.65 58.66 2fex s ILE 69 Cb -0.16 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 39.95 2fex s ILE 69 CO 0.00 -0.19 1.06 -2.16 0.00 0.00 0.00 174.94 173.65 2fex s PRO 70 N 1.06 2.99 0.00 2.79 0.04 -1.26 -2.25 135.00 138.38 2fex s PRO 70 Ca -0.04 0.90 0.00 0.00 0.04 0.00 0.00 61.00 61.91 2fex s PRO 70 Cb -0.20 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.34 2fex s PRO 70 CO -0.06 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.34 2fex n GLY 71 N -2.12 -0.77 0.00 0.56 0.00 -0.96 -4.55 105.19 97.35 2fex n GLY 71 Ca 0.07 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.46 2fex n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fex n GLY 72 N 5.00 0.78 0.35 -0.02 0.00 -1.26 -0.88 105.19 109.17 2fex n GLY 72 Ca 0.00 -1.87 0.12 0.00 0.00 0.00 0.00 46.02 44.27 2fex n GLY 72 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fex n LEU 73 N 0.00 1.43 -0.23 0.99 4.77 -0.43 -4.38 117.00 119.14 2fex n LEU 73 Ca 0.00 -0.46 -0.03 0.00 -0.03 0.00 0.00 56.01 55.49 2fex n LEU 73 Cb 0.00 -0.07 0.08 0.00 -2.33 0.00 0.00 43.42 41.10 2fex n LEU 73 CO 0.00 0.27 1.12 0.77 -1.33 0.00 0.00 177.39 178.21 2fex h SER 74 N 1.73 0.65 0.10 -1.43 4.64 -1.80 -1.11 113.55 116.33 2fex h SER 74 Ca 0.00 0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 2fex h SER 74 Cb 0.60 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.53 2fex h SER 74 CO 0.00 0.44 -0.21 -0.50 -0.87 0.00 0.00 176.83 175.69 2fex h TRP 75 N 0.78 -0.57 0.00 4.77 6.55 -1.90 -1.69 115.95 123.90 2fex h TRP 75 Ca 0.28 0.01 -0.00 0.00 0.95 0.00 0.00 58.89 60.13 2fex h TRP 75 Cb 0.06 0.24 -0.00 0.00 -0.86 0.00 0.00 29.16 28.60 2fex h TRP 75 CO -0.05 -0.31 -0.00 1.05 -1.05 0.00 0.00 178.44 178.08 2fex h GLU 76 N -0.40 0.00 -0.01 0.49 4.11 -1.78 -1.77 114.58 115.23 2fex h GLU 76 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 2fex h GLU 76 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2fex h GLU 76 CO -0.13 0.00 -0.12 1.63 0.07 0.00 0.00 179.01 180.46 2fex n LYS 77 N -3.09 0.83 -1.53 1.06 5.02 -0.44 -4.94 118.16 115.06 2fex n LYS 77 Ca -0.00 -0.34 -0.05 0.00 -2.02 0.00 0.00 58.31 55.90 2fex n LYS 77 Cb 0.26 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 33.76 2fex n LYS 77 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fex n GLY 78 N 1.27 0.51 0.24 0.72 0.00 -0.66 -4.92 105.19 102.34 2fex n GLY 78 Ca 0.15 -0.78 0.07 0.00 0.00 0.00 0.00 46.02 45.46 2fex n GLY 78 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fex n THR 79 N -3.34 1.47 -2.13 2.61 -2.24 -0.70 -5.06 114.28 104.90 2fex n THR 79 Ca -0.05 -1.85 -0.36 0.00 -2.27 0.00 0.00 64.05 59.52 2fex n THR 79 Cb 0.32 -0.05 0.01 0.00 -2.10 0.00 0.00 70.33 68.51 2fex n THR 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fex s ALA 80 N -2.23 2.77 0.64 6.98 0.00 -1.19 -4.88 121.76 123.86 2fex s ALA 80 Ca 0.26 0.98 -0.15 0.00 0.00 0.00 0.00 51.96 53.05 2fex s ALA 80 Cb 0.23 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 2fex s ALA 80 CO 0.01 -0.91 1.08 0.00 0.00 0.00 0.00 175.76 175.94 2fex s ALA 81 N -1.58 2.60 -0.53 0.00 0.00 -1.26 -4.99 121.76 116.00 2fex s ALA 81 Ca 0.70 0.41 -0.28 0.00 0.00 0.00 0.00 51.96 52.79 2fex s ALA 81 Cb -0.29 -3.26 0.03 0.00 0.00 0.00 0.00 23.12 19.60 2fex s ALA 81 CO 0.34 -1.09 1.15 0.34 0.00 0.00 0.00 175.76 176.50 2fex s ASP 82 N -2.86 6.52 0.00 0.00 2.15 -1.26 -4.88 116.67 116.35 2fex s ASP 82 Ca 0.64 0.24 0.25 0.00 0.43 0.00 0.00 52.55 54.11 2fex s ASP 82 Cb -0.18 -2.54 0.46 0.00 -0.30 0.00 0.00 42.92 40.36 2fex s ASP 82 CO 0.42 -1.36 1.38 0.18 -0.17 0.00 0.00 175.17 175.61 2fex n LEU 83 N 8.12 1.31 0.27 -1.34 4.77 -1.26 -4.63 117.00 124.24 2fex n LEU 83 Ca 0.10 -0.41 -0.16 0.00 -0.03 0.00 0.00 56.01 55.50 2fex n LEU 83 Cb 0.49 -0.09 -0.08 0.00 -2.33 0.00 0.00 43.42 41.41 2fex n LEU 83 CO 0.71 0.25 0.66 1.23 -1.33 0.00 0.00 177.39 178.91 2fex h GLY 84 N 4.91 -0.81 0.98 -0.72 0.00 -1.95 -0.27 103.07 105.21 2fex h GLY 84 Ca 0.00 0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.66 2fex h GLY 84 CO 0.00 -0.30 0.24 -1.33 0.00 0.00 0.00 176.54 175.15 2fex h GLY 85 N -0.75 0.88 0.93 4.60 0.00 -2.00 -1.61 103.07 105.12 2fex h GLY 85 Ca -0.05 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 2fex h GLY 85 CO 0.03 0.44 0.12 -2.00 0.00 0.00 0.00 176.54 175.13 2fex h LEU 86 N 0.76 0.32 -0.41 3.11 5.85 -1.79 0.11 115.31 123.26 2fex h LEU 86 Ca 0.19 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2fex h LEU 86 Cb 0.17 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2fex h LEU 86 CO -0.02 0.35 0.25 0.58 -0.34 0.00 0.00 178.44 179.27 2fex h VAL 87 N 0.27 1.13 -0.63 1.05 2.07 -0.89 -2.35 116.25 116.89 2fex h VAL 87 Ca 0.08 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.32 2fex h VAL 87 Cb 0.12 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 2fex h VAL 87 CO -0.01 0.13 0.41 0.50 0.02 0.00 0.00 177.57 178.62 2fex h LYS 88 N 0.55 0.82 -0.40 1.57 3.64 -0.97 0.12 116.57 121.90 2fex h LYS 88 Ca 0.15 -0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.55 2fex h LYS 88 Cb -0.01 -0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 31.57 2fex h LYS 88 CO -0.03 0.54 0.03 -0.09 -2.27 0.00 0.00 179.45 177.63 2fex h ARG 89 N 0.84 0.14 -0.18 1.90 2.43 -0.50 0.24 114.38 119.25 2fex h ARG 89 Ca 0.24 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.32 2fex h ARG 89 Cb -0.08 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 2fex h ARG 89 CO -0.06 0.09 -0.21 0.74 -1.51 0.00 0.00 179.97 179.03 2fex h PHE 90 N 0.15 0.55 -0.82 2.20 -1.00 -0.98 -3.22 116.94 113.82 2fex h PHE 90 Ca 0.20 -0.17 0.04 0.00 2.81 0.00 0.00 57.97 60.84 2fex h PHE 90 Cb 0.26 -0.11 -0.05 0.00 3.61 0.00 0.00 35.95 39.67 2fex h PHE 90 CO -0.24 0.84 0.54 0.00 -1.61 0.00 0.00 178.31 177.84 2fex h ARG 91 N 0.10 0.96 0.00 1.51 2.47 -0.39 -1.53 114.38 117.50 2fex h ARG 91 Ca 0.02 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.67 2fex h ARG 91 Cb 0.76 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.86 2fex h ARG 91 CO 0.05 0.64 -0.07 -0.44 0.56 0.00 0.00 179.97 180.70 2fex h ASP 92 N 0.99 0.00 -0.62 7.04 3.32 -0.54 0.23 116.42 126.84 2fex h ASP 92 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 2fex h ASP 92 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2fex h ASP 92 CO -0.10 0.07 0.00 -1.14 -1.72 0.00 0.00 179.24 176.35 2fex n ARG 93 N -3.94 3.86 -3.50 3.56 3.00 -0.76 -4.96 116.66 113.93 2fex n ARG 93 Ca -0.02 -2.91 -0.26 0.00 -0.00 0.00 0.00 57.85 54.65 2fex n ARG 93 Cb 0.16 -1.93 0.02 0.00 0.00 0.00 0.00 32.46 30.71 2fex n ARG 93 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2fex n ASP 94 N 0.97 -4.89 -4.84 6.15 8.00 0.79 -4.96 116.55 117.77 2fex n ASP 94 Ca 0.26 -0.52 -0.34 0.00 0.71 0.00 0.00 54.79 54.90 2fex n ASP 94 Cb 0.93 -3.95 -0.06 0.00 -0.02 0.00 0.00 41.12 38.02 2fex n ASP 94 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2fex s ARG 95 N -6.18 4.02 0.17 -1.24 1.81 -0.65 -5.01 118.95 111.87 2fex s ARG 95 Ca 0.49 0.58 -0.34 0.00 -1.72 0.00 0.00 55.73 54.74 2fex s ARG 95 Cb -0.24 -2.77 -0.14 0.00 -0.45 0.00 0.00 34.95 31.35 2fex s ARG 95 CO 0.60 0.36 1.47 -0.11 -0.68 0.00 0.00 175.30 176.95 2fex n LEU 96 N 0.38 2.79 -4.18 2.53 7.94 -1.17 -4.47 117.00 120.83 2fex n LEU 96 Ca -0.02 1.11 -0.29 0.00 -1.11 0.00 0.00 56.01 55.70 2fex n LEU 96 Cb 0.52 -1.38 -0.17 0.00 0.53 0.00 0.00 43.42 42.92 2fex n LEU 96 CO 0.43 -0.51 -0.53 -0.69 -1.11 0.00 0.00 177.39 174.97 2fex s VAL 97 N 0.52 1.76 -0.02 1.96 1.01 -0.86 -0.94 120.40 123.82 2fex s VAL 97 Ca 0.76 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.89 2fex s VAL 97 Cb -0.72 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.15 2fex s VAL 97 CO 0.43 0.49 -0.05 0.00 0.00 0.00 0.00 175.10 175.98 2fex s ALA 98 N 0.21 0.56 -0.01 5.51 0.00 0.26 -1.57 121.76 126.73 2fex s ALA 98 Ca -0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 51.96 51.71 2fex s ALA 98 Cb -0.15 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.71 2fex s ALA 98 CO 0.05 0.06 0.02 0.20 0.00 0.00 0.00 175.76 176.09 2fex s GLY 99 N 0.40 0.02 0.04 0.00 0.00 -0.05 -0.19 107.32 107.54 2fex s GLY 99 Ca -0.05 0.11 0.08 0.00 0.00 0.00 0.00 44.72 44.86 2fex s GLY 99 CO -0.00 0.22 -0.23 -1.50 0.00 0.00 0.00 173.10 171.60 2fex s ILE 100 N 0.32 1.83 0.00 0.90 2.07 -0.96 -2.41 121.20 122.96 2fex s ILE 100 Ca -0.03 -1.24 0.00 0.00 -1.41 0.00 0.00 60.65 57.97 2fex s ILE 100 Cb -0.04 -1.58 0.00 0.00 0.13 0.00 0.00 42.46 40.98 2fex s ILE 100 CO -0.01 0.28 0.00 0.00 -1.91 0.00 0.00 174.94 173.30 2fex h ALA 102 N -0.61 2.37 0.00 0.00 0.00 -1.91 -0.22 119.26 118.89 2fex h ALA 102 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2fex h ALA 102 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2fex h ALA 102 CO 0.00 -0.51 -0.29 0.00 0.00 0.00 0.00 179.25 178.45 2fex h ALA 103 N 1.75 1.13 -0.76 0.00 0.00 -1.52 -1.73 119.26 118.13 2fex h ALA 103 Ca 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2fex h ALA 103 Cb 0.85 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 2fex h ALA 103 CO -0.02 0.36 0.43 0.00 0.00 0.00 0.00 179.25 180.03 2fex h ALA 104 N 1.71 0.97 -0.27 0.00 0.00 -1.02 0.21 119.26 120.85 2fex h ALA 104 Ca -0.00 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 2fex h ALA 104 Cb 0.70 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2fex h ALA 104 CO 0.04 0.47 -0.42 0.77 0.00 0.00 0.00 179.25 180.10 2fex h SER 105 N 1.05 0.72 -0.89 0.00 0.02 -1.49 -1.49 113.55 111.46 2fex h SER 105 Ca 0.27 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 2fex h SER 105 Cb 0.00 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.30 2fex h SER 105 CO -0.05 1.05 0.50 0.00 -1.14 0.00 0.00 176.83 177.19 2fex h ALA 106 N 0.98 1.21 -0.61 3.77 0.00 -1.04 -1.29 119.26 122.29 2fex h ALA 106 Ca 0.04 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.90 2fex h ALA 106 Cb 0.96 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 2fex h ALA 106 CO 0.09 0.65 0.30 -0.07 0.00 0.00 0.00 179.25 180.22 2fex h LEU 107 N 1.24 0.42 -1.20 0.00 3.38 -0.59 -1.48 115.31 117.08 2fex h LEU 107 Ca 0.32 0.04 0.21 0.00 0.09 0.00 0.00 57.88 58.54 2fex h LEU 107 Cb -0.00 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 40.62 2fex h LEU 107 CO -0.05 0.27 0.62 1.23 0.09 0.00 0.00 178.44 180.60 2fex h GLY 108 N 0.56 1.46 2.00 0.83 0.00 -0.22 -0.08 103.07 107.62 2fex h GLY 108 Ca 0.28 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2fex h GLY 108 CO -0.20 -0.06 0.00 -1.33 0.00 0.00 0.00 176.54 174.94 2fex h GLY 109 N 0.61 0.00 1.95 4.60 0.00 -0.32 -2.44 103.07 107.47 2fex h GLY 109 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.89 2fex h GLY 109 CO -0.32 0.00 -0.04 -1.30 0.00 0.00 0.00 176.54 174.89 2fex n THR 110 N -2.93 0.57 -0.00 4.70 -2.24 -0.05 -4.61 114.28 109.72 2fex n THR 110 Ca 0.01 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2fex n THR 110 Cb 0.27 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 2fex n THR 110 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fex n GLY 111 N 1.32 0.56 0.18 3.38 0.00 -0.92 -4.94 105.19 104.76 2fex n GLY 111 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.21 2fex n GLY 111 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2fex h VAL 112 N 0.00 0.00 -0.31 1.61 3.04 -1.79 -1.37 116.25 117.43 2fex h VAL 112 Ca 0.00 -0.36 0.00 0.00 -1.01 0.00 0.00 66.70 65.33 2fex h VAL 112 Cb 0.00 1.20 0.00 0.00 -2.01 0.00 0.00 31.29 30.48 2fex h VAL 112 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.57 176.74 2fex n LEU 113 N -2.53 2.35 0.19 3.16 4.77 -1.26 -4.52 117.00 119.17 2fex n LEU 113 Ca 0.02 -1.06 0.04 0.00 -0.03 0.00 0.00 56.01 54.98 2fex n LEU 113 Cb 0.28 -0.20 0.37 0.00 -2.33 0.00 0.00 43.42 41.54 2fex n LEU 113 CO 0.23 0.53 0.72 0.78 -1.33 0.00 0.00 177.39 178.32 2fex h ASN 114 N 2.92 0.00 0.00 -1.43 2.35 -1.56 -3.33 115.58 114.54 2fex h ASN 114 Ca 0.00 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.64 2fex h ASN 114 Cb 0.65 0.00 -0.24 0.00 0.05 0.00 0.00 38.32 38.78 2fex h ASN 114 CO 0.00 0.38 -0.82 0.47 -1.65 0.00 0.00 177.43 175.81 2fex n ASP 115 N -3.93 0.85 -4.15 5.81 8.00 -1.26 -4.34 116.55 117.53 2fex n ASP 115 Ca -0.02 -2.20 -0.15 0.00 0.71 0.00 0.00 54.79 53.13 2fex n ASP 115 Cb 0.43 -0.30 -0.11 0.00 -0.02 0.00 0.00 41.12 41.12 2fex n ASP 115 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2fex s VAL 116 N -0.38 0.91 0.42 2.53 -7.23 -1.25 -5.03 120.40 110.37 2fex s VAL 116 Ca 0.26 -1.41 -0.25 0.00 -1.81 0.00 0.00 61.98 58.76 2fex s VAL 116 Cb 0.28 -1.10 -0.08 0.00 0.56 0.00 0.00 36.38 36.04 2fex s VAL 116 CO -0.11 -0.41 1.31 0.00 -0.31 0.00 0.00 175.10 175.58 2fex s ALA 117 N -1.82 3.22 0.25 1.32 0.00 -1.26 -4.80 121.76 118.65 2fex s ALA 117 Ca -0.00 1.25 -0.21 0.00 0.00 0.00 0.00 51.96 52.99 2fex s ALA 117 Cb -0.07 -3.50 0.05 0.00 0.00 0.00 0.00 23.12 19.61 2fex s ALA 117 CO 0.01 -0.89 0.87 -3.38 0.00 0.00 0.00 175.76 172.37 2fex s HIS 118 N -1.28 -0.06 0.00 0.00 -3.43 -0.96 -4.37 115.29 105.20 2fex s HIS 118 Ca 0.59 -0.39 0.00 0.00 -0.80 0.00 0.00 55.06 54.45 2fex s HIS 118 Cb -0.38 0.71 0.00 0.00 -1.43 0.00 0.00 32.58 31.48 2fex s HIS 118 CO 0.49 -1.13 0.00 -2.37 -2.00 0.00 0.00 174.74 169.73 2fex n THR 119 N -0.52 0.00 -3.72 -5.38 5.66 -1.26 -0.24 114.28 108.82 2fex n THR 119 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 2fex n THR 119 Cb 0.60 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.38 2fex n THR 119 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2fex n GLY 120 N 0.00 0.48 0.21 1.09 0.00 -1.26 -4.44 105.19 101.27 2fex n GLY 120 Ca 0.00 -0.74 -0.03 0.00 0.00 0.00 0.00 46.02 45.25 2fex n GLY 120 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2fex h ASN 121 N 0.00 0.34 -4.14 1.61 2.35 -1.79 -3.34 115.58 110.61 2fex h ASN 121 Ca 0.00 -0.13 0.09 0.00 -0.55 0.00 0.00 56.30 55.71 2fex h ASN 121 Cb 0.00 -0.09 -0.22 0.00 0.05 0.00 0.00 38.32 38.05 2fex h ASN 121 CO 0.00 0.68 0.56 0.00 -1.65 0.00 0.00 177.43 177.02 2fex s ALA 122 N -4.26 -1.93 0.33 -0.83 0.00 -1.26 -5.01 121.76 108.78 2fex s ALA 122 Ca -0.05 1.56 0.00 0.00 0.00 0.00 0.00 51.96 53.47 2fex s ALA 122 Cb 0.13 -0.64 0.54 0.00 0.00 0.00 0.00 23.12 23.16 2fex s ALA 122 CO 0.78 -0.34 1.99 1.25 0.00 0.00 0.00 175.76 179.44 2fex h LEU 123 N 2.50 0.84 -1.67 0.00 5.85 -1.98 -1.48 115.31 119.37 2fex h LEU 123 Ca -0.18 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.52 2fex h LEU 123 Cb 1.17 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 2fex h LEU 123 CO 0.31 0.60 0.21 0.00 -0.34 0.00 0.00 178.44 179.21 2fex h ALA 124 N 1.54 1.76 -0.57 1.25 0.00 -1.98 -0.24 119.26 121.02 2fex h ALA 124 Ca 0.27 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2fex h ALA 124 Cb -0.10 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2fex h ALA 124 CO -0.06 0.22 0.19 0.77 0.00 0.00 0.00 179.25 180.37 2fex h SER 125 N 0.44 0.82 -0.48 0.00 0.02 -1.67 -2.23 113.55 110.45 2fex h SER 125 Ca 0.12 -0.20 -0.12 0.00 -0.84 0.00 0.00 61.79 60.75 2fex h SER 125 Cb -0.04 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 2fex h SER 125 CO -0.02 0.81 -0.16 0.45 -1.14 0.00 0.00 176.83 176.76 2fex h HIS 126 N 0.80 1.09 0.00 3.45 -0.00 -1.07 -3.13 115.15 116.29 2fex h HIS 126 Ca 0.19 -0.25 0.00 0.00 -0.00 0.00 0.00 60.37 60.31 2fex h HIS 126 Cb 0.27 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 27.42 2fex h HIS 126 CO 0.02 1.05 0.00 0.87 -0.00 0.00 0.00 177.93 179.87 2fex h LYS 127 N 0.81 0.00 0.00 2.45 1.57 -0.71 -2.12 116.57 118.57 2fex h LYS 127 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2fex h LYS 127 Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 2fex h LYS 127 CO 0.06 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.94 2fex h ALA 128 N 2.19 1.00 -2.66 3.86 0.00 -1.35 -3.41 119.26 118.89 2fex h ALA 128 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 2fex h ALA 128 Cb 0.28 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.94 2fex h ALA 128 CO 0.00 0.00 -0.13 0.71 0.00 0.00 0.00 179.25 179.83 2fex s TYR 129 N -3.92 3.26 0.50 0.00 2.02 -0.80 -4.97 117.35 113.44 2fex s TYR 129 Ca -0.03 0.52 0.18 0.00 -0.37 0.00 0.00 57.07 57.38 2fex s TYR 129 Cb 0.11 -2.64 1.23 0.00 -0.40 0.00 0.00 41.96 40.26 2fex s TYR 129 CO 0.43 -0.25 2.06 -1.35 -1.57 0.00 0.00 175.55 174.86 2fex h PRO 130 N 8.09 0.12 0.00 -1.71 0.11 -1.88 -1.51 132.00 135.22 2fex h PRO 130 Ca -0.30 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2fex h PRO 130 Cb 1.15 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2fex h PRO 130 CO 0.68 0.08 0.00 0.00 -0.21 0.00 0.00 178.00 178.55 2fex n ALA 131 N -2.56 2.27 -2.17 -0.75 0.00 -1.26 -4.74 120.51 111.30 2fex n ALA 131 Ca 0.04 -0.09 -0.43 0.00 0.00 0.00 0.00 53.44 52.97 2fex n ALA 131 Cb 0.31 -1.45 -0.02 0.00 0.00 0.00 0.00 19.45 18.29 2fex n ALA 131 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2fex s TYR 132 N -3.01 2.19 -0.15 0.00 5.04 -0.57 -4.42 117.35 116.43 2fex s TYR 132 Ca 0.13 0.61 0.17 0.00 -2.44 0.00 0.00 57.07 55.55 2fex s TYR 132 Cb 0.18 -4.00 0.33 0.00 0.35 0.00 0.00 41.96 38.81 2fex s TYR 132 CO 0.52 -2.68 1.18 0.54 -1.34 0.00 0.00 175.55 173.77 2fex n ARG 133 N 7.69 1.43 -0.43 4.97 5.12 -1.26 -4.78 116.66 129.40 2fex n ARG 133 Ca 0.18 -2.74 0.10 0.00 -1.93 0.00 0.00 57.85 53.46 2fex n ARG 133 Cb 0.46 -1.54 0.30 0.00 -1.16 0.00 0.00 32.46 30.51 2fex n ARG 133 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2fex n GLY 134 N -1.33 2.20 0.34 -0.13 0.00 -1.26 -4.69 105.19 100.32 2fex n GLY 134 Ca 0.17 -0.73 0.09 0.00 0.00 0.00 0.00 46.02 45.56 2fex n GLY 134 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fex h GLU 135 N 3.73 0.74 0.00 1.61 4.81 -1.87 0.13 114.58 123.72 2fex h GLU 135 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2fex h GLU 135 Cb 1.07 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.28 2fex h GLU 135 CO 0.09 0.49 0.00 0.00 -0.73 0.00 0.00 179.01 178.86 2fex h ALA 136 N 1.58 1.00 -0.01 2.92 0.00 -1.93 -2.30 119.26 120.51 2fex h ALA 136 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.42 2fex h ALA 136 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2fex h ALA 136 CO -0.35 0.00 -0.31 0.72 0.00 0.00 0.00 179.25 179.32 2fex n HIS 137 N -3.06 0.00 -2.42 0.00 8.25 0.44 -4.96 115.22 113.47 2fex n HIS 137 Ca -0.02 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.04 2fex n HIS 137 Cb 0.16 -0.05 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 2fex n HIS 137 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2fex s TYR 138 N -2.40 3.50 -0.24 4.41 5.04 -0.87 -2.26 117.35 124.53 2fex s TYR 138 Ca 0.23 1.66 0.02 0.00 -2.44 0.00 0.00 57.07 56.55 2fex s TYR 138 Cb 0.19 -3.34 0.05 0.00 0.35 0.00 0.00 41.96 39.21 2fex s TYR 138 CO 0.51 -0.74 -0.13 1.03 -1.34 0.00 0.00 175.55 174.88 2fex s ARG 139 N -1.51 2.40 -0.88 4.97 0.52 0.66 -4.92 118.95 120.19 2fex s ARG 139 Ca 0.45 -1.19 -0.23 0.00 -0.52 0.00 0.00 55.73 54.25 2fex s ARG 139 Cb -0.33 -2.78 0.07 0.00 0.52 0.00 0.00 34.95 32.43 2fex s ARG 139 CO 0.43 -0.48 1.26 0.34 0.02 0.00 0.00 175.30 176.87 2fex s ASP 140 N 1.17 6.41 0.07 0.23 2.15 -1.26 -4.51 116.67 120.93 2fex s ASP 140 Ca -0.05 -1.34 -0.12 0.00 0.43 0.00 0.00 52.55 51.47 2fex s ASP 140 Cb -0.18 -2.50 0.02 0.00 -0.30 0.00 0.00 42.92 39.95 2fex s ASP 140 CO -0.07 -1.45 0.28 0.00 -0.17 0.00 0.00 175.17 173.76 2fex s GLN 141 N 4.39 0.84 0.23 4.34 -2.07 -1.26 -5.08 119.66 121.06 2fex s GLN 141 Ca 0.37 -0.66 0.05 0.00 -1.82 0.00 0.00 55.36 53.30 2fex s GLN 141 Cb -0.05 0.36 0.23 0.00 -1.09 0.00 0.00 33.01 32.45 2fex s GLN 141 CO -0.02 -0.28 1.54 -1.00 -1.32 0.00 0.00 175.29 174.21 2fex h PRO 142 N 3.01 0.19 -6.77 9.60 0.13 -1.99 -3.46 132.00 132.71 2fex h PRO 142 Ca -0.33 -0.14 -0.49 0.00 -0.87 0.00 0.00 66.00 64.17 2fex h PRO 142 Cb 1.21 0.03 0.02 0.00 0.13 0.00 0.00 31.00 32.38 2fex h PRO 142 CO 0.49 0.77 0.00 1.03 -0.23 0.00 0.00 178.00 180.06 2fex s ARG 143 N -3.64 3.55 0.77 0.86 0.52 -1.26 -4.65 118.95 115.11 2fex s ARG 143 Ca -0.03 0.05 -0.15 0.00 -0.52 0.00 0.00 55.73 55.08 2fex s ARG 143 Cb 0.12 -2.48 0.02 0.00 0.52 0.00 0.00 34.95 33.12 2fex s ARG 143 CO 0.80 -0.05 0.85 0.00 0.02 0.00 0.00 175.30 176.92 2fex n ALA 144 N -1.92 -0.78 -2.35 2.13 0.00 -1.26 -4.90 120.51 111.43 2fex n ALA 144 Ca -0.01 -0.29 -0.30 0.00 0.00 0.00 0.00 53.44 52.84 2fex n ALA 144 Cb 0.55 -2.05 -0.15 0.00 0.00 0.00 0.00 19.45 17.81 2fex n ALA 144 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2fex s VAL 145 N -1.98 2.19 -0.06 0.00 1.01 -0.01 -4.97 120.40 116.57 2fex s VAL 145 Ca 0.69 -1.38 0.01 0.00 0.00 0.00 0.00 61.98 61.30 2fex s VAL 145 Cb -0.32 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.23 2fex s VAL 145 CO 0.54 0.36 -0.05 -0.55 0.00 0.00 0.00 175.10 175.40 2fex s SER 146 N -1.27 1.37 -0.28 3.32 0.15 -1.26 -1.02 113.70 114.71 2fex s SER 146 Ca 0.12 -0.17 -0.21 0.00 0.70 0.00 0.00 55.95 56.39 2fex s SER 146 Cb -0.10 -0.56 0.10 0.00 -1.71 0.00 0.00 66.02 63.75 2fex s SER 146 CO 0.02 -0.07 0.85 -0.62 1.20 0.00 0.00 173.24 174.62 2fex s ASP 147 N 1.17 -0.67 -1.84 5.45 2.15 -0.47 -4.96 116.67 117.50 2fex s ASP 147 Ca -0.07 1.18 0.00 0.00 0.43 0.00 0.00 52.55 54.09 2fex s ASP 147 Cb -0.14 1.23 0.00 0.00 -0.30 0.00 0.00 42.92 43.71 2fex s ASP 147 CO -0.01 -0.19 0.00 0.61 -0.17 0.00 0.00 175.17 175.40 2fex n GLY 148 N 3.17 0.05 2.05 2.66 0.00 -1.26 -1.25 105.19 110.61 2fex n GLY 148 Ca -0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 2fex n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fex n GLY 149 N -0.90 0.50 3.00 -0.02 0.00 -1.26 -5.04 105.19 101.48 2fex n GLY 149 Ca -0.24 -0.87 -0.26 0.00 0.00 0.00 0.00 46.02 44.66 2fex n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fex s VAL 150 N -2.04 1.16 -0.12 1.61 1.01 -0.38 -2.02 120.40 119.61 2fex s VAL 150 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.53 2fex s VAL 150 Cb 0.00 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 35.28 2fex s VAL 150 CO 0.00 0.37 -0.13 -0.69 0.00 0.00 0.00 175.10 174.65 2fex s VAL 151 N 0.99 3.09 0.07 2.92 1.01 -0.61 -1.37 120.40 126.51 2fex s VAL 151 Ca -0.08 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.28 2fex s VAL 151 Cb -0.15 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 2fex s VAL 151 CO -0.00 0.53 -0.10 0.42 0.00 0.00 0.00 175.10 175.95 2fex s THR 152 N 0.25 0.84 0.14 3.92 -4.23 -0.19 -0.88 115.64 115.50 2fex s THR 152 Ca -0.09 -1.40 -0.23 0.00 -1.18 0.00 0.00 61.69 58.79 2fex s THR 152 Cb -0.15 -1.07 0.07 0.00 1.34 0.00 0.00 72.50 72.68 2fex s THR 152 CO 0.05 -0.44 0.59 0.00 -0.54 0.00 0.00 174.62 174.28 2fex s ALA 153 N -1.90 -1.56 0.63 3.99 0.00 -1.01 -0.83 121.76 121.08 2fex s ALA 153 Ca -0.01 0.51 -0.13 0.00 0.00 0.00 0.00 51.96 52.33 2fex s ALA 153 Cb -0.06 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.84 2fex s ALA 153 CO 0.00 -0.73 1.04 0.00 0.00 0.00 0.00 175.76 176.07 2fex s ALA 154 N -3.57 2.87 0.04 0.00 0.00 -1.25 -0.65 121.76 119.20 2fex s ALA 154 Ca 0.00 0.10 0.30 0.00 0.00 0.00 0.00 51.96 52.37 2fex s ALA 154 Cb -0.01 -3.15 1.53 0.00 0.00 0.00 0.00 23.12 21.50 2fex s ALA 154 CO -0.11 -0.85 1.92 0.78 0.00 0.00 0.00 175.76 177.50 2fex h GLY 155 N -0.15 0.00 1.32 0.00 0.00 -1.88 -0.85 103.07 101.50 2fex h GLY 155 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2fex h GLY 155 CO 0.59 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.99 2fex n SER 156 N -2.59 0.00 -2.56 0.19 3.41 -1.26 -4.21 113.62 106.59 2fex n SER 156 Ca -0.01 -0.44 -0.26 0.00 -0.26 0.00 0.00 58.87 57.90 2fex n SER 156 Cb 0.11 -0.16 -0.00 0.00 -0.26 0.00 0.00 64.21 63.90 2fex n SER 156 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fex n ALA 157 N -1.16 4.89 0.18 7.33 0.00 -0.33 -4.87 120.51 126.56 2fex n ALA 157 Ca 0.17 -4.30 0.03 0.00 0.00 0.00 0.00 53.44 49.33 2fex n ALA 157 Cb 0.16 -0.59 0.35 0.00 0.00 0.00 0.00 19.45 19.37 2fex n ALA 157 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2fex h PRO 158 N 2.67 0.00 -0.01 0.00 0.13 -1.77 -1.85 132.00 131.16 2fex h PRO 158 Ca 0.25 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.36 2fex h PRO 158 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2fex h PRO 158 CO 0.82 0.39 -0.08 0.28 -0.23 0.00 0.00 178.00 179.18 2fex h VAL 159 N 0.00 1.52 -0.02 1.56 2.07 -1.94 -2.18 116.25 117.26 2fex h VAL 159 Ca -0.00 -1.66 -0.09 0.00 0.82 0.00 0.00 66.70 65.76 2fex h VAL 159 Cb 0.74 2.59 -0.01 0.00 -1.52 0.00 0.00 31.29 33.10 2fex h VAL 159 CO 0.05 0.44 -0.42 0.77 0.02 0.00 0.00 177.57 178.43 2fex h SER 160 N -0.57 0.05 -0.13 0.57 4.64 -1.96 -0.40 113.55 115.74 2fex h SER 160 Ca -0.01 -0.02 0.03 0.00 -0.47 0.00 0.00 61.79 61.32 2fex h SER 160 Cb 0.77 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.82 2fex h SER 160 CO 0.02 0.47 -0.04 0.15 -0.87 0.00 0.00 176.83 176.56 2fex h PHE 161 N 0.04 -0.08 -0.30 4.77 3.57 -1.31 0.07 116.94 123.70 2fex h PHE 161 Ca 0.00 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.54 2fex h PHE 161 Cb 0.77 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.54 2fex h PHE 161 CO 0.00 -0.06 0.13 0.00 -2.23 0.00 0.00 178.31 176.15 2fex h ALA 162 N 1.13 0.36 -0.38 2.41 0.00 -0.77 -2.00 119.26 120.01 2fex h ALA 162 Ca 0.07 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2fex h ALA 162 Cb 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2fex h ALA 162 CO -0.14 -0.26 0.24 0.28 0.00 0.00 0.00 179.25 179.38 2fex h VAL 163 N 0.29 1.09 -0.48 0.00 2.07 -0.86 -1.47 116.25 116.89 2fex h VAL 163 Ca 0.13 -0.17 -0.09 0.00 0.82 0.00 0.00 66.70 67.39 2fex h VAL 163 Cb 0.07 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2fex h VAL 163 CO -0.11 0.09 -0.08 -0.33 0.02 0.00 0.00 177.57 177.17 2fex h GLU 164 N 0.50 0.85 -0.08 1.57 4.39 -0.82 0.49 114.58 121.47 2fex h GLU 164 Ca 0.14 -0.27 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 2fex h GLU 164 Cb -0.05 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 2fex h GLU 164 CO -0.04 0.90 0.03 0.82 -1.16 0.00 0.00 179.01 179.56 2fex h ILE 165 N 0.77 1.15 -0.77 3.13 2.04 -1.10 -0.84 117.51 121.90 2fex h ILE 165 Ca 0.13 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 2fex h ILE 165 Cb 0.57 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 2fex h ILE 165 CO 0.04 0.13 0.30 -0.07 0.00 0.00 0.00 178.15 178.55 2fex h LEU 166 N -0.04 1.06 -0.20 1.44 3.38 -1.00 -1.91 115.31 118.04 2fex h LEU 166 Ca 0.03 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.84 2fex h LEU 166 Cb 0.18 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2fex h LEU 166 CO -0.00 0.94 0.10 0.11 0.09 0.00 0.00 178.44 179.68 2fex h LYS 167 N 1.12 0.21 -0.21 1.13 1.57 -0.78 -0.50 116.57 119.11 2fex h LYS 167 Ca 0.26 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.00 2fex h LYS 167 Cb 0.22 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 2fex h LYS 167 CO -0.02 0.14 0.02 1.03 -0.57 0.00 0.00 179.45 180.05 2fex h SER 168 N 0.22 0.28 -0.03 0.86 0.87 -0.77 -0.94 113.55 114.04 2fex h SER 168 Ca 0.08 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2fex h SER 168 Cb 0.01 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 2fex h SER 168 CO -0.05 0.32 0.00 0.18 -0.53 0.00 0.00 176.83 176.75 2fex n LEU 169 N -4.38 0.46 -0.94 2.23 4.77 -0.75 -4.90 117.00 113.49 2fex n LEU 169 Ca 0.00 -0.18 -0.11 0.00 -0.03 0.00 0.00 56.01 55.69 2fex n LEU 169 Cb 0.17 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2fex n LEU 169 CO 0.37 0.09 -0.11 0.61 -1.33 0.00 0.00 177.39 177.01 2fex n GLY 170 N 0.94 0.85 0.84 -0.72 0.00 -0.36 -4.92 105.19 101.82 2fex n GLY 170 Ca 0.17 -0.51 0.09 0.00 0.00 0.00 0.00 46.02 45.77 2fex n GLY 170 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fex n LEU 171 N -1.32 2.96 -3.81 0.99 4.77 -0.22 -4.81 117.00 115.56 2fex n LEU 171 Ca -0.11 -1.54 -0.42 0.00 -0.03 0.00 0.00 56.01 53.90 2fex n LEU 171 Cb 0.42 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2fex n LEU 171 CO 0.16 0.66 1.86 0.33 -1.33 0.00 0.00 177.39 179.07 2fex n PHE 172 N 1.01 2.72 -2.20 -1.77 7.35 -1.20 -4.64 117.46 118.73 2fex n PHE 172 Ca 0.14 -2.74 0.00 0.00 -0.76 0.00 0.00 57.45 54.09 2fex n PHE 172 Cb 0.48 -1.77 0.00 0.00 0.35 0.00 0.00 39.48 38.54 2fex n PHE 172 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2fex n GLY 173 N 2.22 0.82 0.31 7.13 0.00 -1.26 -4.81 105.19 109.60 2fex n GLY 173 Ca 0.41 -1.96 0.01 0.00 0.00 0.00 0.00 46.02 44.49 2fex n GLY 173 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fex h PRO 174 N 0.00 0.69 0.06 1.61 0.13 -1.99 -0.52 132.00 131.98 2fex h PRO 174 Ca 0.00 -0.07 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2fex h PRO 174 Cb 0.00 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 30.99 2fex h PRO 174 CO 0.00 0.53 -0.03 0.93 -0.23 0.00 0.00 178.00 179.20 2fex h GLU 175 N 0.70 -0.08 -0.17 0.86 3.07 -1.95 -0.55 114.58 116.47 2fex h GLU 175 Ca 0.18 0.01 0.01 0.00 -0.50 0.00 0.00 59.36 59.05 2fex h GLU 175 Cb 0.05 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.97 2fex h GLU 175 CO -0.03 0.11 0.10 0.00 -1.40 0.00 0.00 179.01 177.79 2fex h ALA 176 N 0.68 0.21 -0.74 3.43 0.00 -1.70 -1.48 119.26 119.67 2fex h ALA 176 Ca -0.01 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2fex h ALA 176 Cb 0.22 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2fex h ALA 176 CO 0.01 -0.33 0.33 1.49 0.00 0.00 0.00 179.25 180.75 2fex h GLU 177 N 0.20 1.08 -0.97 0.00 4.81 -1.07 -1.43 114.58 117.20 2fex h GLU 177 Ca 0.07 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2fex h GLU 177 Cb -0.00 -0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.14 2fex h GLU 177 CO -0.03 0.86 0.61 0.00 -0.73 0.00 0.00 179.01 179.72 2fex h ALA 178 N 1.16 1.23 -0.00 2.92 0.00 -0.70 -1.11 119.26 122.77 2fex h ALA 178 Ca 0.25 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 2fex h ALA 178 Cb 0.16 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2fex h ALA 178 CO -0.03 0.66 -0.82 0.93 0.00 0.00 0.00 179.25 179.99 2fex h GLU 179 N 1.33 0.08 0.00 0.00 4.39 -0.72 -3.34 114.58 116.33 2fex h GLU 179 Ca 0.35 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.96 2fex h GLU 179 Cb -0.10 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2fex h GLU 179 CO -0.07 0.86 -1.22 1.28 -1.16 0.00 0.00 179.01 178.70 2fex n LEU 180 N -3.62 0.56 -0.00 1.33 4.77 -0.59 -4.34 117.00 115.10 2fex n LEU 180 Ca -0.02 -0.08 0.16 0.00 -0.03 0.00 0.00 56.01 56.04 2fex n LEU 180 Cb 0.78 -0.06 0.89 0.00 -2.33 0.00 0.00 43.42 42.70 2fex n LEU 180 CO 0.46 0.06 1.08 0.00 -1.33 0.00 0.00 177.39 177.66 2fex n GLN 181 N -1.98 0.84 0.07 3.23 10.64 -0.44 -4.08 117.38 125.65 2fex n GLN 181 Ca 0.01 -0.01 0.12 0.00 -1.83 0.00 0.00 57.00 55.30 2fex n GLN 181 Cb 0.45 -1.50 0.28 0.00 -0.86 0.00 0.00 30.24 28.61 2fex n GLN 181 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.06 175.67 2fex n ILE 182 N -1.08 0.39 0.90 -0.39 -5.35 -1.26 -3.99 119.36 108.57 2fex n ILE 182 Ca 0.21 -0.24 0.14 0.00 -0.27 0.00 0.00 62.75 62.59 2fex n ILE 182 Cb 0.15 -0.27 0.56 0.00 -1.74 0.00 0.00 39.64 38.33 2fex n ILE 182 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2fex n PHE 183 N -2.08 0.25 0.08 4.28 3.72 -1.26 -3.71 117.46 118.75 2fex n PHE 183 Ca 0.04 0.07 -0.07 0.00 -0.05 0.00 0.00 57.45 57.44 2fex n PHE 183 Cb 0.42 -0.62 -0.07 0.00 -0.94 0.00 0.00 39.48 38.27 2fex n PHE 183 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fex h ALA 184 N 2.87 0.42 -0.64 4.37 0.00 -1.89 -3.36 119.26 121.02 2fex h ALA 184 Ca 0.00 -0.84 0.06 0.00 0.00 0.00 0.00 54.91 54.13 2fex h ALA 184 Cb 0.56 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2fex h ALA 184 CO 0.00 1.12 0.43 0.00 0.00 0.00 0.00 179.25 180.79 2fex h ALA 185 N 1.00 1.76 0.00 0.00 0.00 -1.85 -0.05 119.26 120.12 2fex h ALA 185 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2fex h ALA 185 Cb 1.68 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2fex h ALA 185 CO 0.13 0.14 0.00 -0.85 0.00 0.00 0.00 179.25 178.67 2fex n GLU 186 N -4.47 0.53 0.00 0.00 0.28 -1.26 -2.57 120.64 113.15 2fex n GLU 186 Ca 0.09 0.03 0.09 0.00 -0.16 0.00 0.00 57.16 57.21 2fex n GLU 186 Cb 0.22 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.60 2fex n GLU 186 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2fex n HIS 187 N -1.19 0.00 1.34 -1.84 8.25 -0.04 -5.23 115.22 116.51 2fex n HIS 187 Ca 0.15 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.72 2fex n HIS 187 Cb 0.16 0.00 0.64 0.00 1.12 0.00 0.00 29.99 31.91 2fex n HIS 187 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52