#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lxa s ILE 2 N 0.00 1.08 0.14 1.12 1.01 -1.26 -0.54 121.20 122.75 1lxa s ILE 2 Ca 0.00 -0.44 -0.33 0.00 0.00 0.00 0.00 60.65 59.89 1lxa s ILE 2 Cb 0.00 -1.01 -0.12 0.00 0.01 0.00 0.00 42.46 41.34 1lxa s ILE 2 CO 0.00 0.35 1.72 -0.67 0.00 0.00 0.00 174.94 176.34 1lxa n ASP 3 N 3.95 3.66 0.26 3.58 2.03 -1.02 -4.86 116.55 124.15 1lxa n ASP 3 Ca -0.22 1.04 0.16 0.00 0.52 0.00 0.00 54.79 56.29 1lxa n ASP 3 Cb 0.51 -1.50 0.88 0.00 -0.72 0.00 0.00 41.12 40.30 1lxa n ASP 3 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1lxa h LYS 4 N 7.24 0.00 0.00 -0.67 1.57 -1.95 0.63 116.57 123.39 1lxa h LYS 4 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1lxa h LYS 4 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1lxa h LYS 4 CO 0.93 0.00 -0.29 -1.13 -0.57 0.00 0.00 179.45 178.39 1lxa n SER 5 N -3.81 0.32 -4.76 0.86 3.41 -1.26 -4.88 113.62 103.50 1lxa n SER 5 Ca -0.01 0.10 -0.39 0.00 -0.26 0.00 0.00 58.87 58.31 1lxa n SER 5 Cb 0.19 -0.10 -0.05 0.00 -0.26 0.00 0.00 64.21 64.00 1lxa n SER 5 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lxa s ALA 6 N -3.01 3.32 -0.30 7.33 0.00 0.22 -3.44 121.76 125.88 1lxa s ALA 6 Ca 0.12 0.77 -0.12 0.00 0.00 0.00 0.00 51.96 52.72 1lxa s ALA 6 Cb 0.18 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 1lxa s ALA 6 CO 0.63 -0.05 0.23 0.12 0.00 0.00 0.00 175.76 176.69 1lxa s PHE 7 N -1.29 3.22 -0.26 0.00 5.36 -0.75 -4.93 117.98 119.33 1lxa s PHE 7 Ca 0.46 0.03 0.03 0.00 -0.96 0.00 0.00 56.93 56.49 1lxa s PHE 7 Cb -0.28 -2.44 0.06 0.00 -0.34 0.00 0.00 43.02 40.03 1lxa s PHE 7 CO 0.35 -0.24 -0.09 0.08 -1.46 0.00 0.00 175.22 173.86 1lxa s VAL 8 N 1.79 2.08 0.17 3.12 1.01 -1.26 -1.01 120.40 126.29 1lxa s VAL 8 Ca 0.08 -1.64 -0.32 0.00 0.00 0.00 0.00 61.98 60.10 1lxa s VAL 8 Cb -0.16 -2.24 -0.11 0.00 0.00 0.00 0.00 36.38 33.87 1lxa s VAL 8 CO 0.11 -0.09 1.74 -2.28 0.00 0.00 0.00 175.10 174.57 1lxa s HIS 9 N 1.13 2.65 0.39 5.22 2.46 0.31 -4.84 115.29 122.60 1lxa s HIS 9 Ca -0.07 0.25 0.21 0.00 0.47 0.00 0.00 55.06 55.93 1lxa s HIS 9 Cb -0.20 -4.12 1.23 0.00 -0.13 0.00 0.00 32.58 29.37 1lxa s HIS 9 CO -0.06 -4.37 1.66 -1.35 -2.47 0.00 0.00 174.74 168.15 1lxa h PRO 10 N 7.47 0.21 0.00 2.88 0.11 -1.93 0.37 132.00 141.12 1lxa h PRO 10 Ca -0.44 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 1lxa h PRO 10 Cb 1.21 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1lxa h PRO 10 CO 0.95 0.14 -0.24 1.79 -0.21 0.00 0.00 178.00 180.43 1lxa h THR 11 N 0.22 0.56 -4.26 -1.15 1.35 -1.92 -3.45 112.91 104.26 1lxa h THR 11 Ca 0.76 -1.19 -0.51 0.00 -0.55 0.00 0.00 66.41 64.91 1lxa h THR 11 Cb 2.02 1.81 0.17 0.00 -1.73 0.00 0.00 68.15 70.42 1lxa h THR 11 CO -0.51 0.23 0.26 0.00 -0.25 0.00 0.00 175.52 175.25 1lxa s ALA 12 N -3.60 1.80 -0.27 6.62 0.00 0.13 -4.11 121.76 122.33 1lxa s ALA 12 Ca 0.01 0.41 0.01 0.00 0.00 0.00 0.00 51.96 52.39 1lxa s ALA 12 Cb 0.10 -3.36 0.08 0.00 0.00 0.00 0.00 23.12 19.94 1lxa s ALA 12 CO 0.64 -2.31 -0.01 0.42 0.00 0.00 0.00 175.76 174.50 1lxa s ILE 13 N -2.77 1.65 -0.18 0.00 1.01 0.34 -4.92 121.20 116.32 1lxa s ILE 13 Ca 0.64 -1.54 -0.08 0.00 0.00 0.00 0.00 60.65 59.67 1lxa s ILE 13 Cb -0.20 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 1lxa s ILE 13 CO 0.57 -0.30 0.09 -0.69 0.00 0.00 0.00 174.94 174.61 1lxa s VAL 14 N 1.29 5.04 0.37 2.92 1.01 -1.26 -0.58 120.40 129.18 1lxa s VAL 14 Ca 0.00 0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.90 1lxa s VAL 14 Cb -0.19 -3.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.84 1lxa s VAL 14 CO -0.09 0.46 0.76 -1.61 0.00 0.00 0.00 175.10 174.62 1lxa s GLU 15 N 0.27 3.91 0.04 2.72 0.41 0.12 -4.95 118.70 121.22 1lxa s GLU 15 Ca 0.06 0.60 -0.30 0.00 -0.41 0.00 0.00 54.97 54.91 1lxa s GLU 15 Cb -0.12 -2.40 -0.07 0.00 -1.78 0.00 0.00 34.13 29.76 1lxa s GLU 15 CO -0.00 0.05 1.55 -1.21 -0.49 0.00 0.00 175.26 175.16 1lxa s GLU 16 N -3.40 4.23 0.00 1.61 2.02 -1.26 -1.70 118.70 120.20 1lxa s GLU 16 Ca 0.53 2.18 0.00 0.00 0.02 0.00 0.00 54.97 57.70 1lxa s GLU 16 Cb -0.10 -3.58 0.00 0.00 0.10 0.00 0.00 34.13 30.55 1lxa s GLU 16 CO 0.24 -0.67 0.00 0.41 0.02 0.00 0.00 175.26 175.26 1lxa n GLY 17 N 3.84 2.22 3.70 -1.39 0.00 -1.26 -4.56 105.19 107.74 1lxa n GLY 17 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1lxa n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lxa s ALA 18 N -2.06 3.73 -0.22 4.61 0.00 -0.69 -4.39 121.76 122.74 1lxa s ALA 18 Ca 0.00 1.31 -0.07 0.00 0.00 0.00 0.00 51.96 53.19 1lxa s ALA 18 Cb 0.00 -3.69 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 1lxa s ALA 18 CO 0.00 -1.04 0.06 0.45 0.00 0.00 0.00 175.76 175.24 1lxa s SER 19 N 2.10 5.28 -0.13 0.00 0.15 -0.15 -3.31 113.70 117.63 1lxa s SER 19 Ca 0.74 -0.11 0.02 0.00 0.70 0.00 0.00 55.95 57.30 1lxa s SER 19 Cb -0.42 -1.93 0.01 0.00 -1.71 0.00 0.00 66.02 61.97 1lxa s SER 19 CO 0.33 0.04 -0.19 -0.63 1.20 0.00 0.00 173.24 173.98 1lxa s ILE 20 N 1.17 1.85 0.91 6.45 1.01 0.30 -1.11 121.20 131.79 1lxa s ILE 20 Ca 0.04 -0.85 -0.12 0.00 0.00 0.00 0.00 60.65 59.72 1lxa s ILE 20 Cb -0.14 -1.66 0.14 0.00 0.01 0.00 0.00 42.46 40.81 1lxa s ILE 20 CO 0.03 0.51 1.09 -0.83 0.00 0.00 0.00 174.94 175.74 1lxa s GLY 21 N 0.90 1.61 0.53 6.18 0.00 0.34 -2.42 107.32 114.47 1lxa s GLY 21 Ca -0.06 -0.05 -0.22 0.00 0.00 0.00 0.00 44.72 44.39 1lxa s GLY 21 CO -0.02 0.45 1.24 0.00 0.00 0.00 0.00 173.10 174.76 1lxa n ALA 22 N -3.95 1.14 -1.97 3.20 0.00 -1.26 -2.29 120.51 115.39 1lxa n ALA 22 Ca 0.07 0.13 -0.11 0.00 0.00 0.00 0.00 53.44 53.54 1lxa n ALA 22 Cb 0.55 -2.27 -0.02 0.00 0.00 0.00 0.00 19.45 17.71 1lxa n ALA 22 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1lxa n ASN 23 N -0.63 -3.25 -4.66 0.00 3.02 -1.22 -1.19 115.26 107.33 1lxa n ASN 23 Ca 0.10 0.25 -0.28 0.00 -0.03 0.00 0.00 54.58 54.63 1lxa n ASN 23 Cb 0.44 -2.92 0.11 0.00 -0.61 0.00 0.00 39.78 36.81 1lxa n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lxa s ALA 24 N -2.27 2.82 -0.07 5.41 0.00 -0.97 -3.01 121.76 123.67 1lxa s ALA 24 Ca 0.00 -1.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.90 1lxa s ALA 24 Cb 0.00 -2.67 0.04 0.00 0.00 0.00 0.00 23.12 20.48 1lxa s ALA 24 CO 0.00 -1.75 0.07 -1.58 0.00 0.00 0.00 175.76 172.50 1lxa s HIS 25 N -3.51 0.07 -0.32 0.00 2.46 0.24 -1.81 115.29 112.42 1lxa s HIS 25 Ca 0.65 0.16 -0.03 0.00 0.47 0.00 0.00 55.06 56.31 1lxa s HIS 25 Cb -0.08 -0.51 0.05 0.00 -0.13 0.00 0.00 32.58 31.91 1lxa s HIS 25 CO 0.48 -0.26 0.05 0.42 -2.47 0.00 0.00 174.74 172.96 1lxa s ILE 26 N 2.17 3.29 0.99 0.89 -1.09 -0.18 0.22 121.20 127.49 1lxa s ILE 26 Ca 0.04 -1.34 -0.16 0.00 -2.23 0.00 0.00 60.65 56.97 1lxa s ILE 26 Cb -0.13 -2.90 0.20 0.00 -1.58 0.00 0.00 42.46 38.04 1lxa s ILE 26 CO -0.04 -0.17 1.24 -0.83 -1.23 0.00 0.00 174.94 173.91 1lxa s GLY 27 N 1.35 1.69 0.71 6.18 0.00 0.05 -0.53 107.32 116.77 1lxa s GLY 27 Ca -0.03 -1.00 -0.16 0.00 0.00 0.00 0.00 44.72 43.53 1lxa s GLY 27 CO 0.00 -0.27 1.06 -1.05 0.00 0.00 0.00 173.10 172.84 1lxa n PRO 28 N -3.91 0.59 -3.64 2.90 -0.02 -1.26 -3.43 135.00 126.23 1lxa n PRO 28 Ca 0.13 0.26 -0.27 0.00 -2.02 0.00 0.00 63.50 61.60 1lxa n PRO 28 Cb 0.60 -2.30 -0.01 0.00 -0.02 0.00 0.00 33.50 31.76 1lxa n PRO 28 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1lxa n PHE 29 N -2.48 -1.77 -3.92 6.00 3.72 -1.26 -0.89 117.46 116.87 1lxa n PHE 29 Ca 0.14 0.56 -0.21 0.00 -0.05 0.00 0.00 57.45 57.89 1lxa n PHE 29 Cb 0.49 -2.81 -0.03 0.00 -0.94 0.00 0.00 39.48 36.19 1lxa n PHE 29 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1lxa s ILE 31 N -2.08 0.65 -0.14 0.00 1.01 0.14 -0.50 121.20 120.28 1lxa s ILE 31 Ca 0.36 -0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.88 1lxa s ILE 31 Cb -0.08 -0.69 0.02 0.00 0.01 0.00 0.00 42.46 41.71 1lxa s ILE 31 CO 0.28 0.27 -0.16 -0.69 0.00 0.00 0.00 174.94 174.64 1lxa s VAL 32 N 1.25 1.64 0.96 2.92 1.01 0.25 -0.92 120.40 127.51 1lxa s VAL 32 Ca -0.05 -0.70 -0.12 0.00 0.00 0.00 0.00 61.98 61.11 1lxa s VAL 32 Cb -0.14 -1.52 0.17 0.00 0.00 0.00 0.00 36.38 34.90 1lxa s VAL 32 CO -0.02 0.47 1.09 -0.83 0.00 0.00 0.00 175.10 175.81 1lxa s GLY 33 N 1.26 1.60 0.36 4.51 0.00 0.49 0.15 107.32 115.70 1lxa s GLY 33 Ca 0.01 -0.04 0.27 0.00 0.00 0.00 0.00 44.72 44.96 1lxa s GLY 33 CO -0.08 0.50 1.80 -0.56 0.00 0.00 0.00 173.10 174.77 1lxa h PRO 34 N -1.84 0.00 -0.36 2.90 0.13 -1.80 -2.76 132.00 128.26 1lxa h PRO 34 Ca -0.52 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1lxa h PRO 34 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1lxa h PRO 34 CO 0.53 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.02 1lxa n HIS 35 N -2.55 0.90 -3.15 1.56 8.25 -1.26 -2.29 115.22 116.68 1lxa n HIS 35 Ca 0.02 -0.70 -0.33 0.00 -0.26 0.00 0.00 57.72 56.45 1lxa n HIS 35 Cb 0.28 -0.21 -0.06 0.00 1.12 0.00 0.00 29.99 31.12 1lxa n HIS 35 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1lxa s VAL 36 N -2.02 4.67 -0.19 1.59 1.01 -1.04 -3.42 120.40 121.01 1lxa s VAL 36 Ca 0.37 0.98 -0.03 0.00 0.00 0.00 0.00 61.98 63.30 1lxa s VAL 36 Cb 0.26 -3.65 0.06 0.00 0.00 0.00 0.00 36.38 33.05 1lxa s VAL 36 CO 0.14 -0.11 0.05 -1.61 0.00 0.00 0.00 175.10 173.57 1lxa s GLU 37 N -2.79 0.50 -0.23 2.72 2.02 -0.07 -0.98 118.70 119.88 1lxa s GLU 37 Ca 0.52 -0.33 -0.05 0.00 0.02 0.00 0.00 54.97 55.13 1lxa s GLU 37 Cb -0.11 -2.02 -0.02 0.00 0.10 0.00 0.00 34.13 32.08 1lxa s GLU 37 CO 0.18 -0.64 -0.01 0.42 0.02 0.00 0.00 175.26 175.23 1lxa s ILE 38 N 1.93 3.67 1.02 -1.63 1.01 -0.26 -0.23 121.20 126.71 1lxa s ILE 38 Ca -0.00 -0.39 -0.13 0.00 0.00 0.00 0.00 60.65 60.13 1lxa s ILE 38 Cb -0.17 -2.68 0.20 0.00 0.01 0.00 0.00 42.46 39.82 1lxa s ILE 38 CO -0.08 0.40 1.09 -0.83 0.00 0.00 0.00 174.94 175.52 1lxa s GLY 39 N 1.46 1.56 0.42 6.18 0.00 0.14 0.13 107.32 117.21 1lxa s GLY 39 Ca 0.05 -0.37 -0.25 0.00 0.00 0.00 0.00 44.72 44.16 1lxa s GLY 39 CO -0.01 0.27 1.10 -2.21 0.00 0.00 0.00 173.10 172.24 1lxa n GLU 40 N -4.27 1.52 -1.69 2.90 2.13 -1.26 -2.65 120.64 117.31 1lxa n GLU 40 Ca 0.05 0.54 -0.16 0.00 0.66 0.00 0.00 57.16 58.25 1lxa n GLU 40 Cb 0.57 -2.15 -0.05 0.00 0.27 0.00 0.00 31.44 30.07 1lxa n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1lxa n GLY 41 N 1.07 1.04 3.86 8.31 0.00 -0.33 -0.40 105.19 118.74 1lxa n GLY 41 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1lxa n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lxa s THR 42 N -2.46 4.95 -0.04 2.61 2.01 -1.08 -3.01 115.64 118.62 1lxa s THR 42 Ca 0.00 0.56 0.04 0.00 0.31 0.00 0.00 61.69 62.60 1lxa s THR 42 Cb 0.00 -3.66 -0.00 0.00 0.01 0.00 0.00 72.50 68.85 1lxa s THR 42 CO 0.00 0.11 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.20 1lxa s VAL 43 N -1.61 1.24 -0.43 3.82 1.01 0.14 0.81 120.40 125.37 1lxa s VAL 43 Ca 0.41 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.80 1lxa s VAL 43 Cb -0.13 -1.07 0.12 0.00 0.00 0.00 0.00 36.38 35.30 1lxa s VAL 43 CO 0.20 0.36 0.18 -0.76 0.00 0.00 0.00 175.10 175.08 1lxa s LEU 44 N 0.07 4.80 0.15 3.92 1.02 0.13 -0.41 118.68 128.37 1lxa s LEU 44 Ca -0.03 -2.44 -0.31 0.00 0.02 0.00 0.00 54.13 51.37 1lxa s LEU 44 Cb -0.10 -1.70 -0.08 0.00 0.02 0.00 0.00 46.19 44.33 1lxa s LEU 44 CO 0.02 -0.37 1.55 0.11 0.02 0.00 0.00 176.35 177.67 1lxa h LYS 45 N 7.34 -0.18 0.00 1.70 1.79 -1.44 0.18 116.57 125.96 1lxa h LYS 45 Ca -0.07 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1lxa h LYS 45 Cb 0.98 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 1lxa h LYS 45 CO 0.62 -0.12 0.00 -1.13 -1.08 0.00 0.00 179.45 177.74 1lxa n SER 46 N -5.32 0.00 -3.93 0.86 3.41 -1.26 -3.97 113.62 103.41 1lxa n SER 46 Ca -0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.36 1lxa n SER 46 Cb 0.30 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 1lxa n SER 46 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1lxa n HIS 47 N -0.51 -1.67 -4.51 7.33 8.25 -0.07 -3.56 115.22 120.49 1lxa n HIS 47 Ca 0.00 0.74 -0.29 0.00 -0.26 0.00 0.00 57.72 57.92 1lxa n HIS 47 Cb 0.00 -3.78 -0.13 0.00 1.12 0.00 0.00 29.99 27.20 1lxa n HIS 47 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1lxa s VAL 48 N -3.93 2.17 -0.20 1.59 1.01 -1.25 -0.66 120.40 119.13 1lxa s VAL 48 Ca 0.01 -1.64 0.01 0.00 0.00 0.00 0.00 61.98 60.37 1lxa s VAL 48 Cb -0.00 -1.91 0.03 0.00 0.00 0.00 0.00 36.38 34.50 1lxa s VAL 48 CO 0.88 0.14 -0.15 -0.69 0.00 0.00 0.00 175.10 175.29 1lxa s VAL 49 N -1.00 1.90 -0.18 2.92 1.01 -1.09 -0.68 120.40 123.28 1lxa s VAL 49 Ca 0.13 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 61.07 1lxa s VAL 49 Cb -0.10 -1.85 0.03 0.00 0.00 0.00 0.00 36.38 34.46 1lxa s VAL 49 CO 0.05 0.33 -0.15 -0.69 0.00 0.00 0.00 175.10 174.63 1lxa s VAL 50 N 1.31 1.82 0.27 2.92 1.01 -0.10 -0.40 120.40 127.23 1lxa s VAL 50 Ca 0.01 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.12 1lxa s VAL 50 Cb -0.15 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 1lxa s VAL 50 CO -0.10 0.39 0.26 -0.46 0.00 0.00 0.00 175.10 175.19 1lxa n ASN 51 N 4.67 -0.67 -0.00 3.32 0.23 -0.41 -0.38 115.26 122.02 1lxa n ASN 51 Ca -0.18 -2.69 0.00 0.00 -0.53 0.00 0.00 54.58 51.18 1lxa n ASN 51 Cb 0.49 1.47 0.00 0.00 -2.08 0.00 0.00 39.78 39.66 1lxa n ASN 51 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1lxa n GLY 52 N -0.49 -1.57 3.38 4.83 0.00 -1.26 -4.03 105.19 106.04 1lxa n GLY 52 Ca 0.05 -1.32 -0.45 0.00 0.00 0.00 0.00 46.02 44.30 1lxa n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1lxa s HIS 53 N 0.00 3.92 -0.10 1.61 3.76 -1.25 -4.04 115.29 119.18 1lxa s HIS 53 Ca 0.00 -2.36 0.02 0.00 -0.15 0.00 0.00 55.06 52.57 1lxa s HIS 53 Cb 0.00 -4.00 -0.01 0.00 1.11 0.00 0.00 32.58 29.68 1lxa s HIS 53 CO 0.00 -1.12 -0.18 0.99 -0.85 0.00 0.00 174.74 173.58 1lxa s THR 54 N -0.01 2.59 -0.21 1.30 2.01 -1.22 -2.54 115.64 117.56 1lxa s THR 54 Ca 0.33 -0.84 -0.02 0.00 0.31 0.00 0.00 61.69 61.47 1lxa s THR 54 Cb -0.08 -2.04 0.01 0.00 0.01 0.00 0.00 72.50 70.40 1lxa s THR 54 CO -0.06 0.55 -0.09 -0.75 -0.69 0.00 0.00 174.62 173.58 1lxa s LYS 55 N 0.20 3.17 -0.09 4.92 2.36 0.16 -0.89 119.74 129.57 1lxa s LYS 55 Ca -0.11 -0.74 0.03 0.00 -2.55 0.00 0.00 55.97 52.59 1lxa s LYS 55 Cb -0.16 -2.87 0.01 0.00 -1.05 0.00 0.00 37.83 33.75 1lxa s LYS 55 CO 0.06 -0.24 -0.18 0.42 1.55 0.00 0.00 175.35 176.96 1lxa s ILE 56 N 1.40 1.65 0.00 5.43 1.01 0.68 -0.20 121.20 131.16 1lxa s ILE 56 Ca 0.05 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 59.93 1lxa s ILE 56 Cb -0.14 -1.46 0.00 0.00 0.01 0.00 0.00 42.46 40.86 1lxa s ILE 56 CO -0.06 0.47 0.00 0.61 0.00 0.00 0.00 174.94 175.96 1lxa n GLY 57 N 3.78 -2.68 3.76 6.18 0.00 -0.34 0.23 105.19 116.12 1lxa n GLY 57 Ca -0.20 -1.27 -0.25 0.00 0.00 0.00 0.00 46.02 44.30 1lxa n GLY 57 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1lxa s ARG 58 N 0.00 2.75 -1.58 1.61 1.70 -1.26 -2.37 118.95 119.80 1lxa s ARG 58 Ca 0.00 -1.03 -0.02 0.00 -0.47 0.00 0.00 55.73 54.22 1lxa s ARG 58 Cb 0.00 -2.51 0.00 0.00 -0.57 0.00 0.00 34.95 31.87 1lxa s ARG 58 CO 0.00 0.44 0.16 -0.25 -1.08 0.00 0.00 175.30 174.57 1lxa n ASP 59 N -0.62 -5.50 -4.90 -2.89 8.00 0.46 -1.67 116.55 109.43 1lxa n ASP 59 Ca -0.08 -0.06 -0.29 0.00 0.71 0.00 0.00 54.79 55.07 1lxa n ASP 59 Cb 0.56 -4.56 -0.03 0.00 -0.02 0.00 0.00 41.12 37.07 1lxa n ASP 59 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1lxa s ASN 60 N -2.23 6.46 -0.13 -2.24 0.01 -1.26 -3.43 114.94 112.12 1lxa s ASN 60 Ca 0.09 0.83 0.01 0.00 -0.71 0.00 0.00 52.86 53.08 1lxa s ASN 60 Cb -0.04 -2.19 0.02 0.00 0.41 0.00 0.00 41.25 39.45 1lxa s ASN 60 CO 0.11 -0.27 -0.14 -0.70 -1.51 0.00 0.00 177.10 174.60 1lxa s GLU 61 N -3.69 2.18 -0.16 -0.60 2.12 -0.22 -0.68 118.70 117.65 1lxa s GLU 61 Ca 0.46 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 55.27 1lxa s GLU 61 Cb -0.11 -1.99 0.03 0.00 0.26 0.00 0.00 34.13 32.33 1lxa s GLU 61 CO 0.31 -0.20 -0.11 0.42 -0.54 0.00 0.00 175.26 175.15 1lxa s ILE 62 N 1.38 1.42 0.32 -3.70 1.01 0.45 -0.62 121.20 121.46 1lxa s ILE 62 Ca 0.02 -0.67 -0.14 0.00 0.00 0.00 0.00 60.65 59.86 1lxa s ILE 62 Cb -0.13 -1.43 -0.09 0.00 0.01 0.00 0.00 42.46 40.82 1lxa s ILE 62 CO -0.08 0.31 0.72 -0.31 0.00 0.00 0.00 174.94 175.58 1lxa s TYR 63 N 1.53 3.38 0.10 3.97 1.51 0.70 -1.28 117.35 127.26 1lxa s TYR 63 Ca 0.03 1.18 -0.22 0.00 -1.01 0.00 0.00 57.07 57.04 1lxa s TYR 63 Cb -0.14 -2.51 -0.13 0.00 -0.11 0.00 0.00 41.96 39.08 1lxa s TYR 63 CO -0.09 0.10 0.48 1.04 -1.11 0.00 0.00 175.55 175.97 1lxa n GLN 64 N -0.39 0.00 -1.02 -0.62 6.02 -1.23 -2.80 117.38 117.34 1lxa n GLN 64 Ca 0.03 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 57.01 1lxa n GLN 64 Cb 0.53 -0.81 -0.00 0.00 1.02 0.00 0.00 30.24 30.98 1lxa n GLN 64 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1lxa n PHE 65 N 0.29 0.00 -2.56 1.08 3.72 0.16 -2.76 117.46 117.39 1lxa n PHE 65 Ca 0.13 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.23 1lxa n PHE 65 Cb 0.14 -0.47 -0.02 0.00 -0.94 0.00 0.00 39.48 38.20 1lxa n PHE 65 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1lxa s ALA 66 N -1.92 3.28 -0.20 4.37 0.00 -1.12 -3.01 121.76 123.15 1lxa s ALA 66 Ca 0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 51.96 51.71 1lxa s ALA 66 Cb 0.00 -2.80 0.07 0.00 0.00 0.00 0.00 23.12 20.39 1lxa s ALA 66 CO 0.00 -0.25 0.12 0.45 0.00 0.00 0.00 175.76 176.08 1lxa s SER 67 N -3.56 2.46 -0.15 0.00 0.15 -0.23 -2.67 113.70 109.70 1lxa s SER 67 Ca 0.52 -0.71 0.02 0.00 0.70 0.00 0.00 55.95 56.48 1lxa s SER 67 Cb -0.10 -0.18 0.01 0.00 -1.71 0.00 0.00 66.02 64.04 1lxa s SER 67 CO 0.39 -0.37 -0.20 -0.63 1.20 0.00 0.00 173.24 173.63 1lxa s ILE 68 N 2.16 2.24 0.00 6.45 1.01 0.47 -1.79 121.20 131.73 1lxa s ILE 68 Ca 0.04 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.78 1lxa s ILE 68 Cb -0.16 -1.92 0.00 0.00 0.01 0.00 0.00 42.46 40.39 1lxa s ILE 68 CO -0.16 0.54 0.00 0.61 0.00 0.00 0.00 174.94 175.93 1lxa n GLY 69 N 4.19 0.67 3.39 6.18 0.00 0.42 -1.29 105.19 118.74 1lxa n GLY 69 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1lxa n GLY 69 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1lxa n GLU 70 N -2.00 -0.07 -2.16 1.61 4.07 -1.21 -4.15 120.64 116.74 1lxa n GLU 70 Ca 0.00 0.02 -0.36 0.00 -0.06 0.00 0.00 57.16 56.76 1lxa n GLU 70 Cb 0.00 -1.75 0.01 0.00 -0.06 0.00 0.00 31.44 29.65 1lxa n GLU 70 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1lxa s VAL 71 N -2.20 2.94 0.51 6.31 1.01 -1.26 -0.27 120.40 127.44 1lxa s VAL 71 Ca 0.58 0.60 -0.01 0.00 0.00 0.00 0.00 61.98 63.14 1lxa s VAL 71 Cb -0.26 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 32.89 1lxa s VAL 71 CO 0.66 -0.11 0.76 0.54 0.00 0.00 0.00 175.10 176.94 1lxa s ASN 72 N -1.65 5.63 -0.02 3.32 2.20 -1.26 -4.74 114.94 118.42 1lxa s ASN 72 Ca 0.74 0.33 0.06 0.00 -0.94 0.00 0.00 52.86 53.05 1lxa s ASN 72 Cb -0.27 -1.43 0.21 0.00 -2.00 0.00 0.00 41.25 37.75 1lxa s ASN 72 CO 0.30 -0.90 1.08 0.00 -2.94 0.00 0.00 177.10 174.64 1lxa n GLN 73 N -2.28 1.69 -2.39 3.55 6.02 -1.26 -4.88 117.38 117.82 1lxa n GLN 73 Ca 0.04 -0.83 -0.40 0.00 -0.01 0.00 0.00 57.00 55.80 1lxa n GLN 73 Cb 0.58 -1.32 -0.04 0.00 1.02 0.00 0.00 30.24 30.48 1lxa n GLN 73 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1lxa s ASP 74 N -0.79 7.08 0.42 1.08 -1.08 -1.26 -4.95 116.67 117.18 1lxa s ASP 74 Ca 0.15 2.35 0.22 0.00 -0.52 0.00 0.00 52.55 54.75 1lxa s ASP 74 Cb 0.09 -2.63 0.45 0.00 -1.46 0.00 0.00 42.92 39.38 1lxa s ASP 74 CO 0.09 -0.28 1.64 -0.07 0.52 0.00 0.00 175.17 177.06 1lxa h LEU 75 N 3.56 0.00 0.00 -1.34 3.38 -2.07 -3.22 115.31 115.63 1lxa h LEU 75 Ca -0.47 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.37 1lxa h LEU 75 Cb 1.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 1lxa h LEU 75 CO 0.66 0.14 -0.66 0.11 0.09 0.00 0.00 178.44 178.78 1lxa h LYS 76 N 0.00 0.00 -6.90 1.13 1.57 -1.98 -3.46 116.57 106.93 1lxa h LYS 76 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.24 1lxa h LYS 76 Cb 1.01 0.00 0.09 0.00 0.08 0.00 0.00 32.23 33.41 1lxa h LYS 76 CO 0.02 0.58 0.77 -0.47 -0.57 0.00 0.00 179.45 179.78 1lxa s TYR 77 N -2.91 2.72 -0.13 -1.35 5.04 -1.22 -4.95 117.35 114.55 1lxa s TYR 77 Ca 0.03 1.15 0.24 0.00 -2.44 0.00 0.00 57.07 56.04 1lxa s TYR 77 Cb 0.08 -3.96 0.47 0.00 0.35 0.00 0.00 41.96 38.90 1lxa s TYR 77 CO 0.76 -2.86 1.14 0.00 -1.34 0.00 0.00 175.55 173.26 1lxa n ALA 78 N 0.89 2.57 -0.42 3.97 0.00 -1.26 -4.97 120.51 121.29 1lxa n ALA 78 Ca 0.02 -2.60 0.00 0.00 0.00 0.00 0.00 53.44 50.86 1lxa n ALA 78 Cb 0.39 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1lxa n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lxa n GLY 79 N -0.08 0.76 3.76 0.00 0.00 -1.26 -5.03 105.19 103.34 1lxa n GLY 79 Ca 0.08 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 1lxa n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lxa s GLU 80 N -0.71 4.55 -0.90 1.61 8.01 -1.26 -4.87 118.70 125.13 1lxa s GLU 80 Ca 0.00 1.91 -0.13 0.00 0.01 0.00 0.00 54.97 56.75 1lxa s GLU 80 Cb 0.00 -3.14 -0.09 0.00 -4.31 0.00 0.00 34.13 26.59 1lxa s GLU 80 CO 0.00 0.10 2.05 -0.35 0.01 0.00 0.00 175.26 177.07 1lxa n PRO 81 N 1.05 1.91 -1.89 0.39 -0.04 -1.26 -4.92 135.00 130.24 1lxa n PRO 81 Ca -0.01 -1.70 -0.30 0.00 -0.04 0.00 0.00 63.50 61.46 1lxa n PRO 81 Cb 0.44 -2.71 0.07 0.00 -0.04 0.00 0.00 33.50 31.26 1lxa n PRO 81 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1lxa s THR 82 N 4.06 2.71 0.43 0.52 -4.23 -1.26 -4.95 115.64 112.92 1lxa s THR 82 Ca 0.48 0.23 0.06 0.00 -1.18 0.00 0.00 61.69 61.29 1lxa s THR 82 Cb 0.12 -3.23 -0.06 0.00 1.34 0.00 0.00 72.50 70.68 1lxa s THR 82 CO 0.03 -0.30 0.09 -0.13 -0.54 0.00 0.00 174.62 173.77 1lxa s ARG 83 N -5.47 2.10 -0.12 3.99 0.52 -0.73 -3.86 118.95 115.38 1lxa s ARG 83 Ca 0.60 -2.03 -0.05 0.00 -0.52 0.00 0.00 55.73 53.73 1lxa s ARG 83 Cb -0.11 -1.78 0.06 0.00 0.52 0.00 0.00 34.95 33.63 1lxa s ARG 83 CO 0.50 -0.13 0.26 0.08 0.02 0.00 0.00 175.30 176.04 1lxa s VAL 84 N -2.68 -0.22 -0.09 3.52 1.01 -1.05 -1.85 120.40 119.03 1lxa s VAL 84 Ca 0.35 0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.57 1lxa s VAL 84 Cb 0.06 -0.42 0.01 0.00 0.00 0.00 0.00 36.38 36.03 1lxa s VAL 84 CO 0.18 0.09 -0.19 -1.61 0.00 0.00 0.00 175.10 173.57 1lxa s GLU 85 N 1.82 2.45 -0.05 2.72 2.02 -0.44 -0.67 118.70 126.56 1lxa s GLU 85 Ca -0.04 -0.67 0.04 0.00 0.02 0.00 0.00 54.97 54.31 1lxa s GLU 85 Cb -0.11 -1.91 0.00 0.00 0.10 0.00 0.00 34.13 32.21 1lxa s GLU 85 CO -0.09 0.11 -0.16 0.42 0.02 0.00 0.00 175.26 175.56 1lxa s ILE 86 N 0.49 1.40 0.00 -1.63 1.01 0.71 -1.11 121.20 122.07 1lxa s ILE 86 Ca -0.17 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 59.80 1lxa s ILE 86 Cb -0.17 -1.22 0.00 0.00 0.01 0.00 0.00 42.46 41.08 1lxa s ILE 86 CO 0.07 0.41 0.00 0.61 0.00 0.00 0.00 174.94 176.02 1lxa n GLY 87 N 3.34 -1.14 3.34 6.18 0.00 0.35 -1.20 105.19 116.06 1lxa n GLY 87 Ca -0.19 -1.15 -0.20 0.00 0.00 0.00 0.00 46.02 44.48 1lxa n GLY 87 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1lxa s ASP 88 N -1.46 2.63 -1.19 1.61 1.01 -1.25 -2.25 116.67 115.78 1lxa s ASP 88 Ca 0.00 -0.96 0.00 0.00 0.71 0.00 0.00 52.55 52.30 1lxa s ASP 88 Cb 0.00 -0.15 0.00 0.00 1.01 0.00 0.00 42.92 43.78 1lxa s ASP 88 CO 0.00 -0.12 0.00 0.54 0.21 0.00 0.00 175.17 175.80 1lxa n ARG 89 N -0.14 -0.95 -2.56 8.23 1.74 -0.67 -0.38 116.66 121.94 1lxa n ARG 89 Ca -0.10 0.75 -0.27 0.00 -0.77 0.00 0.00 57.85 57.46 1lxa n ARG 89 Cb 0.59 -4.88 0.00 0.00 -1.02 0.00 0.00 32.46 27.16 1lxa n ARG 89 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1lxa s ASN 90 N -2.62 6.15 -0.26 0.55 0.01 -1.26 -3.69 114.94 113.82 1lxa s ASN 90 Ca 0.00 0.92 0.01 0.00 -0.71 0.00 0.00 52.86 53.08 1lxa s ASN 90 Cb 0.00 -2.17 0.07 0.00 0.41 0.00 0.00 41.25 39.56 1lxa s ASN 90 CO 0.00 -0.67 -0.03 -0.13 -1.51 0.00 0.00 177.10 174.76 1lxa s ARG 91 N -4.80 1.58 -0.32 -0.60 0.52 -0.71 -1.06 118.95 113.56 1lxa s ARG 91 Ca 0.49 -1.18 -0.06 0.00 -0.52 0.00 0.00 55.73 54.46 1lxa s ARG 91 Cb -0.10 -2.66 0.03 0.00 0.52 0.00 0.00 34.95 32.74 1lxa s ARG 91 CO 0.45 -0.69 0.08 0.42 0.02 0.00 0.00 175.30 175.58 1lxa s ILE 92 N 1.30 3.68 0.91 1.52 1.01 0.21 -1.91 121.20 127.91 1lxa s ILE 92 Ca -0.02 -1.07 -0.12 0.00 0.00 0.00 0.00 60.65 59.44 1lxa s ILE 92 Cb -0.19 -3.04 0.14 0.00 0.01 0.00 0.00 42.46 39.38 1lxa s ILE 92 CO -0.08 -0.10 1.14 -0.13 0.00 0.00 0.00 174.94 175.77 1lxa s ARG 93 N 1.40 1.14 0.50 2.79 1.81 -0.64 -0.21 118.95 125.73 1lxa s ARG 93 Ca -0.01 0.28 -0.21 0.00 -1.72 0.00 0.00 55.73 54.07 1lxa s ARG 93 Cb -0.19 -1.84 -0.09 0.00 -0.45 0.00 0.00 34.95 32.38 1lxa s ARG 93 CO 0.02 -2.19 0.87 0.39 -0.68 0.00 0.00 175.30 173.71 1lxa n GLU 94 N -3.76 1.01 -1.15 3.54 4.71 -1.26 -2.50 120.64 121.23 1lxa n GLU 94 Ca 0.07 0.37 -0.08 0.00 -0.01 0.00 0.00 57.16 57.51 1lxa n GLU 94 Cb 0.59 -1.97 -0.03 0.00 -1.01 0.00 0.00 31.44 29.02 1lxa n GLU 94 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 1lxa n SER 95 N 0.22 -5.09 -4.78 1.62 7.64 -1.11 -1.86 113.62 110.25 1lxa n SER 95 Ca 0.11 0.19 -0.34 0.00 1.01 0.00 0.00 58.87 59.84 1lxa n SER 95 Cb 0.43 -3.63 0.01 0.00 -1.01 0.00 0.00 64.21 60.01 1lxa n SER 95 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1lxa s VAL 96 N -1.57 3.36 -0.05 0.44 1.01 -1.04 -4.02 120.40 118.53 1lxa s VAL 96 Ca 0.00 0.74 0.02 0.00 0.00 0.00 0.00 61.98 62.74 1lxa s VAL 96 Cb 0.00 -3.26 0.02 0.00 0.00 0.00 0.00 36.38 33.14 1lxa s VAL 96 CO 0.00 -0.28 -0.08 0.42 0.00 0.00 0.00 175.10 175.15 1lxa s THR 97 N -2.09 0.81 -0.20 3.92 -4.23 -0.96 -1.07 115.64 111.82 1lxa s THR 97 Ca 0.69 -0.29 -0.03 0.00 -1.18 0.00 0.00 61.69 60.88 1lxa s THR 97 Cb -0.21 -0.77 0.06 0.00 1.34 0.00 0.00 72.50 72.92 1lxa s THR 97 CO 0.32 0.28 0.04 -0.63 -0.54 0.00 0.00 174.62 174.10 1lxa s ILE 98 N 0.76 0.49 0.07 2.99 1.01 -0.74 -0.38 121.20 125.39 1lxa s ILE 98 Ca -0.13 -0.57 -0.08 0.00 0.00 0.00 0.00 60.65 59.87 1lxa s ILE 98 Cb -0.15 -1.03 -0.05 0.00 0.01 0.00 0.00 42.46 41.24 1lxa s ILE 98 CO 0.02 -0.24 0.35 -1.00 0.00 0.00 0.00 174.94 174.07 1lxa s HIS 99 N 1.87 3.56 0.54 3.97 3.76 -0.77 -0.44 115.29 127.78 1lxa s HIS 99 Ca -0.00 0.67 -0.20 0.00 -0.15 0.00 0.00 55.06 55.38 1lxa s HIS 99 Cb -0.17 -2.07 -0.05 0.00 1.11 0.00 0.00 32.58 31.39 1lxa s HIS 99 CO -0.09 0.54 1.19 -0.98 -0.85 0.00 0.00 174.74 174.55 1lxa s ARG 100 N -1.99 3.29 1.07 1.40 1.70 0.63 -4.13 118.95 120.93 1lxa s ARG 100 Ca 0.32 1.79 -0.18 0.00 -0.47 0.00 0.00 55.73 57.19 1lxa s ARG 100 Cb -0.13 -2.10 0.27 0.00 -0.57 0.00 0.00 34.95 32.42 1lxa s ARG 100 CO 0.19 -0.94 0.81 0.41 -1.08 0.00 0.00 175.30 174.69 1lxa n GLY 101 N 0.41 -3.20 3.34 3.88 0.00 -1.08 -4.41 105.19 104.13 1lxa n GLY 101 Ca 0.11 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.42 1lxa n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lxa s THR 102 N -2.32 2.23 0.36 2.61 -4.23 -1.26 -4.70 115.64 108.33 1lxa s THR 102 Ca 0.56 -1.04 0.08 0.00 -1.18 0.00 0.00 61.69 60.11 1lxa s THR 102 Cb -0.07 -1.79 0.31 0.00 1.34 0.00 0.00 72.50 72.29 1lxa s THR 102 CO 0.45 0.58 1.90 -0.37 -0.54 0.00 0.00 174.62 176.64 1lxa h VAL 103 N 4.47 0.90 0.37 2.29 -1.51 -1.90 2.43 116.25 123.29 1lxa h VAL 103 Ca -0.44 -0.24 -0.02 0.00 -1.23 0.00 0.00 66.70 64.78 1lxa h VAL 103 Cb 1.13 0.13 0.00 0.00 -2.13 0.00 0.00 31.29 30.42 1lxa h VAL 103 CO 0.48 0.13 -0.18 1.56 -1.23 0.00 0.00 177.57 178.33 1lxa h GLN 104 N 0.70 -0.48 0.00 5.19 7.50 -2.00 -1.58 115.11 124.45 1lxa h GLN 104 Ca 0.40 0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.58 1lxa h GLN 104 Cb 0.57 0.11 0.00 0.00 0.05 0.00 0.00 27.48 28.21 1lxa h GLN 104 CO -0.16 -0.26 0.00 0.41 -1.50 0.00 0.00 178.83 177.32 1lxa n GLY 105 N -1.01 -0.91 0.00 3.46 0.00 -0.28 -4.76 105.19 101.69 1lxa n GLY 105 Ca -0.11 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1lxa n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lxa n GLY 106 N -0.57 0.83 2.61 -0.02 0.00 0.13 -4.77 105.19 103.41 1lxa n GLY 106 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 1lxa n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lxa n GLY 107 N 0.00 1.61 2.90 -0.02 0.00 0.77 -4.91 105.19 105.55 1lxa n GLY 107 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1lxa n GLY 107 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1lxa s LEU 108 N -3.93 0.12 -0.30 0.99 2.96 -1.26 -1.77 118.68 115.50 1lxa s LEU 108 Ca 0.00 0.38 -0.11 0.00 -0.22 0.00 0.00 54.13 54.18 1lxa s LEU 108 Cb 0.00 0.39 -0.03 0.00 0.50 0.00 0.00 46.19 47.05 1lxa s LEU 108 CO 0.00 -0.21 0.18 -0.89 -1.32 0.00 0.00 176.35 174.10 1lxa s THR 109 N 1.96 5.02 -0.01 3.68 2.01 -0.77 -4.29 115.64 123.23 1lxa s THR 109 Ca -0.01 -0.09 0.06 0.00 0.31 0.00 0.00 61.69 61.96 1lxa s THR 109 Cb -0.12 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.91 1lxa s THR 109 CO -0.06 0.16 -0.20 -0.75 -0.69 0.00 0.00 174.62 173.07 1lxa s LYS 110 N 1.70 1.64 -0.07 4.92 2.20 -0.01 -1.33 119.74 128.79 1lxa s LYS 110 Ca 0.06 -0.72 0.00 0.00 -0.36 0.00 0.00 55.97 54.95 1lxa s LYS 110 Cb -0.16 -1.58 0.02 0.00 -1.51 0.00 0.00 37.83 34.59 1lxa s LYS 110 CO 0.09 0.43 -0.06 0.08 -0.36 0.00 0.00 175.35 175.53 1lxa s VAL 111 N -0.48 0.75 0.00 4.02 1.01 -0.27 -0.04 120.40 125.40 1lxa s VAL 111 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.87 1lxa s VAL 111 Cb -0.08 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.53 1lxa s VAL 111 CO -0.01 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1lxa n GLY 112 N 4.44 -2.00 3.34 4.51 0.00 0.25 -0.49 105.19 115.23 1lxa n GLY 112 Ca -0.18 -0.89 -0.18 0.00 0.00 0.00 0.00 46.02 44.77 1lxa n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lxa s SER 113 N -1.65 2.13 -1.29 1.61 0.01 -1.18 -0.63 113.70 112.69 1lxa s SER 113 Ca 0.00 -1.16 -0.07 0.00 1.31 0.00 0.00 55.95 56.03 1lxa s SER 113 Cb 0.00 -0.05 0.05 0.00 0.21 0.00 0.00 66.02 66.23 1lxa s SER 113 CO 0.00 -0.41 0.44 0.47 0.41 0.00 0.00 173.24 174.15 1lxa n ASP 114 N -0.42 -4.16 -4.97 2.44 8.00 0.49 -1.18 116.55 116.76 1lxa n ASP 114 Ca -0.06 -0.28 -0.21 0.00 0.71 0.00 0.00 54.79 54.95 1lxa n ASP 114 Cb 0.63 -3.43 -0.00 0.00 -0.02 0.00 0.00 41.12 38.30 1lxa n ASP 114 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1lxa s ASN 115 N -2.61 5.98 -0.26 -2.24 0.01 -1.26 -2.71 114.94 111.84 1lxa s ASN 115 Ca 0.32 0.05 0.00 0.00 -0.71 0.00 0.00 52.86 52.53 1lxa s ASN 115 Cb -0.16 -1.46 0.07 0.00 0.41 0.00 0.00 41.25 40.11 1lxa s ASN 115 CO 0.40 -0.48 0.00 -0.22 -1.51 0.00 0.00 177.10 175.29 1lxa s LEU 116 N -4.30 2.62 -0.60 0.60 2.96 0.10 -1.73 118.68 118.33 1lxa s LEU 116 Ca 0.45 -1.36 -0.10 0.00 -0.22 0.00 0.00 54.13 52.89 1lxa s LEU 116 Cb -0.10 -1.10 0.15 0.00 0.50 0.00 0.00 46.19 45.65 1lxa s LEU 116 CO 0.34 -0.30 0.49 -0.76 -1.32 0.00 0.00 176.35 174.80 1lxa s LEU 117 N 1.43 5.97 1.06 -0.68 1.43 -0.80 0.52 118.68 127.61 1lxa s LEU 117 Ca 0.00 -2.24 -0.13 0.00 -1.03 0.00 0.00 54.13 50.73 1lxa s LEU 117 Cb -0.18 -2.07 0.22 0.00 0.03 0.00 0.00 46.19 44.19 1lxa s LEU 117 CO -0.11 -0.64 1.07 -0.04 0.23 0.00 0.00 176.35 176.87 1lxa s MET 118 N 0.87 -0.05 0.07 1.70 -1.94 0.80 -1.62 119.30 119.12 1lxa s MET 118 Ca 0.10 0.61 -0.37 0.00 -1.71 0.00 0.00 55.69 54.33 1lxa s MET 118 Cb -0.22 -1.67 -0.18 0.00 2.01 0.00 0.00 34.83 34.77 1lxa s MET 118 CO -0.03 -3.08 1.10 -0.89 -0.01 0.00 0.00 175.02 172.12 1lxa n ILE 119 N -4.43 0.34 -1.41 2.53 5.41 -1.26 -0.75 119.36 119.78 1lxa n ILE 119 Ca 0.04 -0.08 -0.14 0.00 1.00 0.00 0.00 62.75 63.57 1lxa n ILE 119 Cb 0.56 -0.35 -0.06 0.00 -0.71 0.00 0.00 39.64 39.09 1lxa n ILE 119 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1lxa n ASN 120 N 1.90 -5.57 -4.77 4.38 5.15 -0.78 0.22 115.26 115.79 1lxa n ASN 120 Ca 0.19 0.35 -0.37 0.00 -0.60 0.00 0.00 54.58 54.14 1lxa n ASN 120 Cb 0.15 -4.32 -0.01 0.00 -0.53 0.00 0.00 39.78 35.07 1lxa n ASN 120 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1lxa s ALA 121 N -2.24 3.05 -0.08 5.20 0.00 0.07 -3.77 121.76 123.99 1lxa s ALA 121 Ca 0.00 0.94 0.03 0.00 0.00 0.00 0.00 51.96 52.93 1lxa s ALA 121 Cb 0.00 -3.38 0.01 0.00 0.00 0.00 0.00 23.12 19.75 1lxa s ALA 121 CO 0.00 -0.60 -0.16 -1.58 0.00 0.00 0.00 175.76 173.43 1lxa s HIS 122 N -1.50 1.79 -0.25 0.00 2.46 0.53 -2.26 115.29 116.06 1lxa s HIS 122 Ca 0.61 -0.71 -0.01 0.00 0.47 0.00 0.00 55.06 55.43 1lxa s HIS 122 Cb -0.29 -1.27 0.03 0.00 -0.13 0.00 0.00 32.58 30.92 1lxa s HIS 122 CO 0.36 -0.33 -0.07 0.42 -2.47 0.00 0.00 174.74 172.65 1lxa s ILE 123 N 0.61 2.76 0.85 0.89 1.01 0.49 -0.74 121.20 127.07 1lxa s ILE 123 Ca -0.15 -1.14 -0.13 0.00 0.00 0.00 0.00 60.65 59.23 1lxa s ILE 123 Cb -0.16 -2.44 0.11 0.00 0.01 0.00 0.00 42.46 39.97 1lxa s ILE 123 CO 0.05 0.15 1.21 0.00 0.00 0.00 0.00 174.94 176.34 1lxa s ALA 124 N 1.29 2.52 0.32 9.38 0.00 -1.21 -1.86 121.76 132.19 1lxa s ALA 124 Ca -0.01 -0.75 -0.28 0.00 0.00 0.00 0.00 51.96 50.91 1lxa s ALA 124 Cb -0.17 -2.93 -0.13 0.00 0.00 0.00 0.00 23.12 19.89 1lxa s ALA 124 CO -0.05 -1.86 1.19 -2.39 0.00 0.00 0.00 175.76 172.65 1lxa n HIS 125 N -3.43 1.90 -1.98 0.00 1.44 -1.26 -2.26 115.22 109.63 1lxa n HIS 125 Ca 0.09 0.60 -0.17 0.00 -2.01 0.00 0.00 57.72 56.23 1lxa n HIS 125 Cb 0.61 -2.36 -0.04 0.00 0.12 0.00 0.00 29.99 28.32 1lxa n HIS 125 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1lxa n ASP 126 N 1.01 -5.09 -4.62 4.39 8.00 -1.26 -2.22 116.55 116.75 1lxa n ASP 126 Ca 0.07 0.17 -0.26 0.00 0.71 0.00 0.00 54.79 55.48 1lxa n ASP 126 Cb 0.34 -4.16 0.11 0.00 -0.02 0.00 0.00 41.12 37.40 1lxa n ASP 126 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lxa s THR 128 N -3.36 -0.15 -0.06 0.00 2.01 -0.33 -0.82 115.64 112.92 1lxa s THR 128 Ca 0.66 0.36 0.02 0.00 0.31 0.00 0.00 61.69 63.04 1lxa s THR 128 Cb -0.07 -0.20 0.01 0.00 0.01 0.00 0.00 72.50 72.26 1lxa s THR 128 CO 0.47 0.15 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.74 1lxa s VAL 129 N 2.01 1.04 0.00 3.82 1.01 0.95 -0.81 120.40 128.42 1lxa s VAL 129 Ca 0.02 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1lxa s VAL 129 Cb -0.12 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.30 1lxa s VAL 129 CO -0.04 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1lxa n GLY 130 N 3.78 -0.79 3.36 4.51 0.00 -0.62 0.85 105.19 116.28 1lxa n GLY 130 Ca -0.23 -1.13 -0.26 0.00 0.00 0.00 0.00 46.02 44.40 1lxa n GLY 130 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lxa s ASN 131 N -1.37 3.03 -1.45 1.61 0.01 -1.26 -2.14 114.94 113.37 1lxa s ASN 131 Ca 0.00 -0.76 -0.11 0.00 -0.71 0.00 0.00 52.86 51.28 1lxa s ASN 131 Cb 0.00 -0.19 0.05 0.00 0.41 0.00 0.00 41.25 41.52 1lxa s ASN 131 CO 0.00 0.11 1.05 0.54 -1.51 0.00 0.00 177.10 177.30 1lxa n ARG 132 N 0.82 -6.49 -3.51 -0.60 1.74 -0.32 -1.43 116.66 106.87 1lxa n ARG 132 Ca -0.17 0.69 -0.20 0.00 -0.77 0.00 0.00 57.85 57.40 1lxa n ARG 132 Cb 0.54 -5.64 -0.02 0.00 -1.02 0.00 0.00 32.46 26.32 1lxa n ARG 132 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lxa s ILE 134 N -2.38 -0.11 -0.22 0.00 1.01 -0.15 0.01 121.20 119.37 1lxa s ILE 134 Ca 0.47 0.29 -0.01 0.00 0.00 0.00 0.00 60.65 61.41 1lxa s ILE 134 Cb -0.06 -0.17 0.02 0.00 0.01 0.00 0.00 42.46 42.26 1lxa s ILE 134 CO 0.29 0.12 -0.11 -0.76 0.00 0.00 0.00 174.94 174.48 1lxa s LEU 135 N 1.61 2.72 1.03 2.97 1.43 0.19 0.54 118.68 129.15 1lxa s LEU 135 Ca -0.03 -0.70 -0.16 0.00 -1.03 0.00 0.00 54.13 52.21 1lxa s LEU 135 Cb -0.12 -1.60 0.22 0.00 0.03 0.00 0.00 46.19 44.71 1lxa s LEU 135 CO -0.04 -0.05 1.22 0.00 0.23 0.00 0.00 176.35 177.71 1lxa s ALA 136 N 1.34 1.66 -0.07 4.21 0.00 0.48 -0.14 121.76 129.23 1lxa s ALA 136 Ca 0.03 -1.01 -0.38 0.00 0.00 0.00 0.00 51.96 50.60 1lxa s ALA 136 Cb -0.15 -2.85 -0.15 0.00 0.00 0.00 0.00 23.12 19.97 1lxa s ALA 136 CO -0.08 -2.77 1.58 0.09 0.00 0.00 0.00 175.76 174.59 1lxa n ASN 137 N -4.08 2.28 0.00 0.00 4.13 -1.26 -0.45 115.26 115.88 1lxa n ASN 137 Ca 0.13 1.08 0.00 0.00 1.68 0.00 0.00 54.58 57.47 1lxa n ASN 137 Cb 0.59 -1.21 0.00 0.00 -1.54 0.00 0.00 39.78 37.62 1lxa n ASN 137 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1lxa n ASN 138 N 4.19 -2.59 -4.77 6.41 3.02 0.13 -0.35 115.26 121.31 1lxa n ASN 138 Ca 0.22 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.36 1lxa n ASN 138 Cb 0.19 -1.68 -0.01 0.00 -0.61 0.00 0.00 39.78 37.66 1lxa n ASN 138 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lxa s ALA 139 N -1.92 3.53 -0.07 5.41 0.00 0.40 -3.94 121.76 125.16 1lxa s ALA 139 Ca 0.00 1.36 0.01 0.00 0.00 0.00 0.00 51.96 53.33 1lxa s ALA 139 Cb 0.00 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.61 1lxa s ALA 139 CO 0.00 -0.78 -0.08 0.99 0.00 0.00 0.00 175.76 175.89 1lxa s THR 140 N -1.06 0.90 -0.13 0.00 2.01 0.60 -0.35 115.64 117.62 1lxa s THR 140 Ca 0.51 -0.29 -0.04 0.00 0.31 0.00 0.00 61.69 62.17 1lxa s THR 140 Cb -0.42 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.17 1lxa s THR 140 CO 0.55 0.32 0.03 -0.76 -0.69 0.00 0.00 174.62 174.08 1lxa s LEU 141 N 1.12 3.73 0.00 4.42 1.43 0.09 -1.02 118.68 128.45 1lxa s LEU 141 Ca -0.07 0.15 -0.09 0.00 -1.03 0.00 0.00 54.13 53.09 1lxa s LEU 141 Cb -0.14 -1.89 0.16 0.00 0.03 0.00 0.00 46.19 44.35 1lxa s LEU 141 CO -0.01 0.30 0.99 0.00 0.23 0.00 0.00 176.35 177.86 1lxa n ALA 142 N 2.66 -0.81 -1.70 4.21 0.00 -0.56 -3.35 120.51 120.96 1lxa n ALA 142 Ca -0.18 -1.45 -0.34 0.00 0.00 0.00 0.00 53.44 51.47 1lxa n ALA 142 Cb 0.53 0.03 0.01 0.00 0.00 0.00 0.00 19.45 20.03 1lxa n ALA 142 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1lxa s GLY 143 N -5.10 2.49 -1.86 0.00 0.00 -1.26 -3.37 107.32 98.22 1lxa s GLY 143 Ca 0.58 0.73 0.00 0.00 0.00 0.00 0.00 44.72 46.03 1lxa s GLY 143 CO 0.40 1.08 0.00 1.42 0.00 0.00 0.00 173.10 176.00 1lxa n HIS 144 N -1.61 -0.36 -3.39 1.90 8.25 -0.94 -1.87 115.22 117.19 1lxa n HIS 144 Ca 0.11 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.21 1lxa n HIS 144 Cb 0.51 -3.41 -0.06 0.00 1.12 0.00 0.00 29.99 28.15 1lxa n HIS 144 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1lxa s VAL 145 N -2.80 4.89 -0.13 1.59 1.01 -1.22 -2.94 120.40 120.80 1lxa s VAL 145 Ca 0.00 0.82 0.02 0.00 0.00 0.00 0.00 61.98 62.81 1lxa s VAL 145 Cb 0.00 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.66 1lxa s VAL 145 CO 0.00 0.31 -0.18 -0.44 0.00 0.00 0.00 175.10 174.78 1lxa s SER 146 N -1.61 2.82 -0.11 3.32 0.01 0.12 -1.19 113.70 117.05 1lxa s SER 146 Ca 0.35 -0.53 0.03 0.00 1.31 0.00 0.00 55.95 57.11 1lxa s SER 146 Cb -0.15 -1.29 0.00 0.00 0.21 0.00 0.00 66.02 64.79 1lxa s SER 146 CO 0.19 0.03 -0.22 -0.69 0.41 0.00 0.00 173.24 172.95 1lxa s VAL 147 N 1.01 1.98 0.37 3.43 1.01 0.01 0.55 120.40 128.76 1lxa s VAL 147 Ca -0.04 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.05 1lxa s VAL 147 Cb -0.15 -1.73 -0.00 0.00 0.00 0.00 0.00 36.38 34.50 1lxa s VAL 147 CO -0.04 0.54 0.52 -1.81 0.00 0.00 0.00 175.10 174.31 1lxa s ASP 148 N 0.54 5.83 0.14 3.32 1.11 -0.16 -1.59 116.67 125.88 1lxa s ASP 148 Ca -0.14 -0.28 -0.33 0.00 0.18 0.00 0.00 52.55 51.98 1lxa s ASP 148 Cb -0.17 -0.99 -0.17 0.00 1.07 0.00 0.00 42.92 42.66 1lxa s ASP 148 CO 0.05 -0.58 0.96 0.47 1.18 0.00 0.00 175.17 177.25 1lxa n ASP 149 N -1.74 0.31 0.00 0.27 9.92 -1.26 -1.51 116.55 122.54 1lxa n ASP 149 Ca 0.03 1.15 0.00 0.00 -0.53 0.00 0.00 54.79 55.44 1lxa n ASP 149 Cb 0.58 -1.07 0.00 0.00 -0.64 0.00 0.00 41.12 39.99 1lxa n ASP 149 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1lxa n PHE 150 N 1.03 0.00 -2.06 1.24 3.72 -0.51 0.03 117.46 120.90 1lxa n PHE 150 Ca 0.17 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.19 1lxa n PHE 150 Cb 0.21 -0.72 0.01 0.00 -0.94 0.00 0.00 39.48 38.04 1lxa n PHE 150 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1lxa s ALA 151 N -2.52 2.87 -0.09 4.37 0.00 -0.57 -4.10 121.76 121.72 1lxa s ALA 151 Ca 0.00 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.05 1lxa s ALA 151 Cb 0.00 -3.45 0.02 0.00 0.00 0.00 0.00 23.12 19.69 1lxa s ALA 151 CO 0.00 -0.96 -0.08 0.42 0.00 0.00 0.00 175.76 175.13 1lxa s ILE 152 N -1.47 0.99 -0.25 0.00 1.01 -0.51 -0.97 121.20 119.99 1lxa s ILE 152 Ca 0.68 -0.31 -0.01 0.00 0.00 0.00 0.00 60.65 61.01 1lxa s ILE 152 Cb -0.33 -0.98 0.03 0.00 0.01 0.00 0.00 42.46 41.20 1lxa s ILE 152 CO 0.39 0.35 -0.07 -0.63 0.00 0.00 0.00 174.94 174.98 1lxa s ILE 153 N 1.33 2.75 0.42 2.92 1.01 0.19 -0.94 121.20 128.88 1lxa s ILE 153 Ca -0.02 -1.14 -0.22 0.00 0.00 0.00 0.00 60.65 59.26 1lxa s ILE 153 Cb -0.14 -2.44 -0.12 0.00 0.01 0.00 0.00 42.46 39.78 1lxa s ILE 153 CO -0.04 0.15 0.60 0.61 0.00 0.00 0.00 174.94 176.27 1lxa n GLY 154 N 4.63 -1.33 3.76 6.18 0.00 0.32 -0.39 105.19 118.35 1lxa n GLY 154 Ca -0.16 0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 1lxa n GLY 154 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1lxa s GLY 155 N -0.93 2.63 -1.72 -0.02 0.00 -1.26 -2.81 107.32 103.20 1lxa s GLY 155 Ca 0.64 0.91 0.00 0.00 0.00 0.00 0.00 44.72 46.27 1lxa s GLY 155 CO 0.58 1.30 0.00 1.03 0.00 0.00 0.00 173.10 176.00 1lxa n MET 156 N -1.71 -1.55 -4.25 2.90 2.81 0.53 -1.36 117.12 114.49 1lxa n MET 156 Ca 0.13 0.98 -0.35 0.00 -1.81 0.00 0.00 57.70 56.64 1lxa n MET 156 Cb 0.50 -5.55 -0.09 0.00 -0.71 0.00 0.00 33.22 27.37 1lxa n MET 156 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1lxa s THR 157 N -2.96 4.57 -0.17 2.03 2.01 -1.12 -2.93 115.64 117.07 1lxa s THR 157 Ca 0.00 -0.14 -0.04 0.00 0.31 0.00 0.00 61.69 61.82 1lxa s THR 157 Cb 0.00 -2.95 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 1lxa s THR 157 CO 0.00 0.60 -0.03 0.00 -0.69 0.00 0.00 174.62 174.50 1lxa s ALA 158 N -0.81 2.98 -0.13 7.40 0.00 -0.85 -0.29 121.76 130.06 1lxa s ALA 158 Ca 0.13 -0.90 -0.02 0.00 0.00 0.00 0.00 51.96 51.17 1lxa s ALA 158 Cb -0.12 -1.62 -0.02 0.00 0.00 0.00 0.00 23.12 21.36 1lxa s ALA 158 CO 0.03 0.06 -0.07 0.08 0.00 0.00 0.00 175.76 175.86 1lxa s VAL 159 N 0.63 3.63 0.19 0.00 1.01 -0.19 -0.78 120.40 124.89 1lxa s VAL 159 Ca -0.02 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.20 1lxa s VAL 159 Cb -0.14 -2.55 -0.08 0.00 0.00 0.00 0.00 36.38 33.61 1lxa s VAL 159 CO 0.02 0.53 0.97 -1.00 0.00 0.00 0.00 175.10 175.62 1lxa s HIS 160 N 0.08 3.87 0.35 5.22 3.76 0.05 -1.50 115.29 127.12 1lxa s HIS 160 Ca -0.02 1.84 -0.25 0.00 -0.15 0.00 0.00 55.06 56.48 1lxa s HIS 160 Cb -0.14 -3.05 -0.14 0.00 1.11 0.00 0.00 32.58 30.36 1lxa s HIS 160 CO 0.03 0.24 0.59 0.00 -0.85 0.00 0.00 174.74 174.74 1lxa n GLN 161 N 2.06 0.55 -0.74 1.40 10.64 -1.26 -1.80 117.38 128.22 1lxa n GLN 161 Ca 0.00 0.20 0.00 0.00 -1.83 0.00 0.00 57.00 55.37 1lxa n GLN 161 Cb 0.48 -1.41 0.00 0.00 -0.86 0.00 0.00 30.24 28.44 1lxa n GLN 161 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1lxa n PHE 162 N -0.48 0.00 -2.35 2.61 3.72 -0.78 -4.95 117.46 115.23 1lxa n PHE 162 Ca 0.12 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.20 1lxa n PHE 162 Cb 0.35 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.80 1lxa n PHE 162 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1lxa s ILE 164 N -2.63 2.39 -0.26 0.00 1.01 -1.26 -0.71 121.20 119.74 1lxa s ILE 164 Ca 0.59 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 60.30 1lxa s ILE 164 Cb -0.10 -1.89 0.07 0.00 0.01 0.00 0.00 42.46 40.54 1lxa s ILE 164 CO 0.33 0.57 -0.04 -0.63 0.00 0.00 0.00 174.94 175.17 1lxa s ILE 165 N -0.32 1.73 0.98 2.92 1.01 0.19 -0.63 121.20 127.07 1lxa s ILE 165 Ca 0.02 -1.48 -0.15 0.00 0.00 0.00 0.00 60.65 59.04 1lxa s ILE 165 Cb -0.13 -2.02 -0.01 0.00 0.01 0.00 0.00 42.46 40.31 1lxa s ILE 165 CO 0.02 -0.20 0.02 0.61 0.00 0.00 0.00 174.94 175.39 1lxa n GLY 166 N 4.57 -2.75 3.77 6.18 0.00 0.28 -0.99 105.19 116.25 1lxa n GLY 166 Ca -0.09 -0.75 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 1lxa n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lxa s ALA 167 N -2.27 2.78 -0.66 4.61 0.00 -1.26 -3.22 121.76 121.73 1lxa s ALA 167 Ca 0.52 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.32 1lxa s ALA 167 Cb -0.19 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1lxa s ALA 167 CO 0.71 -0.71 0.00 0.72 0.00 0.00 0.00 175.76 176.49 1lxa n HIS 168 N -1.06 0.00 -2.54 0.00 8.25 0.10 -1.37 115.22 118.61 1lxa n HIS 168 Ca 0.10 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.25 1lxa n HIS 168 Cb 0.50 -2.10 -0.03 0.00 1.12 0.00 0.00 29.99 29.48 1lxa n HIS 168 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1lxa s VAL 169 N -1.72 4.61 -0.19 1.59 1.01 -1.20 -4.17 120.40 120.33 1lxa s VAL 169 Ca 0.00 1.04 0.00 0.00 0.00 0.00 0.00 61.98 63.02 1lxa s VAL 169 Cb 0.00 -3.72 0.05 0.00 0.00 0.00 0.00 36.38 32.71 1lxa s VAL 169 CO 0.00 -0.63 -0.06 -0.32 0.00 0.00 0.00 175.10 174.08 1lxa s MET 170 N -3.99 1.62 -0.29 2.72 1.75 -0.43 -1.42 119.30 119.26 1lxa s MET 170 Ca 0.57 -0.72 -0.09 0.00 -1.25 0.00 0.00 55.69 54.19 1lxa s MET 170 Cb -0.10 -2.28 -0.02 0.00 2.84 0.00 0.00 34.83 35.27 1lxa s MET 170 CO 0.31 -0.48 0.14 0.08 -0.65 0.00 0.00 175.02 174.42 1lxa s VAL 171 N 1.51 4.68 0.00 10.11 1.01 -0.12 -0.97 120.40 136.62 1lxa s VAL 171 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.73 1lxa s VAL 171 Cb -0.16 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 32.91 1lxa s VAL 171 CO -0.07 0.17 0.07 0.61 0.00 0.00 0.00 175.10 175.88 1lxa n GLY 172 N 4.98 -0.55 0.00 4.51 0.00 -0.89 0.12 105.19 113.37 1lxa n GLY 172 Ca -0.14 0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1lxa n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lxa n GLY 173 N -0.45 4.16 2.30 -0.02 0.00 -1.26 -4.01 105.19 105.90 1lxa n GLY 173 Ca 0.00 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 1lxa n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lxa s SER 175 N -2.59 3.60 -0.10 0.00 0.01 -1.25 -4.28 113.70 109.09 1lxa s SER 175 Ca 0.05 -1.10 -0.01 0.00 1.31 0.00 0.00 55.95 56.20 1lxa s SER 175 Cb -0.02 -0.31 0.03 0.00 0.21 0.00 0.00 66.02 65.92 1lxa s SER 175 CO 0.07 -0.07 -0.05 -0.83 0.41 0.00 0.00 173.24 172.76 1lxa s GLY 176 N -3.54 0.74 -0.32 3.44 0.00 -1.22 -2.01 107.32 104.41 1lxa s GLY 176 Ca 0.31 -0.45 -0.04 0.00 0.00 0.00 0.00 44.72 44.53 1lxa s GLY 176 CO 0.15 0.90 0.06 0.14 0.00 0.00 0.00 173.10 174.36 1lxa s VAL 177 N 1.78 3.45 -0.37 1.40 1.01 0.04 -1.08 120.40 126.63 1lxa s VAL 177 Ca 0.05 -1.23 0.16 0.00 0.00 0.00 0.00 61.98 60.96 1lxa s VAL 177 Cb -0.13 -2.96 -0.22 0.00 0.00 0.00 0.00 36.38 33.07 1lxa s VAL 177 CO -0.07 -0.14 0.52 0.00 0.00 0.00 0.00 175.10 175.40 1lxa n ALA 178 N 4.73 3.31 -2.55 5.51 0.00 -1.26 -0.77 120.51 129.49 1lxa n ALA 178 Ca -0.13 -0.43 -0.26 0.00 0.00 0.00 0.00 53.44 52.63 1lxa n ALA 178 Cb 0.44 -0.58 -0.09 0.00 0.00 0.00 0.00 19.45 19.22 1lxa n ALA 178 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1lxa s GLN 179 N -2.87 1.89 0.47 0.00 -0.21 -1.26 -4.93 119.66 112.75 1lxa s GLN 179 Ca -0.00 -2.12 -0.22 0.00 0.02 0.00 0.00 55.36 53.03 1lxa s GLN 179 Cb 0.11 -1.01 -0.07 0.00 1.00 0.00 0.00 33.01 33.05 1lxa s GLN 179 CO 0.68 -0.30 1.16 -0.51 -2.12 0.00 0.00 175.29 174.20 1lxa s ASP 180 N -3.63 6.10 -0.36 5.90 1.01 0.34 -4.65 116.67 121.37 1lxa s ASP 180 Ca 0.26 2.28 -0.00 0.00 0.71 0.00 0.00 52.55 55.81 1lxa s ASP 180 Cb 0.06 -2.60 0.10 0.00 1.01 0.00 0.00 42.92 41.48 1lxa s ASP 180 CO 0.13 -0.97 0.11 -0.69 0.21 0.00 0.00 175.17 173.96 1lxa s VAL 181 N -1.58 2.85 0.58 -1.27 1.01 0.19 -2.15 120.40 120.03 1lxa s VAL 181 Ca 0.65 -2.03 -0.19 0.00 0.00 0.00 0.00 61.98 60.40 1lxa s VAL 181 Cb -0.28 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.11 1lxa s VAL 181 CO 0.33 -0.54 1.04 -0.81 0.00 0.00 0.00 175.10 175.12 1lxa n PRO 182 N 4.48 1.06 -1.55 2.72 -0.04 -1.26 0.99 135.00 141.38 1lxa n PRO 182 Ca -0.02 0.40 -0.39 0.00 -0.04 0.00 0.00 63.50 63.45 1lxa n PRO 182 Cb 0.42 -2.24 0.03 0.00 -0.04 0.00 0.00 33.50 31.67 1lxa n PRO 182 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1lxa n PRO 183 N -0.97 0.90 -0.62 0.54 -0.04 -1.26 -3.27 135.00 130.28 1lxa n PRO 183 Ca 0.13 0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 1lxa n PRO 183 Cb 0.46 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 1lxa n PRO 183 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1lxa n TYR 184 N -1.23 0.00 -3.33 0.54 4.01 -0.47 -4.94 117.16 111.74 1lxa n TYR 184 Ca 0.11 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.62 1lxa n TYR 184 Cb 0.44 -0.80 -0.01 0.00 -0.31 0.00 0.00 39.34 38.66 1lxa n TYR 184 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1lxa s VAL 185 N -2.26 4.77 -0.12 -0.72 -7.23 -1.20 0.14 120.40 113.78 1lxa s VAL 185 Ca 0.00 -0.55 -0.02 0.00 -1.81 0.00 0.00 61.98 59.59 1lxa s VAL 185 Cb 0.00 -3.73 -0.03 0.00 0.56 0.00 0.00 36.38 33.18 1lxa s VAL 185 CO 0.00 -0.46 -0.03 -0.63 -0.31 0.00 0.00 175.10 173.67 1lxa s ILE 186 N -2.34 3.95 0.23 -0.62 1.01 0.52 -1.32 121.20 122.63 1lxa s ILE 186 Ca 0.42 -0.36 0.10 0.00 0.00 0.00 0.00 60.65 60.82 1lxa s ILE 186 Cb -0.10 -2.69 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 1lxa s ILE 186 CO 0.36 0.54 -0.20 0.00 0.00 0.00 0.00 174.94 175.64 1lxa s ALA 187 N -0.15 2.44 0.02 9.38 0.00 -0.15 -0.47 121.76 132.84 1lxa s ALA 187 Ca 0.03 -1.72 -0.27 0.00 0.00 0.00 0.00 51.96 50.00 1lxa s ALA 187 Cb -0.13 -0.23 0.09 0.00 0.00 0.00 0.00 23.12 22.85 1lxa s ALA 187 CO 0.02 0.27 0.77 -0.65 0.00 0.00 0.00 175.76 176.17 1lxa s GLN 188 N -3.22 0.98 0.00 0.00 -1.52 -0.32 -2.09 119.66 113.50 1lxa s GLN 188 Ca 0.24 -0.20 0.00 0.00 -1.95 0.00 0.00 55.36 53.45 1lxa s GLN 188 Cb -0.05 0.46 0.00 0.00 -0.22 0.00 0.00 33.01 33.20 1lxa s GLN 188 CO 0.11 -0.40 0.00 0.41 -0.25 0.00 0.00 175.29 175.16 1lxa n GLY 189 N 0.05 -2.42 3.56 3.09 0.00 -1.26 0.10 105.19 108.31 1lxa n GLY 189 Ca -0.13 -1.47 -0.24 0.00 0.00 0.00 0.00 46.02 44.18 1lxa n GLY 189 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lxa s ASN 190 N -4.10 4.91 0.00 1.61 0.01 -1.26 -0.21 114.94 115.90 1lxa s ASN 190 Ca 0.00 -0.56 0.00 0.00 -0.71 0.00 0.00 52.86 51.59 1lxa s ASN 190 Cb 0.00 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 39.10 1lxa s ASN 190 CO 0.00 -2.96 0.00 1.41 -1.51 0.00 0.00 177.10 174.04 1lxa n HIS 191 N 14.84 0.00 -1.73 2.20 8.25 -1.09 -4.89 115.22 132.79 1lxa n HIS 191 Ca 0.41 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.49 1lxa n HIS 191 Cb 0.46 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.62 1lxa n HIS 191 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1lxa n ALA 192 N 0.16 1.43 -2.74 -1.41 0.00 0.70 -4.90 120.51 113.75 1lxa n ALA 192 Ca 0.00 0.10 -0.17 0.00 0.00 0.00 0.00 53.44 53.37 1lxa n ALA 192 Cb 0.00 -2.34 -0.13 0.00 0.00 0.00 0.00 19.45 16.98 1lxa n ALA 192 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1lxa s THR 193 N -1.31 0.79 0.34 0.00 -4.23 0.28 -4.42 115.64 107.09 1lxa s THR 193 Ca 0.74 -0.90 -0.28 0.00 -1.18 0.00 0.00 61.69 60.06 1lxa s THR 193 Cb -0.41 -0.76 -0.10 0.00 1.34 0.00 0.00 72.50 72.57 1lxa s THR 193 CO 0.47 -0.12 1.32 -2.16 -0.54 0.00 0.00 174.62 173.60 1lxa s PRO 194 N -1.13 4.31 0.00 3.99 0.04 -1.26 -1.17 135.00 139.77 1lxa s PRO 194 Ca -0.02 2.24 0.04 0.00 0.04 0.00 0.00 61.00 63.29 1lxa s PRO 194 Cb -0.08 -3.04 -0.02 0.00 0.04 0.00 0.00 34.50 31.40 1lxa s PRO 194 CO 0.01 -0.23 0.30 1.19 0.04 0.00 0.00 177.00 178.30 1lxa n PHE 195 N 0.73 0.00 0.00 0.56 3.01 0.38 -4.92 117.46 117.21 1lxa n PHE 195 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1lxa n PHE 195 Cb 0.42 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.89 1lxa n PHE 195 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1lxa n GLY 196 N 0.82 0.68 3.71 1.37 0.00 -1.25 -4.93 105.19 105.60 1lxa n GLY 196 Ca 0.01 -2.14 -0.39 0.00 0.00 0.00 0.00 46.02 43.50 1lxa n GLY 196 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lxa s VAL 197 N -1.08 5.08 -0.73 1.61 1.01 -1.26 -0.36 120.40 124.66 1lxa s VAL 197 Ca 0.00 1.29 -0.15 0.00 0.00 0.00 0.00 61.98 63.13 1lxa s VAL 197 Cb 0.00 -3.97 -0.12 0.00 0.00 0.00 0.00 36.38 32.29 1lxa s VAL 197 CO 0.00 0.25 1.92 -3.20 0.00 0.00 0.00 175.10 174.07 1lxa n ASN 198 N 3.90 3.20 -0.16 3.32 4.05 0.37 -4.68 115.26 125.26 1lxa n ASN 198 Ca -0.03 -2.49 -0.04 0.00 0.45 0.00 0.00 54.58 52.48 1lxa n ASN 198 Cb 0.51 -1.03 0.02 0.00 1.23 0.00 0.00 39.78 40.51 1lxa n ASN 198 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 1lxa h ILE 199 N 4.07 0.36 -0.70 -1.44 2.04 -1.93 -2.36 117.51 117.55 1lxa h ILE 199 Ca 0.41 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.43 1lxa h ILE 199 Cb 0.43 0.36 -0.12 0.00 -0.74 0.00 0.00 36.82 36.75 1lxa h ILE 199 CO 1.71 0.00 -0.05 -0.08 0.00 0.00 0.00 178.15 179.72 1lxa h GLU 200 N -0.10 0.07 -0.22 2.37 4.81 -1.99 0.11 114.58 119.63 1lxa h GLU 200 Ca 0.23 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.44 1lxa h GLU 200 Cb 0.46 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1lxa h GLU 200 CO -0.56 0.05 0.06 0.78 -0.73 0.00 0.00 179.01 178.61 1lxa h GLY 201 N 0.07 0.38 0.68 1.92 0.00 -1.82 0.09 103.07 104.38 1lxa h GLY 201 Ca 0.37 -0.23 0.09 0.00 0.00 0.00 0.00 47.33 47.56 1lxa h GLY 201 CO -0.65 0.21 0.62 1.41 0.00 0.00 0.00 176.54 178.13 1lxa h LEU 202 N 0.19 0.93 0.55 3.11 3.38 -1.10 0.57 115.31 122.93 1lxa h LEU 202 Ca 0.07 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1lxa h LEU 202 Cb 0.25 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1lxa h LEU 202 CO -0.00 0.56 -0.32 0.50 0.09 0.00 0.00 178.44 179.26 1lxa h LYS 203 N 1.03 -0.78 -0.25 1.13 3.64 -0.44 -1.76 116.57 119.14 1lxa h LYS 203 Ca 0.44 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.94 1lxa h LYS 203 Cb 0.32 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1lxa h LYS 203 CO -0.19 -0.52 0.24 0.00 -2.27 0.00 0.00 179.45 176.70 1lxa h ARG 204 N -0.81 0.00 0.00 1.90 3.08 -0.33 -2.31 114.38 115.91 1lxa h ARG 204 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1lxa h ARG 204 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1lxa h ARG 204 CO 0.08 0.00 -0.38 0.00 -1.07 0.00 0.00 179.97 178.60 1lxa h ARG 205 N 0.00 0.00 0.00 0.04 3.08 0.39 -3.48 114.38 114.41 1lxa h ARG 205 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1lxa h ARG 205 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 1lxa h ARG 205 CO -0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1lxa n GLY 206 N 1.22 0.86 3.78 0.04 0.00 -0.87 -5.07 105.19 105.15 1lxa n GLY 206 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1lxa n GLY 206 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lxa s PHE 207 N -2.00 2.54 0.77 1.61 0.40 -0.70 -4.99 117.98 115.61 1lxa s PHE 207 Ca 0.00 1.18 -0.11 0.00 -0.60 0.00 0.00 56.93 57.40 1lxa s PHE 207 Cb 0.00 -4.02 0.05 0.00 0.51 0.00 0.00 43.02 39.56 1lxa s PHE 207 CO 0.00 -3.04 1.09 -1.54 0.70 0.00 0.00 175.22 172.43 1lxa s SER 208 N -0.20 4.53 0.39 1.36 1.04 -1.26 -4.77 113.70 114.79 1lxa s SER 208 Ca 0.55 1.83 0.10 0.00 0.48 0.00 0.00 55.95 58.90 1lxa s SER 208 Cb -0.46 -2.52 0.80 0.00 0.10 0.00 0.00 66.02 63.93 1lxa s SER 208 CO 0.62 -2.02 1.92 0.08 0.98 0.00 0.00 173.24 174.82 1lxa h ARG 209 N -1.09 0.21 -0.43 4.02 0.11 -1.98 -1.63 114.38 113.58 1lxa h ARG 209 Ca -0.44 -0.05 -0.03 0.00 0.10 0.00 0.00 59.98 59.57 1lxa h ARG 209 Cb 1.23 -0.03 -0.02 0.00 1.11 0.00 0.00 29.97 32.26 1lxa h ARG 209 CO 0.51 0.36 0.16 0.93 0.10 0.00 0.00 179.97 182.04 1lxa h GLU 210 N 0.20 0.65 -0.40 0.08 3.07 -1.98 -0.52 114.58 115.67 1lxa h GLU 210 Ca 0.04 -0.12 -0.10 0.00 -0.50 0.00 0.00 59.36 58.68 1lxa h GLU 210 Cb 0.38 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1lxa h GLU 210 CO 0.02 0.61 -0.12 0.00 -1.40 0.00 0.00 179.01 178.12 1lxa h ALA 211 N 1.01 0.56 0.00 3.43 0.00 -1.89 0.72 119.26 123.08 1lxa h ALA 211 Ca 0.14 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1lxa h ALA 211 Cb 0.21 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1lxa h ALA 211 CO -0.01 0.45 -0.05 0.82 0.00 0.00 0.00 179.25 180.47 1lxa h ILE 212 N 0.61 0.82 0.12 0.00 2.04 -1.06 1.24 117.51 121.28 1lxa h ILE 212 Ca 0.10 -0.17 -0.32 0.00 1.00 0.00 0.00 64.86 65.47 1lxa h ILE 212 Cb 0.66 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1lxa h ILE 212 CO 0.04 0.04 -1.71 0.74 0.00 0.00 0.00 178.15 177.27 1lxa h THR 213 N 0.00 0.82 -0.58 -0.27 2.02 -0.61 -2.66 112.91 111.63 1lxa h THR 213 Ca -0.00 -2.36 0.10 0.00 0.77 0.00 0.00 66.41 64.92 1lxa h THR 213 Cb 0.09 2.57 -0.08 0.00 -1.74 0.00 0.00 68.15 68.99 1lxa h THR 213 CO 0.01 0.77 0.14 0.00 0.37 0.00 0.00 175.52 176.81 1lxa h ALA 214 N -0.03 0.70 -0.37 6.16 0.00 0.12 0.14 119.26 125.98 1lxa h ALA 214 Ca -0.37 0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.71 1lxa h ALA 214 Cb 1.88 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.76 1lxa h ALA 214 CO 0.06 -0.28 0.08 0.82 0.00 0.00 0.00 179.25 179.92 1lxa h ILE 215 N 0.29 0.82 -0.81 0.00 2.04 0.15 -1.58 117.51 118.42 1lxa h ILE 215 Ca 0.30 -0.07 0.10 0.00 1.00 0.00 0.00 64.86 66.19 1lxa h ILE 215 Cb 0.42 0.60 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 1lxa h ILE 215 CO -0.37 0.04 0.53 0.03 0.00 0.00 0.00 178.15 178.38 1lxa h ARG 216 N 0.20 0.72 -0.17 2.37 3.08 -0.87 -1.78 114.38 117.95 1lxa h ARG 216 Ca 0.18 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 60.08 1lxa h ARG 216 Cb 0.20 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1lxa h ARG 216 CO -0.23 0.48 -0.29 -0.91 -1.07 0.00 0.00 179.97 177.96 1lxa h ASN 217 N 0.74 0.54 -0.31 7.04 2.35 -0.07 -2.81 115.58 123.06 1lxa h ASN 217 Ca 0.38 -0.54 0.06 0.00 -0.55 0.00 0.00 56.30 55.65 1lxa h ASN 217 Cb 0.46 -0.15 -0.06 0.00 0.05 0.00 0.00 38.32 38.61 1lxa h ASN 217 CO -0.15 0.97 -0.09 0.00 -1.65 0.00 0.00 177.43 176.51 1lxa h ALA 218 N 0.58 0.18 -0.58 -0.83 0.00 -0.88 0.57 119.26 118.32 1lxa h ALA 218 Ca 0.01 0.12 0.11 0.00 0.00 0.00 0.00 54.91 55.16 1lxa h ALA 218 Cb 0.87 0.26 -0.09 0.00 0.00 0.00 0.00 17.79 18.83 1lxa h ALA 218 CO 0.06 -0.48 0.04 -0.92 0.00 0.00 0.00 179.25 177.95 1lxa h TYR 219 N -0.02 0.03 0.41 0.00 3.20 -1.27 0.02 116.97 119.34 1lxa h TYR 219 Ca 0.15 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 1lxa h TYR 219 Cb 0.25 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1lxa h TYR 219 CO -0.31 -0.11 -0.31 0.87 -1.64 0.00 0.00 178.16 176.66 1lxa h LYS 220 N 0.15 -0.69 -0.98 1.82 1.57 -1.06 0.30 116.57 117.69 1lxa h LYS 220 Ca 0.30 0.05 0.33 0.00 -1.87 0.00 0.00 60.65 59.46 1lxa h LYS 220 Cb 0.47 0.16 -0.17 0.00 0.08 0.00 0.00 32.23 32.76 1lxa h LYS 220 CO -0.46 -0.46 0.35 -0.07 -0.57 0.00 0.00 179.45 178.24 1lxa h LEU 221 N -0.71 0.08 0.31 2.94 3.38 -0.03 2.63 115.31 123.91 1lxa h LEU 221 Ca -0.04 0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 1lxa h LEU 221 Cb 0.61 0.31 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1lxa h LEU 221 CO 0.00 -0.32 -0.15 0.40 0.09 0.00 0.00 178.44 178.46 1lxa h ILE 222 N 0.09 0.02 0.00 1.22 2.04 0.26 -3.24 117.51 117.90 1lxa h ILE 222 Ca 0.71 -0.70 -0.13 0.00 1.00 0.00 0.00 64.86 65.75 1lxa h ILE 222 Cb 1.69 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1lxa h ILE 222 CO -0.77 0.01 -1.43 -1.22 0.00 0.00 0.00 178.15 174.73 1lxa n TYR 223 N -5.06 0.83 -0.07 1.37 4.01 0.94 -4.49 117.16 114.70 1lxa n TYR 223 Ca -0.05 0.27 -0.03 0.00 -0.16 0.00 0.00 57.90 57.93 1lxa n TYR 223 Cb 0.17 -1.00 -0.16 0.00 -0.31 0.00 0.00 39.34 38.04 1lxa n TYR 223 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1lxa n ARG 224 N -2.77 0.77 -0.35 -0.72 1.74 0.87 -4.49 116.66 111.71 1lxa n ARG 224 Ca -0.08 -0.07 0.11 0.00 -0.77 0.00 0.00 57.85 57.04 1lxa n ARG 224 Cb 0.77 -1.50 0.30 0.00 -1.02 0.00 0.00 32.46 31.01 1lxa n ARG 224 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1lxa h SER 225 N 0.00 0.76 0.00 0.55 4.64 -1.20 -3.45 113.55 114.85 1lxa h SER 225 Ca -0.34 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1lxa h SER 225 Cb 1.76 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.80 1lxa h SER 225 CO 0.02 0.29 0.00 0.61 -0.87 0.00 0.00 176.83 176.88 1lxa n GLY 226 N -1.33 0.71 3.94 -0.77 0.00 -1.26 -5.02 105.19 101.46 1lxa n GLY 226 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 1lxa n GLY 226 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lxa s LYS 227 N -0.18 3.25 0.09 1.61 1.02 -1.26 -5.08 119.74 119.18 1lxa s LYS 227 Ca 0.00 -0.31 -0.10 0.00 0.02 0.00 0.00 55.97 55.58 1lxa s LYS 227 Cb 0.00 -2.54 -0.06 0.00 -0.52 0.00 0.00 37.83 34.71 1lxa s LYS 227 CO 0.00 -0.16 0.42 0.95 -0.92 0.00 0.00 175.35 175.63 1lxa s THR 228 N -2.54 5.07 0.22 2.17 -4.23 -1.26 -4.92 115.64 110.15 1lxa s THR 228 Ca 0.46 0.46 -0.01 0.00 -1.18 0.00 0.00 61.69 61.42 1lxa s THR 228 Cb -0.10 -3.65 0.32 0.00 1.34 0.00 0.00 72.50 70.41 1lxa s THR 228 CO 0.39 0.26 1.15 -0.11 -0.54 0.00 0.00 174.62 175.77 1lxa n LEU 229 N 0.82 -0.15 0.04 4.79 7.94 -1.26 0.27 117.00 129.45 1lxa n LEU 229 Ca -0.07 1.26 0.20 0.00 -1.11 0.00 0.00 56.01 56.29 1lxa n LEU 229 Cb 0.52 -0.43 0.73 0.00 0.53 0.00 0.00 43.42 44.77 1lxa n LEU 229 CO 0.43 -1.25 1.18 0.44 -1.11 0.00 0.00 177.39 177.08 1lxa h ASP 230 N 0.00 0.00 0.77 1.96 5.19 -2.01 0.38 116.42 122.71 1lxa h ASP 230 Ca 0.41 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.63 1lxa h ASP 230 Cb 0.78 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.25 1lxa h ASP 230 CO -0.72 0.00 -1.34 -0.33 -3.12 0.00 0.00 179.24 173.73 1lxa h GLU 231 N 0.00 0.00 0.08 3.56 5.08 0.35 -3.39 114.58 120.27 1lxa h GLU 231 Ca 0.22 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.24 1lxa h GLU 231 Cb 1.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.22 1lxa h GLU 231 CO -0.00 0.42 -1.96 1.33 -1.00 0.00 0.00 179.01 177.80 1lxa n VAL 232 N -3.00 1.71 -0.11 3.13 0.24 0.05 -4.44 118.33 115.91 1lxa n VAL 232 Ca -0.09 -0.69 -0.03 0.00 -2.04 0.00 0.00 64.34 61.48 1lxa n VAL 232 Cb 0.88 -1.50 -0.03 0.00 -1.47 0.00 0.00 33.84 31.73 1lxa n VAL 232 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1lxa n LYS 233 N -3.34 -0.12 -0.30 7.34 5.02 0.11 0.18 118.16 127.07 1lxa n LYS 233 Ca -0.29 0.57 0.07 0.00 -2.02 0.00 0.00 58.31 56.64 1lxa n LYS 233 Cb 1.05 -0.84 0.22 0.00 -0.02 0.00 0.00 35.03 35.43 1lxa n LYS 233 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1lxa h PRO 234 N 0.00 0.63 -0.53 1.97 0.13 -1.83 -0.91 132.00 131.46 1lxa h PRO 234 Ca 0.04 -0.04 0.09 0.00 -0.87 0.00 0.00 66.00 65.23 1lxa h PRO 234 Cb 0.11 -0.14 -0.07 0.00 0.13 0.00 0.00 31.00 31.02 1lxa h PRO 234 CO -0.25 0.41 0.12 0.93 -0.23 0.00 0.00 178.00 178.98 1lxa h GLU 235 N 0.64 0.25 -0.07 0.86 5.08 0.18 -1.96 114.58 119.55 1lxa h GLU 235 Ca 0.46 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1lxa h GLU 235 Cb 0.62 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 1lxa h GLU 235 CO -0.35 0.17 0.03 0.82 -1.00 0.00 0.00 179.01 178.68 1lxa h ILE 236 N 0.26 1.12 -0.68 3.13 2.04 -0.58 -2.48 117.51 120.32 1lxa h ILE 236 Ca 0.27 -0.37 0.13 0.00 1.00 0.00 0.00 64.86 65.89 1lxa h ILE 236 Cb 0.37 1.24 -0.13 0.00 -0.74 0.00 0.00 36.82 37.55 1lxa h ILE 236 CO -0.34 0.11 -0.26 0.00 0.00 0.00 0.00 178.15 177.65 1lxa h ALA 237 N 0.89 0.23 0.05 1.87 0.00 -0.63 0.34 119.26 122.01 1lxa h ALA 237 Ca 0.03 0.23 0.01 0.00 0.00 0.00 0.00 54.91 55.18 1lxa h ALA 237 Cb 0.14 0.68 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 1lxa h ALA 237 CO -0.00 -0.54 -0.41 0.93 0.00 0.00 0.00 179.25 179.23 1lxa h GLU 238 N -0.07 -0.53 -1.04 0.00 5.08 -1.30 -0.71 114.58 116.02 1lxa h GLU 238 Ca 0.30 0.04 0.29 0.00 -1.00 0.00 0.00 59.36 58.98 1lxa h GLU 238 Cb 0.55 0.12 -0.12 0.00 0.50 0.00 0.00 28.75 29.79 1lxa h GLU 238 CO -0.73 -0.35 0.62 1.25 -1.00 0.00 0.00 179.01 178.80 1lxa h LEU 239 N -0.55 0.55 -1.45 1.33 5.85 -0.60 1.18 115.31 121.62 1lxa h LEU 239 Ca 0.00 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1lxa h LEU 239 Cb 0.57 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1lxa h LEU 239 CO -0.24 0.01 0.00 0.00 -0.34 0.00 0.00 178.44 177.87 1lxa h ALA 240 N 1.73 1.00 0.00 1.25 0.00 0.11 -0.65 119.26 122.71 1lxa h ALA 240 Ca 0.67 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.57 1lxa h ALA 240 Cb 1.52 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 1lxa h ALA 240 CO -0.47 0.00 -0.04 0.93 0.00 0.00 0.00 179.25 179.67 1lxa h GLU 241 N 0.00 0.00 0.00 0.00 4.39 0.17 -3.28 114.58 115.86 1lxa h GLU 241 Ca 0.00 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.46 1lxa h GLU 241 Cb 0.21 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.81 1lxa h GLU 241 CO 0.00 0.04 -1.90 2.41 -1.16 0.00 0.00 179.01 178.41 1lxa n THR 242 N -3.15 0.90 -3.95 1.13 -1.04 -0.64 -4.87 114.28 102.65 1lxa n THR 242 Ca 0.01 -0.40 -0.34 0.00 -2.04 0.00 0.00 64.05 61.28 1lxa n THR 242 Cb 0.34 -0.96 -0.14 0.00 -1.82 0.00 0.00 70.33 67.75 1lxa n THR 242 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1lxa s TYR 243 N -2.31 3.27 0.22 -1.42 2.02 -0.34 -5.00 117.35 113.79 1lxa s TYR 243 Ca -0.18 -2.00 -0.02 0.00 -0.37 0.00 0.00 57.07 54.50 1lxa s TYR 243 Cb 0.05 -2.08 0.22 0.00 -0.40 0.00 0.00 41.96 39.74 1lxa s TYR 243 CO 0.40 -0.83 1.62 -1.35 -1.57 0.00 0.00 175.55 173.82 1lxa h PRO 244 N 7.94 0.65 -0.99 -1.71 0.11 -1.85 -3.14 132.00 133.01 1lxa h PRO 244 Ca -0.20 -0.29 0.29 0.00 0.11 0.00 0.00 66.00 65.90 1lxa h PRO 244 Cb 1.06 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 1lxa h PRO 244 CO 0.52 0.88 0.77 0.93 -0.21 0.00 0.00 178.00 180.89 1lxa h GLU 245 N 0.55 0.00 -0.07 1.05 3.07 -1.94 0.21 114.58 117.45 1lxa h GLU 245 Ca 0.06 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.78 1lxa h GLU 245 Cb 0.81 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.71 1lxa h GLU 245 CO 0.07 0.00 -0.61 0.28 -1.40 0.00 0.00 179.01 177.35 1lxa h VAL 246 N 0.00 1.39 -1.07 3.13 2.07 -1.88 -3.09 116.25 116.80 1lxa h VAL 246 Ca 0.47 -2.00 0.31 0.00 0.82 0.00 0.00 66.70 66.30 1lxa h VAL 246 Cb 2.00 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 33.75 1lxa h VAL 246 CO -0.00 0.59 0.82 0.50 0.02 0.00 0.00 177.57 179.49 1lxa h LYS 247 N 0.17 0.00 -0.68 1.57 3.64 -1.11 0.37 116.57 120.53 1lxa h LYS 247 Ca -0.01 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.52 1lxa h LYS 247 Cb 1.12 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.83 1lxa h LYS 247 CO 0.09 0.00 0.10 0.00 -2.27 0.00 0.00 179.45 177.38 1lxa h ALA 248 N 1.37 0.79 -0.17 5.00 0.00 -1.70 0.53 119.26 125.08 1lxa h ALA 248 Ca 0.51 0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.64 1lxa h ALA 248 Cb 2.13 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 20.13 1lxa h ALA 248 CO -0.01 -0.36 -0.21 0.74 0.00 0.00 0.00 179.25 179.42 1lxa h PHE 249 N 0.21 -0.55 -0.21 0.00 0.04 -0.49 -1.66 116.94 114.28 1lxa h PHE 249 Ca 0.37 0.03 0.05 0.00 2.80 0.00 0.00 57.97 61.22 1lxa h PHE 249 Cb 0.61 0.27 -0.07 0.00 2.20 0.00 0.00 35.95 38.96 1lxa h PHE 249 CO -0.30 -0.29 -0.43 1.79 -0.60 0.00 0.00 178.31 178.48 1lxa h THR 250 N -0.24 0.13 -0.98 -1.55 1.35 -0.97 0.33 112.91 110.98 1lxa h THR 250 Ca 0.11 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 66.05 1lxa h THR 250 Cb 0.41 0.13 -0.07 0.00 -1.73 0.00 0.00 68.15 66.90 1lxa h THR 250 CO -0.31 0.00 0.63 0.44 -0.25 0.00 0.00 175.52 176.02 1lxa h ASP 251 N -0.45 0.97 0.46 5.36 3.32 -1.08 -0.71 116.42 124.30 1lxa h ASP 251 Ca 0.09 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 1lxa h ASP 251 Cb 0.62 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1lxa h ASP 251 CO -0.45 0.60 -0.22 0.15 -1.72 0.00 0.00 179.24 177.60 1lxa h PHE 252 N 1.09 -0.57 -0.96 4.55 3.57 -0.62 -1.67 116.94 122.32 1lxa h PHE 252 Ca 0.43 -0.01 0.28 0.00 3.53 0.00 0.00 57.97 62.20 1lxa h PHE 252 Cb 0.25 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 1lxa h PHE 252 CO -0.00 -0.31 0.69 0.74 -2.23 0.00 0.00 178.31 177.20 1lxa h PHE 253 N -0.70 0.02 0.00 0.41 0.04 0.43 0.91 116.94 118.05 1lxa h PHE 253 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1lxa h PHE 253 Cb 0.52 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.66 1lxa h PHE 253 CO -0.02 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 177.69 1lxa n ALA 254 N -2.72 2.48 0.00 2.45 0.00 -0.47 -3.13 120.51 119.12 1lxa n ALA 254 Ca 0.20 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1lxa n ALA 254 Cb 1.02 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 19.11 1lxa n ALA 254 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1lxa n ARG 255 N -0.91 2.37 -1.55 0.00 1.74 0.30 -5.04 116.66 113.57 1lxa n ARG 255 Ca 0.17 0.00 -0.47 0.00 -0.77 0.00 0.00 57.85 56.77 1lxa n ARG 255 Cb 0.08 -0.93 -0.03 0.00 -1.02 0.00 0.00 32.46 30.56 1lxa n ARG 255 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1lxa n SER 256 N -1.59 0.84 0.00 0.55 2.88 -0.21 -4.86 113.62 111.24 1lxa n SER 256 Ca 0.00 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 1lxa n SER 256 Cb 0.25 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.52 1lxa n SER 256 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1lxa n THR 257 N 0.73 0.00 1.78 2.46 -2.24 -1.26 -4.74 114.28 111.01 1lxa n THR 257 Ca 0.13 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.97 1lxa n THR 257 Cb 0.27 -0.49 0.25 0.00 -2.10 0.00 0.00 70.33 68.26 1lxa n THR 257 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1lxa n ARG 258 N -2.24 1.18 -0.99 -0.78 5.12 -1.26 -5.00 116.66 112.69 1lxa n ARG 258 Ca 0.00 -0.28 0.13 0.00 -1.93 0.00 0.00 57.85 55.77 1lxa n ARG 258 Cb 0.19 -1.18 -0.04 0.00 -1.16 0.00 0.00 32.46 30.27 1lxa n ARG 258 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1lxa n GLY 259 N 0.74 -2.12 3.99 -0.13 0.00 -1.26 -4.31 105.19 102.09 1lxa n GLY 259 Ca 0.08 -1.25 -0.19 0.00 0.00 0.00 0.00 46.02 44.66 1lxa n GLY 259 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1lxa s LEU 260 N -6.11 3.83 0.45 0.99 2.34 -1.26 0.13 118.68 119.05 1lxa s LEU 260 Ca 0.00 -0.17 -0.23 0.00 0.06 0.00 0.00 54.13 53.79 1lxa s LEU 260 Cb 0.00 -2.79 -0.08 0.00 -0.56 0.00 0.00 46.19 42.76 1lxa s LEU 260 CO 0.00 -0.57 1.12 0.27 -1.06 0.00 0.00 176.35 176.11 1lxa s ILE 261 N -2.29 3.35 0.00 1.48 -4.36 -0.91 -4.77 121.20 113.70 1lxa s ILE 261 Ca 0.48 0.99 0.00 0.00 -0.26 0.00 0.00 60.65 61.86 1lxa s ILE 261 Cb -0.10 -3.49 0.00 0.00 1.25 0.00 0.00 42.46 40.12 1lxa s ILE 261 CO 0.33 -0.03 0.00 0.54 0.24 0.00 0.00 174.94 176.01