#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fxs n GLN 4 N 0.00 2.53 -3.49 1.64 -0.06 -1.07 -4.73 117.38 112.21 1fxs n GLN 4 Ca 0.00 0.91 -0.43 0.00 -2.00 0.00 0.00 57.00 55.49 1fxs n GLN 4 Cb 0.00 -2.74 -0.10 0.00 -4.06 0.00 0.00 30.24 23.35 1fxs n GLN 4 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 1fxs s ARG 5 N 1.29 2.90 -0.21 3.69 0.52 -1.26 0.04 118.95 125.93 1fxs s ARG 5 Ca 0.78 -1.15 -0.08 0.00 -0.52 0.00 0.00 55.73 54.75 1fxs s ARG 5 Cb -0.57 -3.94 -0.04 0.00 0.52 0.00 0.00 34.95 30.92 1fxs s ARG 5 CO 0.35 -0.82 0.07 0.08 0.02 0.00 0.00 175.30 175.00 1fxs s VAL 6 N 1.62 4.70 -0.31 3.52 1.01 -0.27 0.04 120.40 130.71 1fxs s VAL 6 Ca 0.04 -0.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.85 1fxs s VAL 6 Cb -0.21 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.00 1fxs s VAL 6 CO 0.08 0.41 0.19 0.12 0.00 0.00 0.00 175.10 175.90 1fxs s PHE 7 N 0.80 3.20 -0.44 5.22 5.36 -0.30 -0.86 117.98 130.96 1fxs s PHE 7 Ca 0.04 -0.24 -0.11 0.00 -0.96 0.00 0.00 56.93 55.66 1fxs s PHE 7 Cb -0.13 -2.40 0.08 0.00 -0.34 0.00 0.00 43.02 40.22 1fxs s PHE 7 CO 0.02 -0.33 0.30 0.42 -1.46 0.00 0.00 175.22 174.17 1fxs s ILE 8 N 1.70 4.50 0.13 3.12 1.01 -1.23 -1.08 121.20 129.33 1fxs s ILE 8 Ca 0.06 -1.33 -0.30 0.00 0.00 0.00 0.00 60.65 59.08 1fxs s ILE 8 Cb -0.17 -3.74 -0.06 0.00 0.01 0.00 0.00 42.46 38.50 1fxs s ILE 8 CO 0.09 -0.54 1.08 0.00 0.00 0.00 0.00 174.94 175.57 1fxs s ALA 9 N 1.48 3.33 -0.63 9.38 0.00 -0.43 -3.53 121.76 131.36 1fxs s ALA 9 Ca 0.03 0.75 -0.02 0.00 0.00 0.00 0.00 51.96 52.72 1fxs s ALA 9 Cb -0.24 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1fxs s ALA 9 CO 0.03 -0.22 0.54 0.41 0.00 0.00 0.00 175.76 176.52 1fxs n GLY 10 N 2.38 0.14 0.12 0.00 0.00 -1.26 -2.22 105.19 104.35 1fxs n GLY 10 Ca 0.04 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.96 1fxs n GLY 10 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1fxs n HIS 11 N -3.21 0.67 0.11 1.61 -0.00 -1.23 -2.49 115.22 110.68 1fxs n HIS 11 Ca -0.06 0.28 0.09 0.00 -0.00 0.00 0.00 57.72 58.03 1fxs n HIS 11 Cb 0.55 -0.95 0.02 0.00 -0.00 0.00 0.00 29.99 29.61 1fxs n HIS 11 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1fxs h ARG 12 N 0.00 0.00 -7.32 -1.40 2.47 -1.91 -2.36 114.38 103.85 1fxs h ARG 12 Ca 0.00 0.00 -0.41 0.00 -1.26 0.00 0.00 59.98 58.31 1fxs h ARG 12 Cb 0.27 0.00 0.19 0.00 -1.65 0.00 0.00 29.97 28.78 1fxs h ARG 12 CO 0.00 0.07 0.09 0.20 0.56 0.00 0.00 179.97 180.89 1fxs s GLY 13 N -4.41 1.55 0.08 0.04 0.00 -1.04 -4.67 107.32 98.87 1fxs s GLY 13 Ca 0.01 -0.83 -0.33 0.00 0.00 0.00 0.00 44.72 43.57 1fxs s GLY 13 CO 0.77 0.04 1.62 1.98 0.00 0.00 0.00 173.10 177.50 1fxs h MET 14 N -2.65 -0.83 -0.20 2.90 4.05 -1.88 -0.49 114.93 115.82 1fxs h MET 14 Ca -0.47 0.06 -0.13 0.00 -0.28 0.00 0.00 59.70 58.88 1fxs h MET 14 Cb 1.31 0.19 0.00 0.00 -0.80 0.00 0.00 31.60 32.30 1fxs h MET 14 CO 0.36 -0.55 -0.39 0.28 0.23 0.00 0.00 176.91 176.85 1fxs h VAL 15 N -0.86 1.33 -0.33 -5.77 2.07 -1.91 -2.92 116.25 107.85 1fxs h VAL 15 Ca -0.07 -1.61 0.04 0.00 0.82 0.00 0.00 66.70 65.88 1fxs h VAL 15 Cb 0.70 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.30 1fxs h VAL 15 CO 0.06 0.50 0.11 1.23 0.02 0.00 0.00 177.57 179.49 1fxs h GLY 16 N 0.29 0.42 1.86 2.17 0.00 -1.68 -1.96 103.07 104.18 1fxs h GLY 16 Ca 0.01 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.21 1fxs h GLY 16 CO 0.09 0.03 -0.23 1.48 0.00 0.00 0.00 176.54 177.90 1fxs h SER 17 N 0.25 0.17 -0.47 0.19 4.64 -0.51 -1.73 113.55 116.09 1fxs h SER 17 Ca 0.15 -0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.31 1fxs h SER 17 Cb 0.13 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1fxs h SER 17 CO -0.16 0.41 -0.16 0.00 -0.87 0.00 0.00 176.83 176.05 1fxs h ALA 18 N 1.61 0.66 -0.41 5.18 0.00 -1.23 -0.08 119.26 124.99 1fxs h ALA 18 Ca 0.03 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 1fxs h ALA 18 Cb 0.51 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1fxs h ALA 18 CO 0.04 0.60 0.06 0.82 0.00 0.00 0.00 179.25 180.77 1fxs h ILE 19 N 0.79 1.25 -0.32 0.00 2.04 -1.04 -3.01 117.51 117.22 1fxs h ILE 19 Ca 0.11 -0.89 0.01 0.00 1.00 0.00 0.00 64.86 65.09 1fxs h ILE 19 Cb 0.73 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 1fxs h ILE 19 CO 0.06 0.31 0.18 -0.09 0.00 0.00 0.00 178.15 178.61 1fxs h ARG 20 N 0.54 0.36 -0.98 2.37 1.12 -1.11 -1.20 114.38 115.48 1fxs h ARG 20 Ca 0.12 -0.02 0.13 0.00 -1.11 0.00 0.00 59.98 59.10 1fxs h ARG 20 Cb 0.39 -0.08 -0.08 0.00 -0.01 0.00 0.00 29.97 30.18 1fxs h ARG 20 CO 0.01 0.24 0.62 0.00 -3.11 0.00 0.00 179.97 177.73 1fxs h ARG 21 N 0.38 0.89 0.03 0.20 3.08 -0.93 0.19 114.38 118.21 1fxs h ARG 21 Ca 0.13 -0.05 -0.23 0.00 0.07 0.00 0.00 59.98 59.90 1fxs h ARG 21 Cb 0.00 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 1fxs h ARG 21 CO -0.06 0.59 -1.07 1.96 -1.07 0.00 0.00 179.97 180.32 1fxs h GLN 22 N 0.91 0.06 0.00 0.04 4.20 -1.31 -3.27 115.11 115.74 1fxs h GLN 22 Ca 0.49 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 59.05 1fxs h GLN 22 Cb 0.57 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 1fxs h GLN 22 CO -0.26 1.04 -0.40 -0.07 -0.67 0.00 0.00 178.83 178.48 1fxs h LEU 23 N 0.02 0.00 -1.13 1.46 3.38 -0.69 -3.19 115.31 115.15 1fxs h LEU 23 Ca -0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1fxs h LEU 23 Cb 1.82 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.56 1fxs h LEU 23 CO 0.15 0.21 -0.41 -0.08 0.09 0.00 0.00 178.44 178.40 1fxs h GLU 24 N 0.00 0.00 -1.88 1.13 4.81 -1.04 -3.15 114.58 114.45 1fxs h GLU 24 Ca -0.01 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 1fxs h GLU 24 Cb 1.18 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.52 1fxs h GLU 24 CO 0.03 0.41 0.10 1.04 -0.73 0.00 0.00 179.01 179.86 1fxs n GLN 25 N -3.90 1.19 -3.61 1.92 6.02 -1.21 -4.71 117.38 113.08 1fxs n GLN 25 Ca -0.01 -0.37 -0.01 0.00 -0.01 0.00 0.00 57.00 56.59 1fxs n GLN 25 Cb 0.46 -1.15 -0.06 0.00 1.02 0.00 0.00 30.24 30.51 1fxs n GLN 25 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1fxs s ARG 26 N -0.43 0.34 0.00 -1.09 1.70 -1.19 -5.06 118.95 113.22 1fxs s ARG 26 Ca 0.07 0.63 0.30 0.00 -0.47 0.00 0.00 55.73 56.26 1fxs s ARG 26 Cb 0.06 0.12 1.53 0.00 -0.57 0.00 0.00 34.95 36.08 1fxs s ARG 26 CO -0.00 -0.08 2.01 0.41 -1.08 0.00 0.00 175.30 176.57 1fxs n GLY 27 N 3.84 -0.57 0.24 3.88 0.00 -1.26 -3.69 105.19 107.62 1fxs n GLY 27 Ca -0.17 -0.31 0.06 0.00 0.00 0.00 0.00 46.02 45.61 1fxs n GLY 27 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fxs n ASP 28 N -0.50 0.70 -3.95 1.61 5.75 -1.26 -4.77 116.55 114.13 1fxs n ASP 28 Ca 0.22 -1.74 -0.16 0.00 -0.01 0.00 0.00 54.79 53.09 1fxs n ASP 28 Cb 0.22 -0.07 -0.15 0.00 -1.03 0.00 0.00 41.12 40.10 1fxs n ASP 28 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1fxs s VAL 29 N -1.87 0.43 -0.16 2.12 1.01 -1.24 -2.59 120.40 118.09 1fxs s VAL 29 Ca 0.20 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.98 1fxs s VAL 29 Cb 0.10 -0.38 0.01 0.00 0.00 0.00 0.00 36.38 36.11 1fxs s VAL 29 CO 0.16 0.13 -0.17 -0.70 0.00 0.00 0.00 175.10 174.52 1fxs s GLU 30 N 0.01 3.12 -0.02 2.72 2.12 0.11 -4.95 118.70 121.81 1fxs s GLU 30 Ca 0.00 -0.79 -0.21 0.00 0.36 0.00 0.00 54.97 54.34 1fxs s GLU 30 Cb -0.04 -2.60 -0.05 0.00 0.26 0.00 0.00 34.13 31.71 1fxs s GLU 30 CO -0.00 -0.08 0.60 -0.51 -0.54 0.00 0.00 175.26 174.74 1fxs s LEU 31 N 1.01 4.40 -0.28 2.70 1.43 -1.26 -1.11 118.68 125.57 1fxs s LEU 31 Ca -0.02 1.15 -0.02 0.00 -1.03 0.00 0.00 54.13 54.21 1fxs s LEU 31 Cb -0.15 -2.93 0.04 0.00 0.03 0.00 0.00 46.19 43.18 1fxs s LEU 31 CO -0.04 0.07 -0.02 -0.69 0.23 0.00 0.00 176.35 175.90 1fxs s VAL 32 N -0.04 3.02 0.05 -1.59 1.01 -0.04 -4.94 120.40 117.86 1fxs s VAL 32 Ca 0.32 -1.19 0.07 0.00 0.00 0.00 0.00 61.98 61.17 1fxs s VAL 32 Cb -0.18 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 1fxs s VAL 32 CO 0.17 0.03 -0.20 -0.76 0.00 0.00 0.00 175.10 174.34 1fxs s LEU 33 N 1.30 2.18 -0.02 3.92 1.43 -1.26 -3.54 118.68 122.70 1fxs s LEU 33 Ca -0.03 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.54 1fxs s LEU 33 Cb -0.18 -0.92 0.02 0.00 0.03 0.00 0.00 46.19 45.15 1fxs s LEU 33 CO -0.02 0.13 0.02 -0.13 0.23 0.00 0.00 176.35 176.58 1fxs s ARG 34 N -1.26 0.04 0.78 1.70 3.00 -1.26 -5.11 118.95 116.85 1fxs s ARG 34 Ca 0.07 0.13 -0.11 0.00 0.00 0.00 0.00 55.73 55.82 1fxs s ARG 34 Cb -0.09 -0.26 0.07 0.00 0.00 0.00 0.00 34.95 34.68 1fxs s ARG 34 CO 0.02 -0.13 1.14 0.95 0.00 0.00 0.00 175.30 177.28 1fxs s THR 35 N 0.86 2.14 0.47 0.02 -4.23 -1.26 -4.73 115.64 108.91 1fxs s THR 35 Ca -0.07 -0.03 0.13 0.00 -1.18 0.00 0.00 61.69 60.53 1fxs s THR 35 Cb -0.11 -3.03 0.25 0.00 1.34 0.00 0.00 72.50 70.95 1fxs s THR 35 CO -0.02 -0.03 2.09 -0.09 -0.54 0.00 0.00 174.62 176.02 1fxs h ARG 36 N -0.94 0.14 0.00 3.99 2.43 -2.02 0.98 114.38 118.96 1fxs h ARG 36 Ca -0.46 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 58.58 1fxs h ARG 36 Cb 1.32 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.83 1fxs h ARG 36 CO 0.65 0.14 -0.60 -0.44 -1.51 0.00 0.00 179.97 178.21 1fxs h ASP 37 N 0.14 0.00 0.59 -3.80 3.32 -2.02 -3.19 116.42 111.46 1fxs h ASP 37 Ca 0.04 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.81 1fxs h ASP 37 Cb 0.07 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1fxs h ASP 37 CO -0.00 0.60 -1.36 -0.33 -1.72 0.00 0.00 179.24 176.43 1fxs h GLU 38 N 0.00 0.22 -2.12 3.56 5.08 -1.60 -3.45 114.58 116.27 1fxs h GLU 38 Ca -0.01 -0.38 -0.22 0.00 -1.00 0.00 0.00 59.36 57.76 1fxs h GLU 38 Cb 1.24 0.14 -0.32 0.00 0.50 0.00 0.00 28.75 30.31 1fxs h GLU 38 CO 0.08 1.12 -0.54 -1.17 -1.00 0.00 0.00 179.01 177.50 1fxs s LEU 39 N -6.98 -0.43 -0.45 1.33 2.96 0.22 -4.94 118.68 110.39 1fxs s LEU 39 Ca -0.06 0.02 -0.26 0.00 -0.22 0.00 0.00 54.13 53.61 1fxs s LEU 39 Cb 0.07 0.83 0.03 0.00 0.50 0.00 0.00 46.19 47.62 1fxs s LEU 39 CO 0.86 -0.31 0.98 0.21 -1.32 0.00 0.00 176.35 176.76 1fxs s ASN 40 N 2.46 6.56 0.16 3.68 2.47 -1.21 -4.31 114.94 124.75 1fxs s ASN 40 Ca 0.10 0.26 0.15 0.00 0.42 0.00 0.00 52.86 53.80 1fxs s ASN 40 Cb -0.15 -2.48 0.71 0.00 -1.45 0.00 0.00 41.25 37.88 1fxs s ASN 40 CO -0.15 -1.07 1.46 0.18 -3.72 0.00 0.00 177.10 173.80 1fxs n LEU 41 N 7.27 0.33 0.13 3.21 4.77 -1.26 -1.76 117.00 129.69 1fxs n LEU 41 Ca 0.08 0.62 0.13 0.00 -0.03 0.00 0.00 56.01 56.80 1fxs n LEU 41 Cb 0.49 -0.62 0.28 0.00 -2.33 0.00 0.00 43.42 41.24 1fxs n LEU 41 CO 0.65 -0.60 0.75 -0.07 -1.33 0.00 0.00 177.39 176.79 1fxs h LEU 42 N 0.00 0.00 -8.53 2.23 3.38 -1.90 -3.40 115.31 107.09 1fxs h LEU 42 Ca 0.00 -0.03 -0.64 0.00 0.09 0.00 0.00 57.88 57.30 1fxs h LEU 42 Cb 0.14 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.75 1fxs h LEU 42 CO 0.00 0.01 0.30 -0.62 0.09 0.00 0.00 178.44 178.22 1fxs s ASP 43 N -5.05 6.33 0.12 -0.43 -1.08 -0.72 -4.93 116.67 110.92 1fxs s ASP 43 Ca 0.08 -0.41 -0.26 0.00 -0.52 0.00 0.00 52.55 51.44 1fxs s ASP 43 Cb 0.10 -2.37 -0.06 0.00 -1.46 0.00 0.00 42.92 39.14 1fxs s ASP 43 CO 0.65 -0.97 1.63 0.28 0.52 0.00 0.00 175.17 177.27 1fxs h SER 44 N 9.06 -0.81 -0.47 -0.34 0.02 -1.86 -0.99 113.55 118.15 1fxs h SER 44 Ca -0.26 0.11 0.06 0.00 -0.84 0.00 0.00 61.79 60.86 1fxs h SER 44 Cb 1.09 0.33 -0.05 0.00 0.14 0.00 0.00 62.40 63.90 1fxs h SER 44 CO 0.98 -0.35 0.19 0.03 -1.14 0.00 0.00 176.83 176.54 1fxs h ARG 45 N -0.43 0.36 -0.42 3.45 -0.00 -1.96 0.91 114.38 116.29 1fxs h ARG 45 Ca 0.06 -0.02 0.02 0.00 -0.50 0.00 0.00 59.98 59.53 1fxs h ARG 45 Cb 0.51 -0.08 -0.03 0.00 0.00 0.00 0.00 29.97 30.37 1fxs h ARG 45 CO -0.22 0.24 0.25 0.00 0.00 0.00 0.00 179.97 180.24 1fxs h ALA 46 N 1.30 0.53 -0.33 0.04 0.00 -1.84 0.63 119.26 119.60 1fxs h ALA 46 Ca 0.22 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1fxs h ALA 46 Cb 0.20 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1fxs h ALA 46 CO -0.21 -0.07 0.08 0.28 0.00 0.00 0.00 179.25 179.33 1fxs h VAL 47 N 0.51 1.22 -0.48 0.00 2.07 -0.55 -1.32 116.25 117.71 1fxs h VAL 47 Ca 0.17 -0.75 -0.08 0.00 0.82 0.00 0.00 66.70 66.87 1fxs h VAL 47 Cb 0.00 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1fxs h VAL 47 CO -0.07 0.25 -0.01 0.45 0.02 0.00 0.00 177.57 178.21 1fxs h HIS 48 N 0.38 0.86 -0.54 1.57 3.86 -0.58 -1.66 115.15 119.03 1fxs h HIS 48 Ca 0.10 -0.12 -0.04 0.00 -1.16 0.00 0.00 60.37 59.15 1fxs h HIS 48 Cb 0.30 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.51 1fxs h HIS 48 CO 0.02 0.80 0.20 -0.44 0.86 0.00 0.00 177.93 179.36 1fxs h ASP 49 N 0.75 0.76 -0.36 2.45 3.32 -0.70 -0.85 116.42 121.79 1fxs h ASP 49 Ca 0.14 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1fxs h ASP 49 Cb 0.47 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 1fxs h ASP 49 CO 0.02 0.74 0.19 0.15 -1.72 0.00 0.00 179.24 178.62 1fxs h PHE 50 N 0.74 0.51 0.00 4.55 3.57 -0.97 -0.60 116.94 124.74 1fxs h PHE 50 Ca 0.18 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 1fxs h PHE 50 Cb 0.23 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1fxs h PHE 50 CO 0.01 0.42 -0.22 0.74 -2.23 0.00 0.00 178.31 177.03 1fxs h PHE 51 N 0.45 0.00 0.14 0.41 0.04 -1.04 -1.38 116.94 115.56 1fxs h PHE 51 Ca 0.13 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.61 1fxs h PHE 51 Cb 0.09 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.25 1fxs h PHE 51 CO -0.02 0.22 -1.25 0.00 -0.60 0.00 0.00 178.31 176.66 1fxs h ALA 52 N 1.78 0.07 0.13 2.45 0.00 -0.81 -3.36 119.26 119.51 1fxs h ALA 52 Ca -0.00 -0.84 -0.30 0.00 0.00 0.00 0.00 54.91 53.78 1fxs h ALA 52 Cb 0.56 0.05 0.03 0.00 0.00 0.00 0.00 17.79 18.43 1fxs h ALA 52 CO 0.03 0.85 -1.25 0.77 0.00 0.00 0.00 179.25 179.65 1fxs h SER 53 N 0.14 0.80 -2.78 0.00 0.02 -0.83 -3.46 113.55 107.43 1fxs h SER 53 Ca -0.16 -0.75 -0.46 0.00 -0.84 0.00 0.00 61.79 59.57 1fxs h SER 53 Cb 1.95 -0.25 0.02 0.00 0.14 0.00 0.00 62.40 64.26 1fxs h SER 53 CO 0.22 1.57 -0.12 -1.61 -1.14 0.00 0.00 176.83 175.75 1fxs s GLU 54 N -2.93 3.21 -0.73 3.45 0.41 -0.55 -5.05 118.70 116.51 1fxs s GLU 54 Ca -0.08 -0.42 -0.03 0.00 -0.41 0.00 0.00 54.97 54.02 1fxs s GLU 54 Cb 0.06 -2.58 0.18 0.00 -1.78 0.00 0.00 34.13 30.01 1fxs s GLU 54 CO 0.92 -0.15 0.58 -0.98 -0.49 0.00 0.00 175.26 175.14 1fxs s ARG 55 N -4.49 2.87 -0.08 1.61 1.70 -1.26 -4.83 118.95 114.46 1fxs s ARG 55 Ca 0.46 -2.80 -0.21 0.00 -0.47 0.00 0.00 55.73 52.71 1fxs s ARG 55 Cb -0.10 -3.84 -0.04 0.00 -0.57 0.00 0.00 34.95 30.40 1fxs s ARG 55 CO 0.38 -1.21 0.61 0.42 -1.08 0.00 0.00 175.30 174.41 1fxs s ILE 56 N -0.52 5.10 -0.23 4.99 -1.09 -1.26 -4.69 121.20 123.49 1fxs s ILE 56 Ca 0.21 1.24 0.08 0.00 -2.23 0.00 0.00 60.65 59.95 1fxs s ILE 56 Cb -0.15 -3.95 -0.20 0.00 -1.58 0.00 0.00 42.46 36.58 1fxs s ILE 56 CO -0.07 0.29 -0.10 0.47 -1.23 0.00 0.00 174.94 174.30 1fxs n ASP 57 N 3.69 1.25 -4.07 3.58 8.00 0.11 -4.61 116.55 124.49 1fxs n ASP 57 Ca -0.04 -0.08 -0.10 0.00 0.71 0.00 0.00 54.79 55.28 1fxs n ASP 57 Cb 0.51 0.10 -0.11 0.00 -0.02 0.00 0.00 41.12 41.61 1fxs n ASP 57 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1fxs s GLN 58 N -2.51 0.55 -0.05 -1.24 -0.21 -0.98 -3.92 119.66 111.31 1fxs s GLN 58 Ca -0.25 -0.94 0.01 0.00 0.02 0.00 0.00 55.36 54.20 1fxs s GLN 58 Cb 0.08 -0.07 0.02 0.00 1.00 0.00 0.00 33.01 34.04 1fxs s GLN 58 CO 0.69 -0.02 -0.04 0.08 -2.12 0.00 0.00 175.29 173.88 1fxs s VAL 59 N -2.38 0.51 -0.37 1.09 1.01 -0.70 -1.15 120.40 118.40 1fxs s VAL 59 Ca -0.03 -0.09 -0.07 0.00 0.00 0.00 0.00 61.98 61.79 1fxs s VAL 59 Cb -0.03 -0.55 0.06 0.00 0.00 0.00 0.00 36.38 35.86 1fxs s VAL 59 CO -0.03 0.23 0.16 -0.31 0.00 0.00 0.00 175.10 175.15 1fxs s TYR 60 N 1.05 3.32 -1.14 5.22 1.51 -0.24 0.15 117.35 127.21 1fxs s TYR 60 Ca -0.09 -1.60 -0.18 0.00 -1.01 0.00 0.00 57.07 54.19 1fxs s TYR 60 Cb -0.14 -2.62 0.11 0.00 -0.11 0.00 0.00 41.96 39.20 1fxs s TYR 60 CO -0.01 -0.80 1.47 -1.17 -1.11 0.00 0.00 175.55 173.93 1fxs s LEU 61 N 1.37 4.40 0.00 -1.29 2.96 0.33 -1.31 118.68 125.14 1fxs s LEU 61 Ca 0.01 -2.36 0.15 0.00 -0.22 0.00 0.00 54.13 51.71 1fxs s LEU 61 Cb -0.21 -2.48 0.40 0.00 0.50 0.00 0.00 46.19 44.39 1fxs s LEU 61 CO 0.02 -1.08 1.32 0.00 -1.32 0.00 0.00 176.35 175.29 1fxs n ALA 62 N 7.24 2.27 -2.30 5.97 0.00 -0.96 -3.34 120.51 129.40 1fxs n ALA 62 Ca 0.37 -1.14 -0.39 0.00 0.00 0.00 0.00 53.44 52.28 1fxs n ALA 62 Cb 0.47 -0.61 -0.06 0.00 0.00 0.00 0.00 19.45 19.25 1fxs n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fxs s ALA 63 N -1.04 3.52 -0.02 0.00 0.00 -0.94 -4.58 121.76 118.70 1fxs s ALA 63 Ca 0.31 0.10 -0.30 0.00 0.00 0.00 0.00 51.96 52.08 1fxs s ALA 63 Cb 0.17 -2.75 0.11 0.00 0.00 0.00 0.00 23.12 20.65 1fxs s ALA 63 CO 0.22 0.29 1.08 0.00 0.00 0.00 0.00 175.76 177.35 1fxs s ALA 64 N -0.76 -1.95 -0.52 0.00 0.00 -1.26 -4.94 121.76 112.33 1fxs s ALA 64 Ca 0.31 0.91 -0.15 0.00 0.00 0.00 0.00 51.96 53.03 1fxs s ALA 64 Cb -0.20 0.30 0.11 0.00 0.00 0.00 0.00 23.12 23.34 1fxs s ALA 64 CO 0.20 -0.82 0.46 0.21 0.00 0.00 0.00 175.76 175.81 1fxs s LYS 65 N -2.81 2.95 0.13 0.00 2.47 -1.26 -5.06 119.74 116.17 1fxs s LYS 65 Ca 0.10 -1.62 0.07 0.00 -1.56 0.00 0.00 55.97 52.96 1fxs s LYS 65 Cb 0.00 -4.23 -0.04 0.00 -1.46 0.00 0.00 37.83 32.10 1fxs s LYS 65 CO -0.04 -1.24 -0.05 0.08 0.16 0.00 0.00 175.35 174.25 1fxs s VAL 66 N 1.59 3.56 0.16 4.02 1.01 -1.26 -4.93 120.40 124.56 1fxs s VAL 66 Ca 0.03 -1.31 -0.23 0.00 0.00 0.00 0.00 61.98 60.48 1fxs s VAL 66 Cb -0.28 -2.72 0.08 0.00 0.00 0.00 0.00 36.38 33.46 1fxs s VAL 66 CO 0.04 0.03 1.07 -0.83 0.00 0.00 0.00 175.10 175.40 1fxs s GLY 67 N -2.50 0.08 0.13 4.51 0.00 -1.26 -5.07 107.32 103.21 1fxs s GLY 67 Ca 0.24 -0.28 0.01 0.00 0.00 0.00 0.00 44.72 44.69 1fxs s GLY 67 CO 0.16 2.76 0.18 0.61 0.00 0.00 0.00 173.10 176.81 1fxs n GLY 68 N -0.72 1.09 0.23 0.20 0.00 -1.26 -4.82 105.19 99.91 1fxs n GLY 68 Ca -0.02 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 43.98 1fxs n GLY 68 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1fxs h ILE 69 N -0.29 0.54 -0.19 -0.61 2.04 -1.93 -1.54 117.51 115.53 1fxs h ILE 69 Ca -0.06 -0.05 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 1fxs h ILE 69 Cb 0.23 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1fxs h ILE 69 CO 0.07 0.02 0.04 0.58 0.00 0.00 0.00 178.15 178.87 1fxs h VAL 70 N 0.14 1.21 -0.13 1.67 2.07 -1.95 -2.82 116.25 116.44 1fxs h VAL 70 Ca 0.31 -0.66 0.01 0.00 0.82 0.00 0.00 66.70 67.18 1fxs h VAL 70 Cb 0.48 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1fxs h VAL 70 CO -0.49 0.20 0.03 0.00 0.02 0.00 0.00 177.57 177.34 1fxs h ALA 71 N 0.85 0.13 -0.23 1.67 0.00 -1.82 0.12 119.26 119.97 1fxs h ALA 71 Ca 0.06 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1fxs h ALA 71 Cb 0.27 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1fxs h ALA 71 CO 0.00 -0.42 0.09 -0.91 0.00 0.00 0.00 179.25 178.01 1fxs h ASN 72 N 0.09 0.29 1.05 0.00 4.21 -1.31 0.21 115.58 120.11 1fxs h ASN 72 Ca 0.05 -0.02 -0.07 0.00 1.21 0.00 0.00 56.30 57.48 1fxs h ASN 72 Cb 0.04 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 1fxs h ASN 72 CO -0.07 0.27 -0.99 0.78 -1.29 0.00 0.00 177.43 176.14 1fxs h ASN 73 N 0.33 0.00 0.25 5.81 2.35 -1.21 -3.26 115.58 119.84 1fxs h ASN 73 Ca 0.08 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.49 1fxs h ASN 73 Cb 0.08 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1fxs h ASN 73 CO -0.01 0.24 -1.83 0.74 -1.65 0.00 0.00 177.43 174.92 1fxs h THR 74 N 0.00 0.80 -1.63 2.81 2.02 -0.24 -3.40 112.91 113.27 1fxs h THR 74 Ca -0.05 -2.50 -0.58 0.00 0.77 0.00 0.00 66.41 64.04 1fxs h THR 74 Cb 1.23 2.58 -0.42 0.00 -1.74 0.00 0.00 68.15 69.80 1fxs h THR 74 CO 0.02 0.81 -0.73 -1.22 0.37 0.00 0.00 175.52 174.77 1fxs n TYR 75 N -3.43 3.43 -0.22 3.16 4.01 0.71 -4.91 117.16 119.91 1fxs n TYR 75 Ca -0.26 -3.25 0.00 0.00 -0.16 0.00 0.00 57.90 54.23 1fxs n TYR 75 Cb 1.05 -0.16 0.12 0.00 -0.31 0.00 0.00 39.34 40.05 1fxs n TYR 75 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1fxs h PRO 76 N 2.66 0.51 -0.68 -0.72 0.13 -1.76 -2.41 132.00 129.73 1fxs h PRO 76 Ca 0.26 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 65.41 1fxs h PRO 76 Cb 0.86 -0.12 -0.05 0.00 0.13 0.00 0.00 31.00 31.83 1fxs h PRO 76 CO 0.83 0.34 0.40 0.00 -0.23 0.00 0.00 178.00 179.34 1fxs h ALA 77 N 1.41 0.91 -0.78 -0.56 0.00 -1.91 -1.59 119.26 116.74 1fxs h ALA 77 Ca 0.32 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 1fxs h ALA 77 Cb 0.34 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1fxs h ALA 77 CO -0.27 0.11 0.33 -0.44 0.00 0.00 0.00 179.25 178.98 1fxs h ASP 78 N 0.75 1.05 -0.32 0.00 3.32 -1.86 -0.73 116.42 118.62 1fxs h ASP 78 Ca 0.30 -0.15 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 1fxs h ASP 78 Cb 0.14 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1fxs h ASP 78 CO -0.16 0.91 -0.19 -0.26 -1.72 0.00 0.00 179.24 177.83 1fxs h PHE 79 N 1.12 0.81 -0.00 4.55 -1.00 -0.99 -1.60 116.94 119.84 1fxs h PHE 79 Ca 0.26 -0.21 -0.13 0.00 2.81 0.00 0.00 57.97 60.70 1fxs h PHE 79 Cb 0.18 -0.18 0.01 0.00 3.61 0.00 0.00 35.95 39.56 1fxs h PHE 79 CO 0.02 0.93 -0.52 0.97 -1.61 0.00 0.00 178.31 178.10 1fxs h ILE 80 N 0.47 1.46 0.38 -0.55 2.10 -1.24 -3.19 117.51 116.92 1fxs h ILE 80 Ca 0.07 -2.05 -0.02 0.00 1.08 0.00 0.00 64.86 63.94 1fxs h ILE 80 Cb 0.73 2.64 0.00 0.00 -1.09 0.00 0.00 36.82 39.10 1fxs h ILE 80 CO 0.05 0.59 -0.18 0.22 -1.08 0.00 0.00 178.15 177.75 1fxs h TYR 81 N -0.20 -0.47 -0.63 2.19 3.20 -1.21 -1.48 116.97 118.37 1fxs h TYR 81 Ca -0.06 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.77 1fxs h TYR 81 Cb 1.24 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 39.64 1fxs h TYR 81 CO 0.15 -0.22 0.28 1.96 -1.64 0.00 0.00 178.16 178.69 1fxs h GLN 82 N -0.63 0.91 -0.16 1.82 4.20 -1.46 -0.75 115.11 119.04 1fxs h GLN 82 Ca -0.05 -0.13 -0.19 0.00 0.06 0.00 0.00 58.65 58.34 1fxs h GLN 82 Cb 0.46 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 1fxs h GLN 82 CO 0.09 0.73 -0.65 -0.91 -0.67 0.00 0.00 178.83 177.41 1fxs h ASN 83 N 0.90 0.71 -0.26 1.46 2.35 -1.54 -1.57 115.58 117.62 1fxs h ASN 83 Ca 0.22 -0.42 -0.02 0.00 -0.55 0.00 0.00 56.30 55.53 1fxs h ASN 83 Cb 0.13 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1fxs h ASN 83 CO -0.02 1.17 0.10 0.24 -1.65 0.00 0.00 177.43 177.28 1fxs h MET 84 N 0.45 0.40 -0.18 0.81 2.86 -0.91 -1.98 114.93 116.38 1fxs h MET 84 Ca -0.02 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1fxs h MET 84 Cb 1.24 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.82 1fxs h MET 84 CO 0.13 0.43 0.05 0.52 1.06 0.00 0.00 176.91 179.09 1fxs h MET 85 N 0.28 0.29 -0.61 1.72 2.86 -1.13 -1.26 114.93 117.07 1fxs h MET 85 Ca 0.09 -0.07 0.05 0.00 -2.06 0.00 0.00 59.70 57.71 1fxs h MET 85 Cb 0.18 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.75 1fxs h MET 85 CO -0.01 0.42 0.33 0.82 1.06 0.00 0.00 176.91 179.54 1fxs h ILE 86 N 0.10 0.98 0.28 -1.22 2.04 -1.26 0.33 117.51 118.76 1fxs h ILE 86 Ca 0.06 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 1fxs h ILE 86 Cb 0.26 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 1fxs h ILE 86 CO 0.00 0.11 -0.13 -0.33 0.00 0.00 0.00 178.15 177.80 1fxs h GLU 87 N 0.63 -0.36 -0.14 2.37 5.08 -1.25 -2.47 114.58 118.43 1fxs h GLU 87 Ca 0.27 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.68 1fxs h GLU 87 Cb 0.15 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1fxs h GLU 87 CO -0.16 -0.14 -0.07 0.77 -1.00 0.00 0.00 179.01 178.41 1fxs h SER 88 N -0.52 -0.22 0.29 1.42 0.02 -1.04 -1.06 113.55 112.44 1fxs h SER 88 Ca -0.04 0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1fxs h SER 88 Cb 0.39 0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1fxs h SER 88 CO 0.06 -0.09 -0.22 0.78 -1.14 0.00 0.00 176.83 176.22 1fxs h ASN 89 N -0.05 -0.57 0.17 3.07 -0.26 -0.97 -1.22 115.58 115.75 1fxs h ASN 89 Ca 0.08 0.04 -0.01 0.00 -0.56 0.00 0.00 56.30 55.85 1fxs h ASN 89 Cb 0.17 0.18 0.00 0.00 -1.06 0.00 0.00 38.32 37.61 1fxs h ASN 89 CO -0.18 -0.34 -0.08 0.40 -1.06 0.00 0.00 177.43 176.17 1fxs h ILE 90 N -0.51 0.90 -0.80 2.81 2.04 -1.39 -1.12 117.51 119.43 1fxs h ILE 90 Ca -0.02 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1fxs h ILE 90 Cb 0.45 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 1fxs h ILE 90 CO -0.00 0.08 0.46 0.40 0.00 0.00 0.00 178.15 179.08 1fxs h ILE 91 N -0.40 1.23 -0.14 -0.67 2.04 -1.23 0.49 117.51 118.84 1fxs h ILE 91 Ca -0.02 -0.55 -0.06 0.00 1.00 0.00 0.00 64.86 65.22 1fxs h ILE 91 Cb 0.31 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.53 1fxs h ILE 91 CO 0.04 0.25 -0.16 -0.74 0.00 0.00 0.00 178.15 177.54 1fxs h HIS 92 N 1.10 0.43 -0.75 1.37 2.76 -1.23 -2.62 115.15 116.22 1fxs h HIS 92 Ca 0.28 -0.13 0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1fxs h HIS 92 Cb 0.00 -0.09 -0.04 0.00 1.55 0.00 0.00 27.41 28.83 1fxs h HIS 92 CO -0.00 0.77 0.49 0.00 -1.30 0.00 0.00 177.93 177.88 1fxs h ALA 93 N 0.59 0.95 -0.26 5.26 0.00 -1.05 -0.56 119.26 124.20 1fxs h ALA 93 Ca 0.02 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1fxs h ALA 93 Cb 0.70 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1fxs h ALA 93 CO 0.04 0.33 0.06 0.00 0.00 0.00 0.00 179.25 179.68 1fxs h ALA 94 N 1.29 0.27 -0.27 0.00 0.00 -0.89 -1.46 119.26 118.21 1fxs h ALA 94 Ca 0.28 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 1fxs h ALA 94 Cb -0.08 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1fxs h ALA 94 CO -0.07 -0.36 0.12 1.25 0.00 0.00 0.00 179.25 180.19 1fxs h HIS 95 N 0.16 0.39 -0.22 0.00 6.17 -1.05 0.54 115.15 121.14 1fxs h HIS 95 Ca 0.12 -0.02 0.06 0.00 0.71 0.00 0.00 60.37 61.24 1fxs h HIS 95 Cb 0.11 -0.12 -0.01 0.00 2.52 0.00 0.00 27.41 29.91 1fxs h HIS 95 CO -0.15 0.38 0.18 1.96 0.71 0.00 0.00 177.93 181.01 1fxs h GLN 96 N 0.29 0.00 -0.43 5.26 1.08 -0.82 -2.48 115.11 118.01 1fxs h GLN 96 Ca 0.09 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 57.08 1fxs h GLN 96 Cb 0.14 0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 27.45 1fxs h GLN 96 CO -0.01 0.00 0.02 0.09 -0.95 0.00 0.00 178.83 177.98 1fxs n ASN 97 N -4.27 2.79 -2.17 1.46 4.13 -0.57 -4.98 115.26 111.64 1fxs n ASN 97 Ca 0.02 -3.68 -0.19 0.00 1.68 0.00 0.00 54.58 52.41 1fxs n ASN 97 Cb 0.32 -0.66 -0.03 0.00 -1.54 0.00 0.00 39.78 37.88 1fxs n ASN 97 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1fxs n ASP 98 N -1.06 -5.40 -4.64 6.41 8.00 -0.93 -4.94 116.55 113.99 1fxs n ASP 98 Ca 0.36 0.15 -0.42 0.00 0.71 0.00 0.00 54.79 55.58 1fxs n ASP 98 Cb 1.11 -4.58 -0.03 0.00 -0.02 0.00 0.00 41.12 37.59 1fxs n ASP 98 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1fxs s VAL 99 N -2.86 4.70 -0.14 2.53 1.01 0.14 -4.90 120.40 120.89 1fxs s VAL 99 Ca 0.00 1.71 0.19 0.00 0.00 0.00 0.00 61.98 63.88 1fxs s VAL 99 Cb 0.00 -4.26 -0.16 0.00 0.00 0.00 0.00 36.38 31.97 1fxs s VAL 99 CO 0.00 -0.23 0.72 -3.20 0.00 0.00 0.00 175.10 172.40 1fxs n ASN 100 N 6.34 0.63 -4.48 3.32 5.15 -1.26 -4.32 115.26 120.63 1fxs n ASN 100 Ca 0.09 0.27 -0.34 0.00 -0.60 0.00 0.00 54.58 54.00 1fxs n ASN 100 Cb 0.47 0.58 -0.12 0.00 -0.53 0.00 0.00 39.78 40.18 1fxs n ASN 100 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1fxs s LYS 101 N -3.04 3.64 -0.15 1.20 1.02 -1.25 -1.13 119.74 120.03 1fxs s LYS 101 Ca -0.04 -0.53 -0.16 0.00 0.02 0.00 0.00 55.97 55.26 1fxs s LYS 101 Cb 0.09 -2.93 0.04 0.00 -0.52 0.00 0.00 37.83 34.52 1fxs s LYS 101 CO 0.82 0.20 0.44 -1.17 -0.92 0.00 0.00 175.35 174.72 1fxs s LEU 102 N 0.48 0.33 -0.18 3.17 0.20 -1.12 -1.72 118.68 119.84 1fxs s LEU 102 Ca -0.03 0.83 0.01 0.00 0.69 0.00 0.00 54.13 55.62 1fxs s LEU 102 Cb -0.14 1.52 0.02 0.00 -0.43 0.00 0.00 46.19 47.16 1fxs s LEU 102 CO 0.03 -0.19 -0.20 -0.22 -0.29 0.00 0.00 176.35 175.48 1fxs s LEU 103 N 0.09 2.11 -0.20 -0.68 2.96 0.12 -0.80 118.68 122.28 1fxs s LEU 103 Ca -0.01 -0.64 -0.10 0.00 -0.22 0.00 0.00 54.13 53.16 1fxs s LEU 103 Cb -0.03 -1.47 -0.05 0.00 0.50 0.00 0.00 46.19 45.14 1fxs s LEU 103 CO 0.01 0.00 0.12 0.12 -1.32 0.00 0.00 176.35 175.28 1fxs s PHE 104 N 1.28 3.39 -0.35 5.38 5.36 0.60 -0.52 117.98 133.12 1fxs s PHE 104 Ca 0.05 0.30 -0.13 0.00 -0.96 0.00 0.00 56.93 56.18 1fxs s PHE 104 Cb -0.13 -2.14 -0.01 0.00 -0.34 0.00 0.00 43.02 40.39 1fxs s PHE 104 CO -0.13 0.28 0.26 -0.51 -1.46 0.00 0.00 175.22 173.67 1fxs s LEU 105 N 0.33 4.57 0.00 6.12 1.43 -1.21 -1.15 118.68 128.77 1fxs s LEU 105 Ca 0.07 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 1fxs s LEU 105 Cb -0.11 -2.17 0.00 0.00 0.03 0.00 0.00 46.19 43.94 1fxs s LEU 105 CO -0.02 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 176.90 1fxs n GLY 106 N 5.09 1.55 3.47 -3.19 0.00 0.29 -4.98 105.19 107.42 1fxs n GLY 106 Ca -0.12 -1.62 -0.14 0.00 0.00 0.00 0.00 46.02 44.14 1fxs n GLY 106 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fxs s SER 107 N -1.00 -0.58 0.38 1.61 0.15 -1.26 -4.42 113.70 108.58 1fxs s SER 107 Ca 0.00 0.31 0.21 0.00 0.70 0.00 0.00 55.95 57.16 1fxs s SER 107 Cb 0.00 0.54 0.49 0.00 -1.71 0.00 0.00 66.02 65.35 1fxs s SER 107 CO 0.00 -0.77 1.64 0.77 1.20 0.00 0.00 173.24 176.09 1fxs h SER 108 N 2.43 0.00 0.00 5.45 4.64 -1.68 -3.12 113.55 121.26 1fxs h SER 108 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1fxs h SER 108 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1fxs h SER 108 CO 0.37 0.28 0.00 0.00 -0.87 0.00 0.00 176.83 176.61 1fxs h ILE 110 N 0.00 0.28 -4.23 0.00 2.04 -1.90 -3.45 117.51 110.25 1fxs h ILE 110 Ca 0.00 -1.46 -0.48 0.00 1.00 0.00 0.00 64.86 63.91 1fxs h ILE 110 Cb 0.00 1.94 0.04 0.00 -0.74 0.00 0.00 36.82 38.05 1fxs h ILE 110 CO 0.00 0.16 0.38 -0.31 0.00 0.00 0.00 178.15 178.39 1fxs s TYR 111 N -3.15 3.38 0.48 1.37 2.02 -1.10 -4.74 117.35 115.61 1fxs s TYR 111 Ca 0.02 1.44 -0.22 0.00 -0.37 0.00 0.00 57.07 57.94 1fxs s TYR 111 Cb 0.08 -2.82 -0.09 0.00 -0.40 0.00 0.00 41.96 38.73 1fxs s TYR 111 CO 0.75 -0.62 0.99 -2.30 -1.57 0.00 0.00 175.55 172.81 1fxs n PRO 112 N -1.97 1.22 -0.24 -1.71 -0.02 -1.26 -4.66 135.00 126.36 1fxs n PRO 112 Ca 0.07 0.45 -0.02 0.00 -2.02 0.00 0.00 63.50 61.97 1fxs n PRO 112 Cb 0.54 -2.09 0.09 0.00 -0.02 0.00 0.00 33.50 32.02 1fxs n PRO 112 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1fxs h LYS 113 N 1.21 0.73 -0.95 -0.52 3.64 -1.37 -2.94 116.57 116.37 1fxs h LYS 113 Ca -0.46 -0.04 -0.61 0.00 -1.27 0.00 0.00 60.65 58.27 1fxs h LYS 113 Cb 1.34 -0.16 -0.30 0.00 -0.41 0.00 0.00 32.23 32.70 1fxs h LYS 113 CO 0.55 0.48 0.64 1.28 -2.27 0.00 0.00 179.45 180.13 1fxs n LEU 114 N -4.74 7.09 -4.73 5.20 4.77 -1.26 -5.02 117.00 118.30 1fxs n LEU 114 Ca 0.08 -4.14 -0.32 0.00 -0.03 0.00 0.00 56.01 51.60 1fxs n LEU 114 Cb 0.14 -0.88 0.11 0.00 -2.33 0.00 0.00 43.42 40.46 1fxs n LEU 114 CO 0.31 1.41 0.71 0.00 -1.33 0.00 0.00 177.39 178.49 1fxs s ALA 115 N -3.66 2.02 0.23 -1.18 0.00 -1.11 -4.99 121.76 113.07 1fxs s ALA 115 Ca 0.61 0.48 -0.30 0.00 0.00 0.00 0.00 51.96 52.75 1fxs s ALA 115 Cb 0.49 -3.36 -0.09 0.00 0.00 0.00 0.00 23.12 20.16 1fxs s ALA 115 CO 0.02 -2.04 1.10 0.21 0.00 0.00 0.00 175.76 175.05 1fxs s LYS 116 N -4.60 4.62 -0.10 0.00 2.20 -1.26 -4.98 119.74 115.62 1fxs s LYS 116 Ca 0.65 1.76 -0.01 0.00 -0.36 0.00 0.00 55.97 58.01 1fxs s LYS 116 Cb -0.21 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 32.85 1fxs s LYS 116 CO 0.53 0.16 -0.03 -0.65 -0.36 0.00 0.00 175.35 175.00 1fxs s GLN 117 N -0.94 3.10 0.56 4.03 -1.52 -1.26 -2.86 119.66 120.77 1fxs s GLN 117 Ca 0.47 -0.49 -0.18 0.00 -1.95 0.00 0.00 55.36 53.20 1fxs s GLN 117 Cb -0.31 -2.76 -0.05 0.00 -0.22 0.00 0.00 33.01 29.68 1fxs s GLN 117 CO 0.38 0.56 1.09 -1.25 -0.25 0.00 0.00 175.29 175.81 1fxs s PRO 118 N -0.49 3.37 -0.47 2.91 0.04 -1.26 -5.08 135.00 134.01 1fxs s PRO 118 Ca 0.08 1.44 -0.29 0.00 0.04 0.00 0.00 61.00 62.27 1fxs s PRO 118 Cb -0.12 -2.02 0.03 0.00 0.04 0.00 0.00 34.50 32.43 1fxs s PRO 118 CO 0.02 -0.80 1.15 -1.64 0.04 0.00 0.00 177.00 175.77 1fxs s MET 119 N -3.54 3.72 0.70 4.56 -1.94 -0.12 -4.57 119.30 118.11 1fxs s MET 119 Ca 0.69 0.58 -0.11 0.00 -1.71 0.00 0.00 55.69 55.14 1fxs s MET 119 Cb -0.20 -3.91 0.01 0.00 2.01 0.00 0.00 34.83 32.74 1fxs s MET 119 CO 0.29 -1.39 1.09 0.00 -0.01 0.00 0.00 175.02 175.00 1fxs s ALA 120 N 4.51 2.87 0.53 3.03 0.00 -1.26 -1.64 121.76 129.79 1fxs s ALA 120 Ca 0.49 -0.30 0.22 0.00 0.00 0.00 0.00 51.96 52.37 1fxs s ALA 120 Cb -0.07 -3.04 1.35 0.00 0.00 0.00 0.00 23.12 21.36 1fxs s ALA 120 CO 0.32 -1.13 2.04 0.93 0.00 0.00 0.00 175.76 177.92 1fxs h GLU 121 N -0.65 0.01 0.00 0.00 3.07 -1.92 -1.09 114.58 113.99 1fxs h GLU 121 Ca -0.45 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 1fxs h GLU 121 Cb 1.25 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.16 1fxs h GLU 121 CO 0.63 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 177.11 1fxs n SER 122 N -4.43 0.00 0.06 1.42 3.41 -1.26 -2.38 113.62 110.44 1fxs n SER 122 Ca 0.06 -0.62 0.13 0.00 -0.26 0.00 0.00 58.87 58.18 1fxs n SER 122 Cb 0.45 -0.03 0.49 0.00 -0.26 0.00 0.00 64.21 64.86 1fxs n SER 122 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1fxs n GLU 123 N -1.03 0.13 -1.79 4.33 4.07 -0.41 -4.76 120.64 121.19 1fxs n GLU 123 Ca 0.16 0.15 -0.42 0.00 -0.06 0.00 0.00 57.16 56.99 1fxs n GLU 123 Cb 0.08 -1.67 -0.03 0.00 -0.06 0.00 0.00 31.44 29.77 1fxs n GLU 123 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 1fxs s LEU 124 N -3.81 4.37 -0.41 4.31 2.96 -1.00 -2.40 118.68 122.70 1fxs s LEU 124 Ca 0.11 2.78 0.00 0.00 -0.22 0.00 0.00 54.13 56.80 1fxs s LEU 124 Cb 0.14 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.24 1fxs s LEU 124 CO 0.53 -0.93 0.00 0.18 -1.32 0.00 0.00 176.35 174.80 1fxs n LEU 125 N 4.11 0.09 -0.16 -0.68 4.77 -1.26 -4.91 117.00 118.97 1fxs n LEU 125 Ca 0.15 0.10 0.15 0.00 -0.03 0.00 0.00 56.01 56.38 1fxs n LEU 125 Cb 0.36 -1.69 0.78 0.00 -2.33 0.00 0.00 43.42 40.54 1fxs n LEU 125 CO 0.63 -0.58 1.01 0.00 -1.33 0.00 0.00 177.39 177.12 1fxs n GLN 126 N -1.39 1.22 0.00 3.23 1.13 -1.01 -4.95 117.38 115.62 1fxs n GLN 126 Ca -0.04 -0.32 0.00 0.00 -1.94 0.00 0.00 57.00 54.70 1fxs n GLN 126 Cb 0.32 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.19 1fxs n GLN 126 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1fxs n GLY 127 N 1.04 -0.19 3.74 1.08 0.00 -1.26 -5.04 105.19 104.57 1fxs n GLY 127 Ca 0.22 -0.96 -0.38 0.00 0.00 0.00 0.00 46.02 44.90 1fxs n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fxs s THR 128 N -2.00 2.07 0.46 2.61 -4.23 -1.26 -4.48 115.64 108.81 1fxs s THR 128 Ca 0.00 0.05 -0.05 0.00 -1.18 0.00 0.00 61.69 60.51 1fxs s THR 128 Cb 0.00 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.78 1fxs s THR 128 CO 0.00 -0.00 0.76 -0.76 -0.54 0.00 0.00 174.62 174.07 1fxs s LEU 129 N -3.85 3.69 0.09 4.79 1.43 -1.26 -1.05 118.68 122.52 1fxs s LEU 129 Ca 0.76 0.89 -0.31 0.00 -1.03 0.00 0.00 54.13 54.44 1fxs s LEU 129 Cb -0.39 -3.83 -0.08 0.00 0.03 0.00 0.00 46.19 41.92 1fxs s LEU 129 CO 0.44 -0.53 1.62 -0.70 0.23 0.00 0.00 176.35 177.42 1fxs s GLU 130 N -4.62 4.21 0.23 1.70 2.56 -1.26 -4.72 118.70 116.79 1fxs s GLU 130 Ca 0.47 2.32 -0.08 0.00 0.00 0.00 0.00 54.97 57.67 1fxs s GLU 130 Cb -0.10 -3.51 0.36 0.00 2.00 0.00 0.00 34.13 32.88 1fxs s GLU 130 CO 0.43 -0.70 1.69 -1.35 -0.56 0.00 0.00 175.26 174.77 1fxs h PRO 131 N 7.99 0.22 -0.78 4.30 0.11 -2.00 -1.57 132.00 140.27 1fxs h PRO 131 Ca -0.42 -0.01 0.15 0.00 0.11 0.00 0.00 66.00 65.82 1fxs h PRO 131 Cb 1.20 -0.05 -0.10 0.00 0.11 0.00 0.00 31.00 32.17 1fxs h PRO 131 CO 0.92 0.14 0.33 1.15 -0.21 0.00 0.00 178.00 180.34 1fxs h THR 132 N 0.23 0.66 -0.06 -1.15 2.02 -1.96 -2.39 112.91 110.25 1fxs h THR 132 Ca 0.36 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.37 1fxs h THR 132 Cb 0.58 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 1fxs h THR 132 CO -0.48 0.09 0.00 0.59 0.37 0.00 0.00 175.52 176.09 1fxs n ASN 133 N -4.98 2.35 -0.14 4.18 3.02 -0.92 -4.44 115.26 114.33 1fxs n ASN 133 Ca 0.15 -1.78 -0.07 0.00 -0.03 0.00 0.00 54.58 52.85 1fxs n ASN 133 Cb 0.43 -0.03 -0.01 0.00 -0.61 0.00 0.00 39.78 39.56 1fxs n ASN 133 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1fxs h GLU 134 N 3.58 -0.22 -0.30 3.52 4.81 -0.76 0.14 114.58 125.36 1fxs h GLU 134 Ca 0.00 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1fxs h GLU 134 Cb 0.76 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1fxs h GLU 134 CO 0.00 -0.15 0.17 -1.35 -0.73 0.00 0.00 179.01 176.95 1fxs h PRO 135 N -0.23 0.34 -0.57 0.92 0.11 -1.83 -0.82 132.00 129.92 1fxs h PRO 135 Ca 0.19 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 1fxs h PRO 135 Cb 0.54 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.55 1fxs h PRO 135 CO -0.58 0.23 0.29 -0.92 -0.21 0.00 0.00 178.00 176.80 1fxs h TYR 136 N 0.35 0.81 -0.77 0.65 3.20 -1.75 -2.48 116.97 116.99 1fxs h TYR 136 Ca 0.12 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 1fxs h TYR 136 Cb 0.00 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 37.98 1fxs h TYR 136 CO -0.08 0.62 0.40 0.00 -1.64 0.00 0.00 178.16 177.46 1fxs h ALA 137 N 1.12 0.98 -0.59 1.82 0.00 -0.40 -1.58 119.26 120.61 1fxs h ALA 137 Ca 0.20 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1fxs h ALA 137 Cb 0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1fxs h ALA 137 CO -0.03 0.51 0.10 0.82 0.00 0.00 0.00 179.25 180.66 1fxs h ILE 138 N 1.07 1.26 -0.47 0.00 1.08 -0.99 -0.65 117.51 118.80 1fxs h ILE 138 Ca 0.27 -0.97 -0.01 0.00 -0.39 0.00 0.00 64.86 63.76 1fxs h ILE 138 Cb 0.06 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 34.54 1fxs h ILE 138 CO -0.04 0.36 0.26 0.00 -0.69 0.00 0.00 178.15 178.04 1fxs h ALA 139 N 1.01 0.60 -0.38 1.87 0.00 -1.17 -1.24 119.26 119.96 1fxs h ALA 139 Ca 0.18 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1fxs h ALA 139 Cb 0.41 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1fxs h ALA 139 CO 0.01 0.12 0.15 0.87 0.00 0.00 0.00 179.25 180.40 1fxs h LYS 140 N 0.62 0.57 -0.72 0.00 1.79 -1.05 -1.50 116.57 116.28 1fxs h LYS 140 Ca 0.17 -0.11 -0.02 0.00 -2.18 0.00 0.00 60.65 58.51 1fxs h LYS 140 Cb 0.04 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.57 1fxs h LYS 140 CO -0.03 0.55 0.37 0.82 -1.08 0.00 0.00 179.45 180.08 1fxs h ILE 141 N 0.46 1.23 -0.43 1.86 2.04 -1.02 -1.82 117.51 119.83 1fxs h ILE 141 Ca 0.13 -0.62 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 1fxs h ILE 141 Cb 0.20 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1fxs h ILE 141 CO -0.01 0.27 0.27 0.00 0.00 0.00 0.00 178.15 178.67 1fxs h ALA 142 N 1.18 1.66 -0.52 1.87 0.00 -0.98 -1.51 119.26 120.95 1fxs h ALA 142 Ca 0.25 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 1fxs h ALA 142 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1fxs h ALA 142 CO -0.03 0.31 -0.05 0.78 0.00 0.00 0.00 179.25 180.25 1fxs h GLY 143 N 0.62 1.00 0.97 0.00 0.00 -0.46 -0.98 103.07 104.21 1fxs h GLY 143 Ca 0.16 -0.73 -0.09 0.00 0.00 0.00 0.00 47.33 46.66 1fxs h GLY 143 CO -0.03 0.68 -0.12 -2.22 0.00 0.00 0.00 176.54 174.84 1fxs h ILE 144 N 0.84 1.28 0.00 2.60 2.04 -0.72 -2.79 117.51 120.76 1fxs h ILE 144 Ca 0.15 -1.22 -0.07 0.00 1.00 0.00 0.00 64.86 64.71 1fxs h ILE 144 Cb 0.56 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1fxs h ILE 144 CO 0.03 0.41 -0.35 0.11 0.00 0.00 0.00 178.15 178.35 1fxs h LYS 145 N 0.55 0.00 -0.10 2.37 1.79 -1.19 -1.60 116.57 118.39 1fxs h LYS 145 Ca 0.09 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.55 1fxs h LYS 145 Cb 0.65 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.30 1fxs h LYS 145 CO 0.04 0.35 0.04 -0.07 -1.08 0.00 0.00 179.45 178.73 1fxs h LEU 146 N 0.00 0.14 0.14 2.94 3.38 -1.07 -0.71 115.31 120.13 1fxs h LEU 146 Ca -0.00 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.80 1fxs h LEU 146 Cb 0.70 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 1fxs h LEU 146 CO 0.05 0.29 -0.25 0.00 0.09 0.00 0.00 178.44 178.61 1fxs h GLU 148 N -0.47 0.97 -0.37 0.00 5.08 -1.28 -0.16 114.58 118.35 1fxs h GLU 148 Ca 0.02 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 1fxs h GLU 148 Cb 0.48 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1fxs h GLU 148 CO -0.13 0.64 -0.23 0.77 -1.00 0.00 0.00 179.01 179.07 1fxs h SER 149 N 1.00 0.75 0.36 1.42 0.02 -0.63 -0.26 113.55 116.22 1fxs h SER 149 Ca 0.36 -0.27 -0.21 0.00 -0.84 0.00 0.00 61.79 60.84 1fxs h SER 149 Cb 0.16 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 1fxs h SER 149 CO -0.13 0.96 -0.86 1.88 -1.14 0.00 0.00 176.83 177.54 1fxs h TYR 150 N 0.65 0.53 -0.13 3.45 -1.99 -0.61 -1.38 116.97 117.48 1fxs h TYR 150 Ca 0.09 -0.27 -0.00 0.00 2.00 0.00 0.00 58.73 60.54 1fxs h TYR 150 Cb 0.73 -0.07 -0.01 0.00 2.00 0.00 0.00 36.73 39.38 1fxs h TYR 150 CO 0.04 1.07 0.07 -0.91 -0.00 0.00 0.00 178.16 178.43 1fxs h ASN 151 N 0.22 0.17 0.48 3.88 -0.26 -0.81 -0.88 115.58 118.38 1fxs h ASN 151 Ca -0.06 -0.10 -0.02 0.00 -0.56 0.00 0.00 56.30 55.56 1fxs h ASN 151 Cb 1.48 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 38.70 1fxs h ASN 151 CO 0.15 0.23 -0.23 0.03 -1.06 0.00 0.00 177.43 176.54 1fxs h ARG 152 N 0.11 -0.62 -0.14 0.81 3.08 -1.02 -1.43 114.38 115.18 1fxs h ARG 152 Ca 0.05 0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.09 1fxs h ARG 152 Cb 0.09 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 1fxs h ARG 152 CO -0.01 -0.33 -0.11 0.37 -1.07 0.00 0.00 179.97 178.83 1fxs h GLN 153 N -0.87 0.31 -0.09 0.04 4.15 -1.31 -3.36 115.11 113.99 1fxs h GLN 153 Ca -0.07 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.20 1fxs h GLN 153 Cb 0.58 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.27 1fxs h GLN 153 CO 0.11 0.69 0.00 0.66 -1.93 0.00 0.00 178.83 178.35 1fxs n TYR 154 N -4.61 0.09 -2.51 3.99 4.01 -0.35 -4.98 117.16 112.81 1fxs n TYR 154 Ca -0.06 -0.06 -0.12 0.00 -0.16 0.00 0.00 57.90 57.49 1fxs n TYR 154 Cb 0.33 -0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.37 1fxs n TYR 154 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fxs n GLY 155 N 1.01 -0.05 3.92 2.72 0.00 -0.54 -4.99 105.19 107.26 1fxs n GLY 155 Ca 0.11 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 1fxs n GLY 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fxs s ARG 156 N -4.96 1.30 -0.51 1.61 1.81 -1.18 -4.97 118.95 112.05 1fxs s ARG 156 Ca 0.11 -0.15 0.07 0.00 -1.72 0.00 0.00 55.73 54.04 1fxs s ARG 156 Cb -0.05 -1.90 0.31 0.00 -0.45 0.00 0.00 34.95 32.86 1fxs s ARG 156 CO 0.13 -2.01 0.78 -3.47 -0.68 0.00 0.00 175.30 170.05 1fxs n ASP 157 N -3.54 2.74 -4.34 0.23 2.03 -0.28 -4.50 116.55 108.89 1fxs n ASP 157 Ca 0.12 -3.31 -0.45 0.00 0.52 0.00 0.00 54.79 51.67 1fxs n ASP 157 Cb 0.60 -0.61 -0.06 0.00 -0.72 0.00 0.00 41.12 40.33 1fxs n ASP 157 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1fxs s TYR 158 N -2.61 3.22 0.39 -0.67 2.02 -1.26 -2.79 117.35 115.66 1fxs s TYR 158 Ca 0.42 -1.17 0.01 0.00 -0.37 0.00 0.00 57.07 55.97 1fxs s TYR 158 Cb 0.25 -3.67 -0.02 0.00 -0.40 0.00 0.00 41.96 38.12 1fxs s TYR 158 CO -0.09 -0.99 0.60 1.03 -1.57 0.00 0.00 175.55 174.53 1fxs s ARG 159 N 1.72 3.24 -0.06 -0.62 0.52 0.02 -4.62 118.95 119.15 1fxs s ARG 159 Ca 0.04 -0.49 -0.08 0.00 -0.52 0.00 0.00 55.73 54.69 1fxs s ARG 159 Cb -0.28 -2.63 0.02 0.00 0.52 0.00 0.00 34.95 32.58 1fxs s ARG 159 CO 0.04 -0.06 0.21 -1.54 0.02 0.00 0.00 175.30 173.97 1fxs s SER 160 N -4.14 -0.18 0.00 0.23 1.04 -1.26 -0.29 113.70 109.09 1fxs s SER 160 Ca 0.44 0.32 0.07 0.00 0.48 0.00 0.00 55.95 57.26 1fxs s SER 160 Cb -0.10 0.39 -0.02 0.00 0.10 0.00 0.00 66.02 66.40 1fxs s SER 160 CO 0.36 -0.13 -0.22 0.68 0.98 0.00 0.00 173.24 174.92 1fxs s VAL 161 N -0.16 1.71 -0.49 5.02 -7.23 -0.30 -1.66 120.40 117.29 1fxs s VAL 161 Ca -0.03 -1.01 -0.07 0.00 -1.81 0.00 0.00 61.98 59.06 1fxs s VAL 161 Cb -0.02 -1.44 0.13 0.00 0.56 0.00 0.00 36.38 35.60 1fxs s VAL 161 CO 0.01 0.41 0.34 -0.32 -0.31 0.00 0.00 175.10 175.22 1fxs s MET 162 N -0.71 2.42 0.61 4.82 1.75 0.37 -0.55 119.30 128.01 1fxs s MET 162 Ca 0.08 -1.90 -0.13 0.00 -1.25 0.00 0.00 55.69 52.50 1fxs s MET 162 Cb -0.08 -3.84 -0.04 0.00 2.84 0.00 0.00 34.83 33.71 1fxs s MET 162 CO -0.00 -1.17 1.03 -1.25 -0.65 0.00 0.00 175.02 172.98 1fxs s PRO 163 N 1.09 3.47 0.00 4.11 0.05 -1.26 -0.62 135.00 141.85 1fxs s PRO 163 Ca 0.08 0.90 0.00 0.00 0.05 0.00 0.00 61.00 62.03 1fxs s PRO 163 Cb -0.24 -2.06 0.00 0.00 0.05 0.00 0.00 34.50 32.25 1fxs s PRO 163 CO -0.02 -0.67 0.00 -2.37 0.05 0.00 0.00 177.00 173.99 1fxs n THR 164 N -2.51 0.00 -1.74 1.26 5.66 -0.71 -1.91 114.28 114.33 1fxs n THR 164 Ca 0.07 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.65 1fxs n THR 164 Cb 0.54 -1.51 -0.03 0.00 -1.55 0.00 0.00 70.33 67.78 1fxs n THR 164 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 1fxs s ASN 165 N -1.00 6.38 0.22 1.09 0.01 -1.25 -4.78 114.94 115.62 1fxs s ASN 165 Ca 0.00 2.87 0.09 0.00 -0.71 0.00 0.00 52.86 55.11 1fxs s ASN 165 Cb 0.00 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.01 1fxs s ASN 165 CO 0.00 -0.96 -0.02 -0.76 -1.51 0.00 0.00 177.10 173.85 1fxs s LEU 166 N 0.93 3.18 0.20 0.60 1.43 -1.26 -0.66 118.68 123.11 1fxs s LEU 166 Ca 0.73 -0.55 -0.18 0.00 -1.03 0.00 0.00 54.13 53.10 1fxs s LEU 166 Cb -0.49 -1.78 0.03 0.00 0.03 0.00 0.00 46.19 43.97 1fxs s LEU 166 CO 0.34 0.05 0.54 -0.72 0.23 0.00 0.00 176.35 176.79 1fxs s TYR 167 N -2.01 -0.12 -5.00 0.29 1.13 -1.02 -4.91 117.35 105.71 1fxs s TYR 167 Ca 0.29 -0.22 0.00 0.00 -1.41 0.00 0.00 57.07 55.72 1fxs s TYR 167 Cb -0.08 0.42 0.00 0.00 -1.10 0.00 0.00 41.96 41.20 1fxs s TYR 167 CO 0.18 -0.94 0.00 0.41 -2.51 0.00 0.00 175.55 172.69 1fxs n GLY 168 N -0.35 0.99 3.74 5.49 0.00 -1.26 -0.30 105.19 113.50 1fxs n GLY 168 Ca -0.09 -1.91 -0.36 0.00 0.00 0.00 0.00 46.02 43.66 1fxs n GLY 168 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fxs s PRO 169 N -2.00 2.65 -0.09 1.61 0.04 -1.26 -3.21 135.00 132.74 1fxs s PRO 169 Ca 0.00 1.90 0.00 0.00 0.04 0.00 0.00 61.00 62.94 1fxs s PRO 169 Cb 0.00 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.66 1fxs s PRO 169 CO 0.00 -1.47 0.00 0.72 0.04 0.00 0.00 177.00 176.29 1fxs n HIS 170 N -1.93 0.00 -1.74 0.56 8.25 -1.26 -4.86 115.22 114.24 1fxs n HIS 170 Ca 0.14 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.30 1fxs n HIS 170 Cb 0.49 -0.62 0.06 0.00 1.12 0.00 0.00 29.99 31.04 1fxs n HIS 170 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1fxs s ASP 171 N -2.16 5.15 -0.82 0.41 -1.08 -1.20 -4.25 116.67 112.73 1fxs s ASP 171 Ca 0.00 1.26 -0.26 0.00 -0.52 0.00 0.00 52.55 53.03 1fxs s ASP 171 Cb 0.00 -2.05 0.03 0.00 -1.46 0.00 0.00 42.92 39.44 1fxs s ASP 171 CO 0.00 -1.55 1.37 0.21 0.52 0.00 0.00 175.17 175.72 1fxs s ASN 172 N -4.14 6.19 0.00 -0.34 2.47 -1.26 -4.82 114.94 113.05 1fxs s ASN 172 Ca 0.59 -0.70 0.17 0.00 0.42 0.00 0.00 52.86 53.34 1fxs s ASN 172 Cb -0.12 -2.56 0.72 0.00 -1.45 0.00 0.00 41.25 37.83 1fxs s ASN 172 CO 0.53 -1.79 1.51 0.49 -3.72 0.00 0.00 177.10 174.11 1fxs n PHE 173 N 9.50 0.18 -1.55 0.43 3.72 -1.26 -4.72 117.46 123.75 1fxs n PHE 173 Ca 0.13 -0.09 -0.35 0.00 -0.05 0.00 0.00 57.45 57.09 1fxs n PHE 173 Cb 0.50 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.12 1fxs n PHE 173 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1fxs s HIS 174 N -1.82 2.04 0.52 1.38 3.76 -1.26 -4.89 115.29 115.02 1fxs s HIS 174 Ca 0.27 1.56 0.37 0.00 -0.15 0.00 0.00 55.06 57.11 1fxs s HIS 174 Cb 0.14 -3.58 1.98 0.00 1.11 0.00 0.00 32.58 32.24 1fxs s HIS 174 CO 0.22 -2.77 2.24 -1.00 -0.85 0.00 0.00 174.74 172.57 1fxs h PRO 175 N 0.05 0.00 0.00 8.40 0.13 -1.97 -2.51 132.00 136.09 1fxs h PRO 175 Ca -0.49 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.54 1fxs h PRO 175 Cb 1.31 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 1fxs h PRO 175 CO 0.51 0.02 -0.48 0.77 -0.23 0.00 0.00 178.00 178.59 1fxs h SER 176 N 0.00 0.00 -2.67 1.44 0.02 -1.95 -3.45 113.55 106.94 1fxs h SER 176 Ca -0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 1fxs h SER 176 Cb 0.14 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.71 1fxs h SER 176 CO 0.00 0.48 1.01 0.21 -1.14 0.00 0.00 176.83 177.39 1fxs s ASN 177 N -6.73 6.55 0.00 3.07 2.47 -0.95 -4.92 114.94 114.42 1fxs s ASN 177 Ca -0.01 2.59 0.25 0.00 0.42 0.00 0.00 52.86 56.10 1fxs s ASN 177 Cb 0.13 -2.57 0.50 0.00 -1.45 0.00 0.00 41.25 37.86 1fxs s ASN 177 CO 0.73 -0.91 1.41 -1.54 -3.72 0.00 0.00 177.10 173.07 1fxs n SER 178 N 5.33 0.51 -4.70 -4.21 3.41 -1.26 -4.59 113.62 108.11 1fxs n SER 178 Ca 0.16 -0.26 -0.42 0.00 -0.26 0.00 0.00 58.87 58.09 1fxs n SER 178 Cb 0.39 0.25 -0.03 0.00 -0.26 0.00 0.00 64.21 64.57 1fxs n SER 178 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1fxs s HIS 179 N -2.99 2.56 0.18 7.33 3.76 -1.26 -4.91 115.29 119.95 1fxs s HIS 179 Ca 0.11 0.38 -0.19 0.00 -0.15 0.00 0.00 55.06 55.21 1fxs s HIS 179 Cb 0.18 -3.96 0.12 0.00 1.11 0.00 0.00 32.58 30.02 1fxs s HIS 179 CO 0.70 -3.80 1.63 -0.24 -0.85 0.00 0.00 174.74 172.18 1fxs h VAL 180 N 4.62 0.37 0.61 -0.90 3.04 -1.98 -2.14 116.25 119.87 1fxs h VAL 180 Ca -0.43 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.24 1fxs h VAL 180 Cb 1.20 0.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.86 1fxs h VAL 180 CO 0.93 0.00 -0.32 0.40 -1.01 0.00 0.00 177.57 177.56 1fxs h ILE 181 N -0.12 0.34 0.00 3.17 2.04 -1.94 0.55 117.51 121.55 1fxs h ILE 181 Ca 0.21 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.01 1fxs h ILE 181 Cb 0.45 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 1fxs h ILE 181 CO -0.52 0.00 -0.27 1.55 0.00 0.00 0.00 178.15 178.91 1fxs h PRO 182 N -0.86 0.00 -0.34 2.37 0.13 -1.89 -0.36 132.00 131.04 1fxs h PRO 182 Ca -0.08 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.95 1fxs h PRO 182 Cb 0.68 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.80 1fxs h PRO 182 CO 0.11 0.27 -0.17 0.00 -0.23 0.00 0.00 178.00 177.98 1fxs h ALA 183 N 1.73 0.48 -0.04 -0.56 0.00 -1.17 -2.66 119.26 117.04 1fxs h ALA 183 Ca -0.00 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.37 1fxs h ALA 183 Cb 0.49 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1fxs h ALA 183 CO 0.04 0.41 -0.77 -0.07 0.00 0.00 0.00 179.25 178.86 1fxs h LEU 184 N 0.50 0.37 -0.64 0.00 3.38 -0.58 -1.76 115.31 116.58 1fxs h LEU 184 Ca 0.08 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1fxs h LEU 184 Cb 0.71 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1fxs h LEU 184 CO 0.05 1.00 0.32 -0.07 0.09 0.00 0.00 178.44 179.84 1fxs h LEU 185 N 0.20 0.82 0.20 1.67 3.38 -1.08 -0.56 115.31 119.95 1fxs h LEU 185 Ca -0.03 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1fxs h LEU 185 Cb 1.35 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1fxs h LEU 185 CO 0.12 0.71 -0.10 -0.09 0.09 0.00 0.00 178.44 179.17 1fxs h ARG 186 N 0.88 -0.26 -0.41 1.13 9.65 -1.42 -1.37 114.38 122.57 1fxs h ARG 186 Ca 0.22 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.12 1fxs h ARG 186 Cb 0.09 0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.71 1fxs h ARG 186 CO -0.03 -0.01 0.27 0.00 2.80 0.00 0.00 179.97 183.01 1fxs h ARG 187 N -0.50 0.54 -0.02 0.20 3.08 -1.21 -1.54 114.38 114.93 1fxs h ARG 187 Ca -0.03 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 1fxs h ARG 187 Cb 0.38 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1fxs h ARG 187 CO 0.05 0.36 -0.37 0.74 -1.07 0.00 0.00 179.97 179.68 1fxs h PHE 188 N 0.56 0.04 -0.08 3.04 0.04 -1.12 -0.37 116.94 119.05 1fxs h PHE 188 Ca 0.15 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 1fxs h PHE 188 Cb -0.06 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.07 1fxs h PHE 188 CO -0.05 0.40 0.02 1.25 -0.60 0.00 0.00 178.31 179.32 1fxs h HIS 189 N 0.03 0.14 -0.29 -0.55 2.76 -0.72 -1.26 115.15 115.25 1fxs h HIS 189 Ca 0.00 -0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.00 1fxs h HIS 189 Cb 0.66 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.58 1fxs h HIS 189 CO 0.00 0.33 -0.42 0.93 -1.30 0.00 0.00 177.93 177.47 1fxs h GLU 190 N -0.10 0.73 -0.51 5.26 5.08 -1.09 -1.81 114.58 122.14 1fxs h GLU 190 Ca 0.02 -0.39 -0.06 0.00 -1.00 0.00 0.00 59.36 57.94 1fxs h GLU 190 Cb 0.26 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1fxs h GLU 190 CO 0.00 1.01 0.09 0.00 -1.00 0.00 0.00 179.01 179.11 1fxs h ALA 191 N 0.93 1.20 -0.39 3.43 0.00 -1.04 0.20 119.26 123.59 1fxs h ALA 191 Ca 0.04 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1fxs h ALA 191 Cb 0.97 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1fxs h ALA 191 CO 0.09 0.54 -0.23 1.15 0.00 0.00 0.00 179.25 180.80 1fxs h THR 192 N 0.76 1.28 -0.37 0.00 2.02 -1.08 0.49 112.91 116.00 1fxs h THR 192 Ca 0.16 -1.37 -0.10 0.00 0.77 0.00 0.00 66.41 65.87 1fxs h THR 192 Cb 0.34 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 1fxs h THR 192 CO 0.00 0.46 -0.16 0.00 0.37 0.00 0.00 175.52 176.20 1fxs h ALA 193 N 0.80 0.52 -0.01 6.16 0.00 -0.88 -2.91 119.26 122.95 1fxs h ALA 193 Ca 0.08 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1fxs h ALA 193 Cb 0.79 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1fxs h ALA 193 CO 0.06 0.44 -0.11 1.04 0.00 0.00 0.00 179.25 180.69 1fxs n GLN 194 N -4.30 0.90 -3.44 0.00 6.02 0.66 -4.94 117.38 112.27 1fxs n GLN 194 Ca -0.02 -0.37 -0.24 0.00 -0.01 0.00 0.00 57.00 56.36 1fxs n GLN 194 Cb 0.40 -1.49 0.06 0.00 1.02 0.00 0.00 30.24 30.22 1fxs n GLN 194 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1fxs n ASN 195 N -0.73 -6.08 -4.76 1.08 4.05 -0.02 -4.95 115.26 103.85 1fxs n ASN 195 Ca 0.16 -0.48 -0.41 0.00 0.45 0.00 0.00 54.58 54.29 1fxs n ASN 195 Cb 0.29 -4.83 -0.01 0.00 1.23 0.00 0.00 39.78 36.45 1fxs n ASN 195 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1fxs s ALA 196 N -3.26 3.68 0.41 5.20 0.00 -0.14 -4.92 121.76 122.73 1fxs s ALA 196 Ca 0.50 1.53 0.07 0.00 0.00 0.00 0.00 51.96 54.07 1fxs s ALA 196 Cb -0.23 -3.62 0.86 0.00 0.00 0.00 0.00 23.12 20.13 1fxs s ALA 196 CO 0.62 -0.96 2.05 -1.00 0.00 0.00 0.00 175.76 176.46 1fxs h PRO 197 N 4.34 0.49 -3.74 0.00 0.13 -1.92 -3.41 132.00 127.89 1fxs h PRO 197 Ca -0.48 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 64.53 1fxs h PRO 197 Cb 1.22 -0.11 -0.11 0.00 0.13 0.00 0.00 31.00 32.14 1fxs h PRO 197 CO 0.75 0.35 -0.21 0.16 -0.23 0.00 0.00 178.00 178.82 1fxs s ASP 198 N -6.72 -0.05 -0.13 1.44 -4.77 -1.26 -1.25 116.67 103.92 1fxs s ASP 198 Ca -0.08 -0.83 -0.01 0.00 -3.30 0.00 0.00 52.55 48.33 1fxs s ASP 198 Cb 0.17 0.50 0.04 0.00 -1.09 0.00 0.00 42.92 42.54 1fxs s ASP 198 CO 0.73 -0.98 -0.02 -0.69 0.70 0.00 0.00 175.17 174.90 1fxs s VAL 199 N -3.97 0.76 -0.17 2.11 1.01 -0.20 -4.90 120.40 115.05 1fxs s VAL 199 Ca 0.18 -0.33 -0.15 0.00 0.00 0.00 0.00 61.98 61.67 1fxs s VAL 199 Cb 0.02 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 1fxs s VAL 199 CO 0.02 0.15 0.36 -0.69 0.00 0.00 0.00 175.10 174.94 1fxs s VAL 200 N 1.79 5.25 -0.08 2.92 1.01 -1.26 -0.91 120.40 129.12 1fxs s VAL 200 Ca 0.02 0.67 0.03 0.00 0.00 0.00 0.00 61.98 62.70 1fxs s VAL 200 Cb -0.14 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 1fxs s VAL 200 CO -0.07 0.33 -0.17 -0.69 0.00 0.00 0.00 175.10 174.50 1fxs s VAL 201 N 0.80 2.76 0.33 2.92 1.01 0.12 -4.97 120.40 123.37 1fxs s VAL 201 Ca 0.19 -0.80 -0.28 0.00 0.00 0.00 0.00 61.98 61.08 1fxs s VAL 201 Cb -0.14 -2.09 -0.10 0.00 0.00 0.00 0.00 36.38 34.05 1fxs s VAL 201 CO 0.06 0.56 1.23 0.26 0.00 0.00 0.00 175.10 177.22 1fxs s TRP 202 N -0.16 3.19 0.00 5.22 0.23 -1.26 -0.81 118.94 125.34 1fxs s TRP 202 Ca -0.01 1.51 0.00 0.00 -2.03 0.00 0.00 56.10 55.57 1fxs s TRP 202 Cb -0.14 -3.54 0.00 0.00 0.03 0.00 0.00 33.47 29.83 1fxs s TRP 202 CO 0.03 -1.44 0.00 0.41 0.96 0.00 0.00 176.95 176.91 1fxs n GLY 203 N 0.88 0.48 0.06 0.98 0.00 -0.15 -4.74 105.19 102.71 1fxs n GLY 203 Ca 0.00 -2.14 0.12 0.00 0.00 0.00 0.00 46.02 44.00 1fxs n GLY 203 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1fxs h SER 204 N 0.00 0.00 0.00 1.61 4.64 -1.78 -2.92 113.55 115.10 1fxs h SER 204 Ca 0.00 -0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1fxs h SER 204 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1fxs h SER 204 CO 0.00 0.11 0.00 0.61 -0.87 0.00 0.00 176.83 176.68 1fxs n GLY 205 N 1.33 1.47 0.15 -0.77 0.00 -1.26 -4.90 105.19 101.20 1fxs n GLY 205 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.08 1fxs n GLY 205 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1fxs h THR 206 N 0.00 0.84 -3.96 2.61 1.35 -1.96 -0.60 112.91 111.20 1fxs h THR 206 Ca 0.00 -2.09 -0.53 0.00 -0.55 0.00 0.00 66.41 63.24 1fxs h THR 206 Cb 0.00 2.34 0.10 0.00 -1.73 0.00 0.00 68.15 68.86 1fxs h THR 206 CO 0.00 0.46 0.67 -2.16 -0.25 0.00 0.00 175.52 174.25 1fxs s PRO 207 N -3.06 3.91 -0.19 4.72 0.04 -1.26 -4.69 135.00 134.47 1fxs s PRO 207 Ca 0.03 2.32 -0.11 0.00 0.04 0.00 0.00 61.00 63.28 1fxs s PRO 207 Cb 0.08 -2.78 -0.05 0.00 0.04 0.00 0.00 34.50 31.79 1fxs s PRO 207 CO 0.73 -0.60 0.19 -1.64 0.04 0.00 0.00 177.00 175.73 1fxs s MET 208 N -2.26 4.20 0.20 4.56 -1.94 0.83 -1.63 119.30 123.26 1fxs s MET 208 Ca 0.57 -0.11 0.06 0.00 -1.71 0.00 0.00 55.69 54.50 1fxs s MET 208 Cb -0.42 -3.44 -0.05 0.00 2.01 0.00 0.00 34.83 32.94 1fxs s MET 208 CO 0.54 0.25 -0.11 1.03 -0.01 0.00 0.00 175.02 176.72 1fxs s ARG 209 N 0.49 1.28 -0.02 2.03 1.81 -0.13 -1.78 118.95 122.62 1fxs s ARG 209 Ca 0.11 -1.58 0.06 0.00 -1.72 0.00 0.00 55.73 52.60 1fxs s ARG 209 Cb -0.12 -0.96 -0.03 0.00 -0.45 0.00 0.00 34.95 33.40 1fxs s ARG 209 CO 0.01 0.12 -0.19 -2.00 -0.68 0.00 0.00 175.30 172.56 1fxs s GLU 210 N -3.69 2.27 -0.00 3.54 2.12 -1.22 -1.45 118.70 120.27 1fxs s GLU 210 Ca 0.22 -0.84 0.02 0.00 0.36 0.00 0.00 54.97 54.73 1fxs s GLU 210 Cb 0.01 -2.21 -0.01 0.00 0.26 0.00 0.00 34.13 32.18 1fxs s GLU 210 CO 0.06 0.58 -0.06 -0.06 -0.54 0.00 0.00 175.26 175.24 1fxs s PHE 211 N -0.73 0.56 -0.05 5.30 0.08 -1.26 -3.76 117.98 118.12 1fxs s PHE 211 Ca 0.12 -0.13 0.02 0.00 0.12 0.00 0.00 56.93 57.06 1fxs s PHE 211 Cb -0.10 -0.36 0.01 0.00 -0.57 0.00 0.00 43.02 42.00 1fxs s PHE 211 CO 0.01 -0.01 -0.11 -1.17 -0.10 0.00 0.00 175.22 173.83 1fxs s LEU 212 N -0.24 1.64 0.29 -0.37 2.96 0.16 -4.66 118.68 118.46 1fxs s LEU 212 Ca 0.02 -0.26 -0.29 0.00 -0.22 0.00 0.00 54.13 53.37 1fxs s LEU 212 Cb -0.03 -0.74 -0.10 0.00 0.50 0.00 0.00 46.19 45.82 1fxs s LEU 212 CO -0.00 0.04 1.22 -2.28 -1.32 0.00 0.00 176.35 174.00 1fxs s HIS 213 N 0.58 3.31 0.54 5.38 5.65 -1.26 -2.43 115.29 127.05 1fxs s HIS 213 Ca -0.12 1.50 0.25 0.00 0.25 0.00 0.00 55.06 56.95 1fxs s HIS 213 Cb -0.14 -3.50 1.43 0.00 -1.18 0.00 0.00 32.58 29.18 1fxs s HIS 213 CO 0.03 -1.31 2.01 -0.24 -0.65 0.00 0.00 174.74 174.58 1fxs h VAL 214 N 3.19 0.69 -0.16 0.89 3.04 -1.04 -0.88 116.25 122.00 1fxs h VAL 214 Ca -0.47 0.00 -0.15 0.00 -1.01 0.00 0.00 66.70 65.06 1fxs h VAL 214 Cb 1.22 0.76 -0.01 0.00 -2.01 0.00 0.00 31.29 31.25 1fxs h VAL 214 CO 0.68 0.00 -0.55 0.44 -1.01 0.00 0.00 177.57 177.13 1fxs h ASP 215 N 0.00 0.53 -0.51 3.17 3.32 -1.91 -0.70 116.42 120.32 1fxs h ASP 215 Ca 0.21 -0.28 -0.13 0.00 0.02 0.00 0.00 57.03 56.85 1fxs h ASP 215 Cb 0.88 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 1fxs h ASP 215 CO -0.00 0.97 -0.18 0.44 -1.72 0.00 0.00 179.24 178.75 1fxs h ASP 216 N 0.37 1.03 -0.13 6.45 3.32 -1.57 -2.14 116.42 123.76 1fxs h ASP 216 Ca 0.01 -0.38 0.03 0.00 0.02 0.00 0.00 57.03 56.71 1fxs h ASP 216 Cb 1.08 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.31 1fxs h ASP 216 CO 0.10 1.18 -0.07 -0.03 -1.72 0.00 0.00 179.24 178.70 1fxs h MET 217 N 0.88 -0.07 -0.70 3.56 4.05 -0.98 -0.90 114.93 120.77 1fxs h MET 217 Ca 0.12 0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.58 1fxs h MET 217 Cb 0.76 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 31.53 1fxs h MET 217 CO 0.06 -0.04 0.43 0.00 0.23 0.00 0.00 176.91 177.59 1fxs h ALA 218 N 1.04 0.93 -0.18 0.39 0.00 -1.03 -0.81 119.26 119.60 1fxs h ALA 218 Ca 0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1fxs h ALA 218 Cb 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1fxs h ALA 218 CO -0.17 0.19 0.11 0.00 0.00 0.00 0.00 179.25 179.38 1fxs h ALA 219 N 1.31 0.23 -0.53 0.00 0.00 -0.93 -1.63 119.26 117.70 1fxs h ALA 219 Ca 0.29 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1fxs h ALA 219 Cb 0.06 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1fxs h ALA 219 CO -0.12 -0.27 0.15 0.00 0.00 0.00 0.00 179.25 179.01 1fxs h ALA 220 N 1.04 1.27 -0.02 0.00 0.00 -0.85 -0.90 119.26 119.79 1fxs h ALA 220 Ca 0.06 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1fxs h ALA 220 Cb 0.01 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1fxs h ALA 220 CO -0.01 0.52 0.01 0.77 0.00 0.00 0.00 179.25 180.53 1fxs h SER 221 N 0.78 0.02 -0.38 0.00 0.02 -0.80 -0.32 113.55 112.87 1fxs h SER 221 Ca 0.18 -0.14 -0.05 0.00 -0.84 0.00 0.00 61.79 60.93 1fxs h SER 221 Cb 0.25 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 1fxs h SER 221 CO -0.01 0.16 0.08 0.40 -1.14 0.00 0.00 176.83 176.33 1fxs h ILE 222 N -0.12 1.21 0.18 3.27 2.04 -1.13 0.20 117.51 123.16 1fxs h ILE 222 Ca 0.01 -0.78 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 1fxs h ILE 222 Cb 0.14 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1fxs h ILE 222 CO -0.00 0.28 -0.08 -0.74 0.00 0.00 0.00 178.15 177.61 1fxs h HIS 223 N 0.67 -0.22 -0.60 1.37 2.76 -0.88 -0.94 115.15 117.32 1fxs h HIS 223 Ca 0.15 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.29 1fxs h HIS 223 Cb 0.30 0.07 -0.03 0.00 1.55 0.00 0.00 27.41 29.30 1fxs h HIS 223 CO 0.01 -0.00 0.29 0.28 -1.30 0.00 0.00 177.93 177.21 1fxs h VAL 224 N -0.40 1.21 -0.75 5.26 2.07 -0.88 -1.92 116.25 120.84 1fxs h VAL 224 Ca -0.02 -0.59 0.02 0.00 0.82 0.00 0.00 66.70 66.93 1fxs h VAL 224 Cb 0.31 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 1fxs h VAL 224 CO 0.04 0.24 0.48 -0.03 0.02 0.00 0.00 177.57 178.32 1fxs h MET 225 N 0.81 0.93 -0.01 1.57 -1.53 -0.84 -3.00 114.93 112.86 1fxs h MET 225 Ca 0.20 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.41 1fxs h MET 225 Cb 0.12 -0.21 0.00 0.00 -0.55 0.00 0.00 31.60 30.96 1fxs h MET 225 CO -0.03 0.61 -0.07 0.39 0.14 0.00 0.00 176.91 177.96 1fxs n GLU 226 N -4.61 1.26 -1.51 0.39 1.02 -0.37 -4.92 120.64 111.90 1fxs n GLU 226 Ca 0.08 -0.64 -0.35 0.00 -0.02 0.00 0.00 57.16 56.24 1fxs n GLU 226 Cb 0.06 -1.49 0.09 0.00 -0.02 0.00 0.00 31.44 30.08 1fxs n GLU 226 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1fxs s LEU 227 N -2.18 3.38 0.28 -4.62 2.96 -0.74 -4.93 118.68 112.83 1fxs s LEU 227 Ca 0.35 2.41 -0.29 0.00 -0.22 0.00 0.00 54.13 56.37 1fxs s LEU 227 Cb 0.21 -4.59 -0.10 0.00 0.50 0.00 0.00 46.19 42.20 1fxs s LEU 227 CO 0.40 -2.19 1.33 0.00 -1.32 0.00 0.00 176.35 174.56 1fxs s ALA 228 N -1.86 3.53 0.27 5.97 0.00 -1.26 -4.88 121.76 123.53 1fxs s ALA 228 Ca 0.76 1.22 0.01 0.00 0.00 0.00 0.00 51.96 53.95 1fxs s ALA 228 Cb -0.31 -3.49 0.59 0.00 0.00 0.00 0.00 23.12 19.92 1fxs s ALA 228 CO 0.44 -0.62 1.76 1.25 0.00 0.00 0.00 175.76 178.59 1fxs h HIS 229 N 4.20 0.80 -0.46 0.00 2.76 -1.96 -0.64 115.15 119.85 1fxs h HIS 229 Ca -0.47 0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 57.67 1fxs h HIS 229 Cb 1.22 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 29.94 1fxs h HIS 229 CO 0.58 0.16 0.03 0.93 -1.30 0.00 0.00 177.93 178.34 1fxs h GLU 230 N 0.62 0.73 -0.40 5.26 3.07 -1.99 -0.72 114.58 121.14 1fxs h GLU 230 Ca 0.49 -0.18 -0.14 0.00 -0.50 0.00 0.00 59.36 59.04 1fxs h GLU 230 Cb 0.75 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.55 1fxs h GLU 230 CO -0.39 0.73 -0.29 0.28 -1.40 0.00 0.00 179.01 177.94 1fxs h VAL 231 N 0.70 1.27 -0.22 3.13 2.07 -1.53 -2.36 116.25 119.31 1fxs h VAL 231 Ca 0.14 -1.44 -0.07 0.00 0.82 0.00 0.00 66.70 66.15 1fxs h VAL 231 Cb 0.38 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1fxs h VAL 231 CO 0.01 0.48 -0.15 -0.25 0.02 0.00 0.00 177.57 177.69 1fxs h TRP 232 N 0.74 0.57 -0.50 1.57 7.01 -0.97 -2.72 115.95 121.66 1fxs h TRP 232 Ca 0.08 -0.15 -0.02 0.00 2.11 0.00 0.00 58.89 60.91 1fxs h TRP 232 Cb 0.84 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.75 1fxs h TRP 232 CO 0.05 0.80 0.24 -0.07 -2.79 0.00 0.00 178.44 176.67 1fxs h LEU 233 N 0.18 0.62 -1.10 0.65 3.38 -1.16 -2.10 115.31 115.78 1fxs h LEU 233 Ca 0.04 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1fxs h LEU 233 Cb 0.67 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1fxs h LEU 233 CO 0.04 0.53 -0.32 -0.08 0.09 0.00 0.00 178.44 178.70 1fxs h GLU 234 N 0.69 0.22 -0.66 1.13 4.81 -1.34 -3.13 114.58 116.31 1fxs h GLU 234 Ca 0.17 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1fxs h GLU 234 Cb 0.07 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1fxs h GLU 234 CO -0.02 0.53 0.00 0.09 -0.73 0.00 0.00 179.01 178.87 1fxs n ASN 235 N -4.11 3.76 -3.38 1.04 4.13 -0.85 -4.98 115.26 110.88 1fxs n ASN 235 Ca -0.01 -2.00 -0.19 0.00 1.68 0.00 0.00 54.58 54.06 1fxs n ASN 235 Cb 0.41 -0.44 -0.08 0.00 -1.54 0.00 0.00 39.78 38.13 1fxs n ASN 235 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1fxs s THR 236 N -1.00 0.00 0.08 3.41 -4.23 -0.87 -5.04 115.64 107.99 1fxs s THR 236 Ca 0.44 -1.97 0.07 0.00 -1.18 0.00 0.00 61.69 59.05 1fxs s THR 236 Cb 0.23 -2.51 -0.03 0.00 1.34 0.00 0.00 72.50 71.52 1fxs s THR 236 CO 0.30 0.00 -0.18 -1.10 -0.54 0.00 0.00 174.62 173.10 1fxs s GLN 237 N -3.44 1.00 0.36 3.99 -0.21 -1.14 -4.84 119.66 115.39 1fxs s GLN 237 Ca 0.40 -1.03 0.12 0.00 0.02 0.00 0.00 55.36 54.88 1fxs s GLN 237 Cb 0.02 -1.13 0.92 0.00 1.00 0.00 0.00 33.01 33.83 1fxs s GLN 237 CO 0.27 0.26 1.82 -1.35 -2.12 0.00 0.00 175.29 174.17 1fxs h PRO 238 N 4.30 0.56 -0.32 2.91 0.11 -1.99 -1.62 132.00 135.95 1fxs h PRO 238 Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1fxs h PRO 238 Cb 1.18 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1fxs h PRO 238 CO 0.40 0.37 0.00 -1.33 -0.21 0.00 0.00 178.00 177.24 1fxs n MET 239 N -4.62 3.25 -2.83 1.05 2.81 -1.26 -4.47 117.12 111.04 1fxs n MET 239 Ca 0.21 -2.85 -0.11 0.00 -1.81 0.00 0.00 57.70 53.14 1fxs n MET 239 Cb 0.64 -1.88 0.05 0.00 -0.71 0.00 0.00 33.22 31.32 1fxs n MET 239 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 1fxs n LEU 240 N -0.24 -1.90 0.02 4.03 7.94 -0.65 -5.02 117.00 121.18 1fxs n LEU 240 Ca 0.22 -3.84 0.11 0.00 -1.11 0.00 0.00 56.01 51.39 1fxs n LEU 240 Cb 0.91 0.86 0.05 0.00 0.53 0.00 0.00 43.42 45.77 1fxs n LEU 240 CO 0.18 2.08 0.09 -1.54 -1.11 0.00 0.00 177.39 177.09 1fxs n SER 241 N 0.83 0.65 -4.77 1.96 3.41 -0.94 -2.87 113.62 111.89 1fxs n SER 241 Ca 0.11 -0.34 -0.35 0.00 -0.26 0.00 0.00 58.87 58.03 1fxs n SER 241 Cb 0.66 0.71 0.01 0.00 -0.26 0.00 0.00 64.21 65.33 1fxs n SER 241 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1fxs s HIS 242 N -3.12 2.65 -0.12 7.33 -3.43 -1.26 -4.57 115.29 112.76 1fxs s HIS 242 Ca 0.06 1.54 0.02 0.00 -0.80 0.00 0.00 55.06 55.88 1fxs s HIS 242 Cb 0.15 -3.26 0.01 0.00 -1.43 0.00 0.00 32.58 28.05 1fxs s HIS 242 CO 0.79 -1.61 -0.18 0.42 -2.00 0.00 0.00 174.74 172.16 1fxs s ILE 243 N -1.90 1.76 0.31 -5.38 1.01 -0.67 -4.94 121.20 111.40 1fxs s ILE 243 Ca 0.71 -0.80 -0.29 0.00 0.00 0.00 0.00 60.65 60.28 1fxs s ILE 243 Cb -0.23 -1.58 -0.10 0.00 0.01 0.00 0.00 42.46 40.55 1fxs s ILE 243 CO 0.30 0.49 1.33 0.20 0.00 0.00 0.00 174.94 177.26 1fxs s ASN 244 N 0.93 6.76 -0.16 3.58 0.01 -1.26 -0.48 114.94 124.32 1fxs s ASN 244 Ca -0.06 2.67 -0.00 0.00 -0.71 0.00 0.00 52.86 54.76 1fxs s ASN 244 Cb -0.15 -2.64 0.04 0.00 0.41 0.00 0.00 41.25 38.90 1fxs s ASN 244 CO -0.02 -0.56 -0.07 -0.69 -1.51 0.00 0.00 177.10 174.25 1fxs s VAL 245 N -0.92 1.18 0.00 1.60 1.01 0.21 -4.53 120.40 118.95 1fxs s VAL 245 Ca 0.51 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1fxs s VAL 245 Cb -0.40 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 34.69 1fxs s VAL 245 CO 0.51 0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.43 1fxs n GLY 246 N 4.86 1.21 0.06 4.51 0.00 -1.26 -1.74 105.19 112.84 1fxs n GLY 246 Ca -0.13 -0.77 -0.01 0.00 0.00 0.00 0.00 46.02 45.11 1fxs n GLY 246 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fxs n THR 247 N 0.00 0.83 -0.99 2.61 -2.24 -1.26 -4.76 114.28 108.47 1fxs n THR 247 Ca 0.00 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.08 1fxs n THR 247 Cb 0.00 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 1fxs n THR 247 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fxs n GLY 248 N 1.52 0.86 3.42 3.38 0.00 -1.26 -5.00 105.19 108.11 1fxs n GLY 248 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 1fxs n GLY 248 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fxs s VAL 249 N -3.47 3.21 0.28 1.61 1.01 -1.26 -4.99 120.40 116.79 1fxs s VAL 249 Ca 0.00 -0.62 0.09 0.00 0.00 0.00 0.00 61.98 61.45 1fxs s VAL 249 Cb 0.00 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1fxs s VAL 249 CO 0.00 0.53 0.03 1.51 0.00 0.00 0.00 175.10 177.18 1fxs s ASP 250 N 0.11 4.61 -0.00 3.32 1.47 -1.26 -4.51 116.67 120.41 1fxs s ASP 250 Ca -0.05 -0.66 -0.14 0.00 1.18 0.00 0.00 52.55 52.88 1fxs s ASP 250 Cb -0.15 -0.84 0.02 0.00 -0.34 0.00 0.00 42.92 41.61 1fxs s ASP 250 CO 0.04 -0.07 0.28 0.00 0.68 0.00 0.00 175.17 176.11 1fxs s THR 252 N -1.55 3.45 0.37 0.00 -4.23 -1.26 -0.96 115.64 111.46 1fxs s THR 252 Ca -0.12 0.55 0.06 0.00 -1.18 0.00 0.00 61.69 61.00 1fxs s THR 252 Cb -0.05 -3.09 0.20 0.00 1.34 0.00 0.00 72.50 70.90 1fxs s THR 252 CO 0.03 -0.54 1.95 0.40 -0.54 0.00 0.00 174.62 175.92 1fxs h ILE 253 N -0.56 1.16 -0.12 2.99 1.08 -0.88 -1.43 117.51 119.75 1fxs h ILE 253 Ca -0.45 -0.57 0.00 0.00 -0.39 0.00 0.00 64.86 63.45 1fxs h ILE 253 Cb 1.23 0.84 -0.01 0.00 -3.07 0.00 0.00 36.82 35.82 1fxs h ILE 253 CO 0.54 0.21 0.08 -0.09 -0.69 0.00 0.00 178.15 178.19 1fxs h ARG 254 N 0.47 0.16 -0.73 2.37 9.65 -1.42 0.36 114.38 125.24 1fxs h ARG 254 Ca 0.11 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.94 1fxs h ARG 254 Cb 0.20 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.71 1fxs h ARG 254 CO -0.00 0.14 0.32 1.49 2.80 0.00 0.00 179.97 184.71 1fxs h GLU 255 N 0.14 1.06 0.16 0.20 4.81 -1.68 -1.04 114.58 118.23 1fxs h GLU 255 Ca 0.04 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1fxs h GLU 255 Cb 0.01 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.21 1fxs h GLU 255 CO -0.01 0.84 -0.08 1.25 -0.73 0.00 0.00 179.01 180.29 1fxs h LEU 256 N 1.05 -0.18 -0.81 1.64 5.85 -0.87 -1.09 115.31 120.90 1fxs h LEU 256 Ca 0.25 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.86 1fxs h LEU 256 Cb 0.16 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 1fxs h LEU 256 CO -0.03 0.03 0.53 0.00 -0.34 0.00 0.00 178.44 178.63 1fxs h ALA 257 N 0.43 1.04 -0.30 1.25 0.00 -0.75 -0.54 119.26 120.39 1fxs h ALA 257 Ca -0.02 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1fxs h ALA 257 Cb 0.30 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1fxs h ALA 257 CO 0.04 0.39 -0.26 0.37 0.00 0.00 0.00 179.25 179.78 1fxs h GLN 258 N 1.05 0.59 -0.25 0.00 5.75 -1.17 -0.54 115.11 120.54 1fxs h GLN 258 Ca 0.31 -0.24 -0.18 0.00 -0.15 0.00 0.00 58.65 58.40 1fxs h GLN 258 Cb -0.06 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.47 1fxs h GLN 258 CO -0.09 0.80 -0.53 1.15 -2.65 0.00 0.00 178.83 177.51 1fxs h THR 259 N 0.52 1.29 -0.51 2.39 2.02 -0.67 -2.38 112.91 115.56 1fxs h THR 259 Ca 0.07 -1.73 -0.03 0.00 0.77 0.00 0.00 66.41 65.49 1fxs h THR 259 Cb 0.72 1.75 -0.02 0.00 -1.74 0.00 0.00 68.15 68.86 1fxs h THR 259 CO 0.06 0.55 0.20 0.40 0.37 0.00 0.00 175.52 177.10 1fxs h ILE 260 N 0.54 1.22 -0.53 3.11 2.04 -0.97 -0.39 117.51 122.53 1fxs h ILE 260 Ca 0.00 -0.68 0.08 0.00 1.00 0.00 0.00 64.86 65.26 1fxs h ILE 260 Cb 1.14 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.87 1fxs h ILE 260 CO 0.12 0.26 0.18 0.00 0.00 0.00 0.00 178.15 178.70 1fxs h ALA 261 N 1.05 0.65 -0.12 1.87 0.00 -1.04 -0.40 119.26 121.28 1fxs h ALA 261 Ca 0.17 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1fxs h ALA 261 Cb 0.21 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1fxs h ALA 261 CO -0.01 -0.22 0.05 -0.22 0.00 0.00 0.00 179.25 178.84 1fxs h LYS 262 N 0.35 0.18 -0.99 0.00 3.64 -1.01 -0.25 116.57 118.49 1fxs h LYS 262 Ca 0.26 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.68 1fxs h LYS 262 Cb 0.31 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.03 1fxs h LYS 262 CO -0.28 0.30 0.63 0.28 -2.27 0.00 0.00 179.45 178.11 1fxs h VAL 263 N 0.03 1.04 0.00 2.00 2.07 -0.49 -2.13 116.25 118.78 1fxs h VAL 263 Ca 0.04 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1fxs h VAL 263 Cb 0.18 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 1fxs h VAL 263 CO -0.00 0.20 -0.00 0.58 0.02 0.00 0.00 177.57 178.37 1fxs h VAL 264 N 1.12 0.00 0.00 2.57 2.07 -0.99 -3.47 116.25 117.54 1fxs h VAL 264 Ca 0.44 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1fxs h VAL 264 Cb 0.24 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1fxs h VAL 264 CO -0.19 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.01 1fxs n GLY 265 N 1.21 0.64 3.72 2.17 0.00 -0.75 -5.00 105.19 107.18 1fxs n GLY 265 Ca 0.05 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 1fxs n GLY 265 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1fxs s TYR 266 N -2.00 3.49 -0.95 1.61 5.04 -0.18 -4.94 117.35 119.42 1fxs s TYR 266 Ca 0.00 1.42 0.14 0.00 -2.44 0.00 0.00 57.07 56.19 1fxs s TYR 266 Cb 0.00 -3.37 -0.08 0.00 0.35 0.00 0.00 41.96 38.87 1fxs s TYR 266 CO 0.00 -1.02 0.67 1.63 -1.34 0.00 0.00 175.55 175.49 1fxs n LYS 267 N 3.27 2.21 0.00 4.97 4.76 -1.26 -4.69 118.16 127.42 1fxs n LYS 267 Ca 0.06 -0.36 0.00 0.00 -2.87 0.00 0.00 58.31 55.14 1fxs n LYS 267 Cb 0.46 -1.17 0.00 0.00 -1.84 0.00 0.00 35.03 32.48 1fxs n LYS 267 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1fxs n GLY 268 N 1.19 -1.61 3.72 0.72 0.00 -1.26 -5.05 105.19 102.90 1fxs n GLY 268 Ca 0.04 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 44.19 1fxs n GLY 268 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fxs s ARG 269 N -0.88 3.23 -0.24 1.61 0.52 -0.38 -4.97 118.95 117.84 1fxs s ARG 269 Ca 0.00 -0.34 -0.15 0.00 -0.52 0.00 0.00 55.73 54.72 1fxs s ARG 269 Cb 0.00 -2.94 -0.04 0.00 0.52 0.00 0.00 34.95 32.49 1fxs s ARG 269 CO 0.00 0.65 0.37 0.08 0.02 0.00 0.00 175.30 176.42 1fxs s VAL 270 N -0.72 5.20 -0.09 3.52 1.01 -1.26 -1.04 120.40 127.02 1fxs s VAL 270 Ca 0.12 0.61 0.04 0.00 0.00 0.00 0.00 61.98 62.74 1fxs s VAL 270 Cb -0.12 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1fxs s VAL 270 CO 0.02 0.21 -0.21 -0.69 0.00 0.00 0.00 175.10 174.44 1fxs s VAL 271 N 1.68 1.80 -0.25 2.92 1.01 -0.09 -4.95 120.40 122.53 1fxs s VAL 271 Ca 0.16 -0.87 -0.10 0.00 0.00 0.00 0.00 61.98 61.17 1fxs s VAL 271 Cb -0.15 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1fxs s VAL 271 CO 0.09 0.50 0.14 -0.36 0.00 0.00 0.00 175.10 175.47 1fxs s PHE 272 N 0.42 3.23 -0.71 5.22 0.08 -1.26 0.15 117.98 125.12 1fxs s PHE 272 Ca -0.17 0.05 -0.20 0.00 0.12 0.00 0.00 56.93 56.73 1fxs s PHE 272 Cb -0.17 -2.28 0.10 0.00 -0.57 0.00 0.00 43.02 40.10 1fxs s PHE 272 CO 0.07 -0.08 0.92 0.34 -0.10 0.00 0.00 175.22 176.38 1fxs s ASP 273 N 1.31 6.30 0.00 1.36 -1.08 0.01 -4.90 116.67 119.66 1fxs s ASP 273 Ca 0.07 -1.42 0.19 0.00 -0.52 0.00 0.00 52.55 50.87 1fxs s ASP 273 Cb -0.14 -2.37 1.12 0.00 -1.46 0.00 0.00 42.92 40.07 1fxs s ASP 273 CO 0.06 -1.24 1.52 0.00 0.52 0.00 0.00 175.17 176.04 1fxs n ALA 274 N 6.93 2.21 1.23 3.66 0.00 -1.18 -0.97 120.51 132.39 1fxs n ALA 274 Ca 0.01 -0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.48 1fxs n ALA 274 Cb 0.45 -1.31 0.68 0.00 0.00 0.00 0.00 19.45 19.28 1fxs n ALA 274 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1fxs n SER 275 N -0.99 0.03 -4.84 0.00 3.41 -1.26 -4.74 113.62 105.23 1fxs n SER 275 Ca 0.14 0.11 -0.34 0.00 -0.26 0.00 0.00 58.87 58.52 1fxs n SER 275 Cb 0.06 -0.36 -0.06 0.00 -0.26 0.00 0.00 64.21 63.60 1fxs n SER 275 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1fxs s LYS 276 N -2.76 3.28 0.65 4.33 -0.14 -1.09 -5.03 119.74 118.96 1fxs s LYS 276 Ca 0.22 -0.32 -0.16 0.00 -1.36 0.00 0.00 55.97 54.34 1fxs s LYS 276 Cb 0.20 -3.02 -0.01 0.00 -1.68 0.00 0.00 37.83 33.32 1fxs s LYS 276 CO 0.50 0.70 1.14 -1.25 -0.76 0.00 0.00 175.35 175.68 1fxs s PRO 277 N -1.49 2.79 0.41 -1.68 0.04 -1.26 -3.82 135.00 129.98 1fxs s PRO 277 Ca 0.21 1.54 0.06 0.00 0.04 0.00 0.00 61.00 62.85 1fxs s PRO 277 Cb -0.12 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.49 1fxs s PRO 277 CO 0.11 -1.29 0.57 -0.51 0.04 0.00 0.00 177.00 175.93 1fxs s ASP 278 N -2.23 5.72 0.00 6.66 1.01 -1.26 -4.48 116.67 122.09 1fxs s ASP 278 Ca 0.70 -0.25 0.00 0.00 0.71 0.00 0.00 52.55 53.71 1fxs s ASP 278 Cb -0.24 -0.92 0.00 0.00 1.01 0.00 0.00 42.92 42.77 1fxs s ASP 278 CO 0.39 -0.70 0.00 0.61 0.21 0.00 0.00 175.17 175.67 1fxs n GLY 279 N -1.86 1.25 3.76 0.21 0.00 -1.26 -5.00 105.19 102.29 1fxs n GLY 279 Ca 0.05 -1.69 -0.38 0.00 0.00 0.00 0.00 46.02 44.00 1fxs n GLY 279 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fxs s THR 280 N 1.30 2.60 0.38 2.61 -4.23 -1.26 -4.91 115.64 112.13 1fxs s THR 280 Ca 0.00 0.46 0.08 0.00 -1.18 0.00 0.00 61.69 61.05 1fxs s THR 280 Cb 0.00 -3.24 0.31 0.00 1.34 0.00 0.00 72.50 70.91 1fxs s THR 280 CO 0.00 0.01 1.95 -0.65 -0.54 0.00 0.00 174.62 175.39 1fxs h PRO 281 N 1.90 0.64 -2.93 3.99 0.11 -1.94 -3.43 132.00 130.34 1fxs h PRO 281 Ca -0.50 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.44 1fxs h PRO 281 Cb 1.27 -0.14 -0.23 0.00 0.11 0.00 0.00 31.00 32.00 1fxs h PRO 281 CO 0.59 0.42 -0.30 0.50 -0.21 0.00 0.00 178.00 179.01 1fxs s ARG 282 N -5.60 0.49 -0.28 1.05 3.52 -1.26 -0.12 118.95 116.75 1fxs s ARG 282 Ca -0.09 0.27 -0.00 0.00 -0.13 0.00 0.00 55.73 55.78 1fxs s ARG 282 Cb 0.20 0.23 0.17 0.00 -1.56 0.00 0.00 34.95 33.99 1fxs s ARG 282 CO 0.77 -0.09 0.50 0.21 -0.81 0.00 0.00 175.30 175.88 1fxs s LYS 283 N -0.29 0.48 0.07 5.12 2.20 -0.74 -4.97 119.74 121.60 1fxs s LYS 283 Ca -0.04 0.67 -0.19 0.00 -0.36 0.00 0.00 55.97 56.05 1fxs s LYS 283 Cb -0.03 0.06 0.04 0.00 -1.51 0.00 0.00 37.83 36.39 1fxs s LYS 283 CO 0.02 -0.74 0.45 -0.48 -0.36 0.00 0.00 175.35 174.23 1fxs s LEU 284 N 2.71 0.23 0.25 5.43 2.34 -1.26 -3.37 118.68 125.01 1fxs s LEU 284 Ca 0.15 -0.02 -0.09 0.00 0.06 0.00 0.00 54.13 54.23 1fxs s LEU 284 Cb -0.14 1.90 -0.07 0.00 -0.56 0.00 0.00 46.19 47.32 1fxs s LEU 284 CO -0.21 -0.73 0.56 -0.76 -1.06 0.00 0.00 176.35 174.15 1fxs s LEU 285 N -2.19 4.13 -0.31 1.48 1.43 -1.26 -0.94 118.68 121.02 1fxs s LEU 285 Ca -0.03 0.90 -0.20 0.00 -1.03 0.00 0.00 54.13 53.77 1fxs s LEU 285 Cb -0.00 -3.68 -0.01 0.00 0.03 0.00 0.00 46.19 42.53 1fxs s LEU 285 CO -0.05 -0.11 0.62 -0.62 0.23 0.00 0.00 176.35 176.42 1fxs s ASP 286 N -2.52 6.47 -0.25 2.29 -1.08 -0.65 -4.41 116.67 116.53 1fxs s ASP 286 Ca 0.47 0.38 0.13 0.00 -0.52 0.00 0.00 52.55 53.01 1fxs s ASP 286 Cb -0.11 -2.32 0.61 0.00 -1.46 0.00 0.00 42.92 39.64 1fxs s ASP 286 CO 0.23 -0.48 1.56 1.33 0.52 0.00 0.00 175.17 178.34 1fxs n VAL 287 N 5.40 2.56 -0.08 1.11 0.24 -1.26 -4.69 118.33 121.61 1fxs n VAL 287 Ca -0.01 -1.95 -0.06 0.00 -2.04 0.00 0.00 64.34 60.27 1fxs n VAL 287 Cb 0.49 -0.30 -0.00 0.00 -1.47 0.00 0.00 33.84 32.56 1fxs n VAL 287 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1fxs h THR 288 N 2.04 0.60 -0.40 3.34 2.02 -1.93 -0.59 112.91 117.99 1fxs h THR 288 Ca 0.12 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.35 1fxs h THR 288 Cb 1.78 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 68.74 1fxs h THR 288 CO 0.42 0.00 0.12 -0.09 0.37 0.00 0.00 175.52 176.34 1fxs h ARG 289 N -0.07 0.26 -0.60 6.66 2.43 -1.94 0.62 114.38 121.74 1fxs h ARG 289 Ca 0.16 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1fxs h ARG 289 Cb 0.30 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 1fxs h ARG 289 CO -0.35 0.17 0.18 1.25 -1.51 0.00 0.00 179.97 179.71 1fxs h LEU 290 N 0.26 0.89 -0.92 3.80 5.85 -1.67 -1.98 115.31 121.55 1fxs h LEU 290 Ca 0.19 -0.21 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 1fxs h LEU 290 Cb 0.20 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1fxs h LEU 290 CO -0.22 0.86 -0.07 0.45 -0.34 0.00 0.00 178.44 179.13 1fxs h HIS 291 N 0.86 0.77 0.00 1.25 3.86 -0.65 -1.87 115.15 119.38 1fxs h HIS 291 Ca 0.19 -0.12 -0.03 0.00 -1.16 0.00 0.00 60.37 59.25 1fxs h HIS 291 Cb 0.30 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 1fxs h HIS 291 CO 0.02 0.76 -0.16 1.96 0.86 0.00 0.00 177.93 181.38 1fxs h GLN 292 N 0.66 0.00 -0.09 2.45 4.20 -0.53 -0.36 115.11 121.44 1fxs h GLN 292 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1fxs h GLN 292 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1fxs h GLN 292 CO 0.03 0.16 0.00 1.28 -0.67 0.00 0.00 178.83 179.62 1fxs n LEU 293 N -3.45 0.66 -0.04 1.46 4.77 -0.72 -4.91 117.00 114.77 1fxs n LEU 293 Ca -0.01 -0.30 -0.00 0.00 -0.03 0.00 0.00 56.01 55.67 1fxs n LEU 293 Cb 0.33 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1fxs n LEU 293 CO 0.31 0.15 -0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1fxs n GLY 294 N 0.85 0.38 3.21 -0.72 0.00 -0.15 -5.06 105.19 103.72 1fxs n GLY 294 Ca 0.12 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 1fxs n GLY 294 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1fxs s TRP 295 N -2.02 2.33 -0.00 1.61 -0.00 -1.11 -5.04 118.94 114.72 1fxs s TRP 295 Ca 0.00 -0.82 0.03 0.00 -0.00 0.00 0.00 56.10 55.31 1fxs s TRP 295 Cb 0.00 -1.55 -0.01 0.00 -0.00 0.00 0.00 33.47 31.91 1fxs s TRP 295 CO 0.00 -0.30 -0.10 0.71 -0.00 0.00 0.00 176.95 177.26 1fxs s TYR 296 N 0.13 0.87 0.57 5.86 1.51 -1.26 -3.98 117.35 121.04 1fxs s TYR 296 Ca -0.11 -0.18 -0.19 0.00 -1.01 0.00 0.00 57.07 55.58 1fxs s TYR 296 Cb -0.15 -0.55 -0.05 0.00 -0.11 0.00 0.00 41.96 41.10 1fxs s TYR 296 CO 0.06 -0.01 1.13 -3.38 -1.11 0.00 0.00 175.55 172.24 1fxs s HIS 297 N -0.30 2.63 -0.08 2.71 -3.43 -1.26 -4.99 115.29 110.57 1fxs s HIS 297 Ca 0.03 1.54 0.10 0.00 -0.80 0.00 0.00 55.06 55.93 1fxs s HIS 297 Cb -0.04 -3.29 -0.14 0.00 -1.43 0.00 0.00 32.58 27.68 1fxs s HIS 297 CO -0.00 -1.66 0.09 0.39 -2.00 0.00 0.00 174.74 171.56 1fxs n GLU 298 N -1.52 1.76 -3.13 -0.38 1.02 -1.26 -4.98 120.64 112.15 1fxs n GLU 298 Ca 0.12 -0.03 -0.41 0.00 -0.02 0.00 0.00 57.16 56.81 1fxs n GLU 298 Cb 0.51 -1.27 -0.07 0.00 -0.02 0.00 0.00 31.44 30.59 1fxs n GLU 298 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1fxs s ILE 299 N -2.40 4.92 0.66 -3.67 1.01 -1.26 -5.06 121.20 115.40 1fxs s ILE 299 Ca -0.05 0.68 -0.11 0.00 0.00 0.00 0.00 60.65 61.17 1fxs s ILE 299 Cb 0.04 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 1fxs s ILE 299 CO 0.44 -0.23 1.05 -0.94 0.00 0.00 0.00 174.94 175.27 1fxs s SER 300 N 1.72 5.82 0.12 3.58 1.04 -1.26 -4.75 113.70 119.98 1fxs s SER 300 Ca 0.24 1.42 -0.23 0.00 0.48 0.00 0.00 55.95 57.86 1fxs s SER 300 Cb -0.15 -2.37 -0.04 0.00 0.10 0.00 0.00 66.02 63.56 1fxs s SER 300 CO 0.13 -1.14 1.66 0.25 0.98 0.00 0.00 173.24 175.13 1fxs h LEU 301 N -0.51 -0.51 -0.21 2.42 5.85 -1.97 0.42 115.31 120.80 1fxs h LEU 301 Ca -0.44 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.38 1fxs h LEU 301 Cb 1.21 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.45 1fxs h LEU 301 CO 0.61 -0.22 0.09 -0.33 -0.34 0.00 0.00 178.44 178.24 1fxs h GLU 302 N -0.25 0.19 -0.79 1.25 3.07 -1.98 -0.06 114.58 116.02 1fxs h GLU 302 Ca 0.07 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.89 1fxs h GLU 302 Cb 0.35 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.18 1fxs h GLU 302 CO -0.21 0.13 0.36 0.00 -1.40 0.00 0.00 179.01 177.89 1fxs h ALA 303 N 1.11 1.02 -0.23 3.43 0.00 -1.91 -1.04 119.26 121.64 1fxs h ALA 303 Ca 0.09 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 1fxs h ALA 303 Cb 0.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1fxs h ALA 303 CO -0.07 0.59 -0.43 0.78 0.00 0.00 0.00 179.25 180.13 1fxs h GLY 304 N 1.12 0.62 1.22 0.00 0.00 -0.57 -1.92 103.07 103.53 1fxs h GLY 304 Ca 0.27 -0.63 -0.18 0.00 0.00 0.00 0.00 47.33 46.79 1fxs h GLY 304 CO -0.03 0.57 -0.55 1.41 0.00 0.00 0.00 176.54 177.94 1fxs h LEU 305 N 0.46 0.91 -0.25 3.11 3.38 -0.81 -1.60 115.31 120.52 1fxs h LEU 305 Ca 0.04 -0.49 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 1fxs h LEU 305 Cb 0.93 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1fxs h LEU 305 CO 0.08 1.27 0.08 0.00 0.09 0.00 0.00 178.44 179.97 1fxs h ALA 306 N 0.74 0.32 -0.29 1.53 0.00 -1.10 -0.39 119.26 120.08 1fxs h ALA 306 Ca 0.01 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 1fxs h ALA 306 Cb 1.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1fxs h ALA 306 CO 0.12 -0.06 -0.30 0.66 0.00 0.00 0.00 179.25 179.67 1fxs h SER 307 N 0.23 0.62 -0.57 0.00 4.64 -1.36 -1.72 113.55 115.39 1fxs h SER 307 Ca 0.08 -0.24 -0.09 0.00 -0.47 0.00 0.00 61.79 61.07 1fxs h SER 307 Cb 0.22 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 1fxs h SER 307 CO -0.00 0.89 0.01 0.74 -0.87 0.00 0.00 176.83 177.59 1fxs h THR 308 N 0.52 1.26 -0.69 2.95 2.02 -1.17 -1.52 112.91 116.29 1fxs h THR 308 Ca 0.06 -1.13 -0.05 0.00 0.77 0.00 0.00 66.41 66.06 1fxs h THR 308 Cb 0.78 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 1fxs h THR 308 CO 0.06 0.41 0.22 0.22 0.37 0.00 0.00 175.52 176.80 1fxs h TYR 309 N 0.95 1.10 -0.42 3.16 3.20 -0.81 -0.19 116.97 123.97 1fxs h TYR 309 Ca 0.17 -0.11 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1fxs h TYR 309 Cb 0.54 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1fxs h TYR 309 CO 0.04 0.88 0.24 0.37 -1.64 0.00 0.00 178.16 178.04 1fxs h GLN 310 N 1.01 0.46 -0.42 1.82 5.75 -1.02 0.02 115.11 122.73 1fxs h GLN 310 Ca 0.22 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.68 1fxs h GLN 310 Cb 0.29 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 1fxs h GLN 310 CO -0.01 0.31 0.19 2.35 -2.65 0.00 0.00 178.83 179.01 1fxs h TRP 311 N 0.48 0.61 -0.87 3.99 7.01 -0.89 -2.53 115.95 123.75 1fxs h TRP 311 Ca 0.17 -0.04 0.09 0.00 2.11 0.00 0.00 58.89 61.22 1fxs h TRP 311 Cb 0.03 -0.19 -0.07 0.00 -2.10 0.00 0.00 29.16 26.83 1fxs h TRP 311 CO -0.08 0.52 0.52 0.35 -2.79 0.00 0.00 178.44 176.96 1fxs h PHE 312 N 0.53 0.95 -0.81 2.65 3.57 -0.47 -2.21 116.94 121.16 1fxs h PHE 312 Ca 0.14 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1fxs h PHE 312 Cb 0.15 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.55 1fxs h PHE 312 CO -0.01 0.41 0.48 -0.07 -2.23 0.00 0.00 178.31 176.90 1fxs h LEU 313 N 0.88 0.98 -0.09 0.59 3.38 -0.59 -0.23 115.31 120.23 1fxs h LEU 313 Ca 0.41 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1fxs h LEU 313 Cb 0.34 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1fxs h LEU 313 CO -0.23 0.76 0.00 -0.62 0.09 0.00 0.00 178.44 178.44 1fxs n GLU 314 N -4.46 0.15 -0.37 1.13 1.02 -0.97 -3.76 120.64 113.39 1fxs n GLU 314 Ca 0.08 0.18 0.06 0.00 -0.02 0.00 0.00 57.16 57.46 1fxs n GLU 314 Cb 0.06 -1.70 0.10 0.00 -0.02 0.00 0.00 31.44 29.89 1fxs n GLU 314 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1fxs n ASN 315 N -1.97 1.53 0.30 1.62 3.02 -0.87 -4.81 115.26 114.08 1fxs n ASN 315 Ca 0.05 -2.84 0.19 0.00 -0.03 0.00 0.00 54.58 51.96 1fxs n ASN 315 Cb 0.36 -0.37 0.88 0.00 -0.61 0.00 0.00 39.78 40.03 1fxs n ASN 315 CO 0.00 0.00 0.00 0.06 -2.62 0.00 0.00 177.26 174.70 1fxs h GLN 316 N 0.22 0.00 -2.80 3.52 3.07 -1.14 -3.22 115.11 114.76 1fxs h GLN 316 Ca -0.02 0.00 -0.73 0.00 0.09 0.00 0.00 58.65 57.99 1fxs h GLN 316 Cb 1.17 0.00 -0.09 0.00 0.08 0.00 0.00 27.48 28.64 1fxs h GLN 316 CO 0.01 0.00 2.69 -0.25 0.09 0.00 0.00 178.83 181.37 1fxs n ASP 317 N -3.09 7.86 0.00 0.06 8.00 -1.26 -2.47 116.55 125.65 1fxs n ASP 317 Ca -0.01 -3.02 0.00 0.00 0.71 0.00 0.00 54.79 52.47 1fxs n ASP 317 Cb 0.22 -1.42 0.00 0.00 -0.02 0.00 0.00 41.12 39.91 1fxs n ASP 317 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1fxs n ARG 318 N 2.36 1.29 0.00 -1.24 1.74 -1.22 -5.24 116.66 114.35 1fxs n ARG 318 Ca 0.64 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.72 1fxs n ARG 318 Cb 0.26 -0.11 0.00 0.00 -1.02 0.00 0.00 32.46 31.59 1fxs n ARG 318 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30