#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fxy s VAL 17 N 0.00 5.04 -0.90 1.39 1.01 0.96 -3.91 120.40 123.99 1fxy s VAL 17 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 1fxy s VAL 17 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1fxy s VAL 17 CO 0.00 0.45 0.10 0.61 0.00 0.00 0.00 175.10 176.26 1fxy n GLY 18 N 3.52 -0.04 0.00 4.51 0.00 -1.25 -2.52 105.19 109.41 1fxy n GLY 18 Ca -0.16 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1fxy n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fxy n GLY 19 N -1.06 1.90 3.12 -0.02 0.00 -1.26 -4.89 105.19 102.98 1fxy n GLY 19 Ca -0.11 -2.03 -0.08 0.00 0.00 0.00 0.00 46.02 43.80 1fxy n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fxy s TYR 20 N 2.04 0.41 -0.28 1.61 -0.85 -0.48 -4.92 117.35 114.88 1fxy s TYR 20 Ca 0.00 -0.93 -0.28 0.00 -0.52 0.00 0.00 57.07 55.34 1fxy s TYR 20 Cb 0.00 -0.30 -0.03 0.00 0.38 0.00 0.00 41.96 42.02 1fxy s TYR 20 CO 0.00 -0.42 1.89 -0.80 -1.52 0.00 0.00 175.55 174.70 1fxy s ASN 21 N -2.89 5.84 0.30 -0.18 -0.87 -1.26 -0.30 114.94 115.58 1fxy s ASN 21 Ca 0.06 1.52 -0.26 0.00 -1.57 0.00 0.00 52.86 52.62 1fxy s ASN 21 Cb 0.07 -2.52 -0.15 0.00 -0.02 0.00 0.00 41.25 38.63 1fxy s ASN 21 CO -0.10 -1.71 0.64 0.00 -2.57 0.00 0.00 177.10 173.36 1fxy s LYS 23 N -1.31 3.77 0.19 0.00 3.01 -1.26 -4.96 119.74 119.18 1fxy s LYS 23 Ca 0.62 1.02 -0.32 0.00 -1.01 0.00 0.00 55.97 56.27 1fxy s LYS 23 Cb -0.76 -2.11 -0.15 0.00 -1.01 0.00 0.00 37.83 33.81 1fxy s LYS 23 CO 0.58 -0.43 1.29 -0.25 0.51 0.00 0.00 175.35 177.06 1fxy n ASP 24 N -1.73 2.01 -0.57 2.83 8.00 -1.26 -1.63 116.55 124.21 1fxy n ASP 24 Ca 0.07 1.14 -0.07 0.00 0.71 0.00 0.00 54.79 56.63 1fxy n ASP 24 Cb 0.54 -1.31 -0.03 0.00 -0.02 0.00 0.00 41.12 40.30 1fxy n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fxy n GLY 25 N 2.18 0.83 0.07 0.44 0.00 -1.26 -4.89 105.19 102.56 1fxy n GLY 25 Ca 0.14 -0.16 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 1fxy n GLY 25 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1fxy h GLU 26 N 0.15 0.02 -2.11 1.61 4.81 -1.68 -3.39 114.58 113.99 1fxy h GLU 26 Ca -0.15 -0.03 -0.58 0.00 -0.13 0.00 0.00 59.36 58.47 1fxy h GLU 26 Cb 0.84 0.01 -0.41 0.00 0.63 0.00 0.00 28.75 29.82 1fxy h GLU 26 CO 0.22 0.99 -0.83 0.28 -0.73 0.00 0.00 179.01 178.94 1fxy n VAL 27 N -3.39 1.00 0.30 0.32 0.31 -1.26 -4.94 118.33 110.66 1fxy n VAL 27 Ca -0.01 -4.69 0.16 0.00 -0.01 0.00 0.00 64.34 59.79 1fxy n VAL 27 Cb 0.92 -1.99 0.93 0.00 -0.91 0.00 0.00 33.84 32.80 1fxy n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1fxy h PRO 28 N 4.05 0.00 -0.09 5.55 0.13 -1.76 -2.54 132.00 137.33 1fxy h PRO 28 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1fxy h PRO 28 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1fxy h PRO 28 CO 0.67 0.02 0.00 -2.67 -0.23 0.00 0.00 178.00 175.78 1fxy n TRP 29 N -3.71 0.10 -2.30 1.56 2.14 -1.09 -2.29 117.44 111.84 1fxy n TRP 29 Ca -0.03 -0.05 -0.41 0.00 2.07 0.00 0.00 57.50 59.08 1fxy n TRP 29 Cb 0.10 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.57 1fxy n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1fxy s GLN 30 N -1.90 4.45 0.10 -2.67 2.00 -0.96 -0.60 119.66 120.08 1fxy s GLN 30 Ca 0.35 1.96 0.06 0.00 -2.00 0.00 0.00 55.36 55.73 1fxy s GLN 30 Cb 0.19 -3.21 -0.03 0.00 0.80 0.00 0.00 33.01 30.75 1fxy s GLN 30 CO 0.30 -0.15 -0.14 0.00 -0.50 0.00 0.00 175.29 174.80 1fxy s ALA 31 N -0.08 1.36 -0.07 1.58 0.00 -0.30 -4.47 121.76 119.79 1fxy s ALA 31 Ca 0.54 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 51.34 1fxy s ALA 31 Cb -0.35 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.71 1fxy s ALA 31 CO 0.38 0.12 -0.12 -1.17 0.00 0.00 0.00 175.76 174.98 1fxy s LEU 32 N -2.18 1.63 -0.13 0.00 2.96 -0.08 -0.79 118.68 120.10 1fxy s LEU 32 Ca 0.05 -0.30 -0.17 0.00 -0.22 0.00 0.00 54.13 53.48 1fxy s LEU 32 Cb -0.07 -0.82 -0.04 0.00 0.50 0.00 0.00 46.19 45.76 1fxy s LEU 32 CO 0.03 0.03 0.45 -0.76 -1.32 0.00 0.00 176.35 174.77 1fxy s LEU 33 N 0.69 4.26 -0.04 -0.68 1.43 0.24 -0.26 118.68 124.32 1fxy s LEU 33 Ca -0.14 0.75 0.07 0.00 -1.03 0.00 0.00 54.13 53.78 1fxy s LEU 33 Cb -0.16 -2.64 -0.01 0.00 0.03 0.00 0.00 46.19 43.41 1fxy s LEU 33 CO 0.03 0.00 -0.25 0.27 0.23 0.00 0.00 176.35 176.64 1fxy s ILE 34 N 0.67 1.99 0.00 -0.59 -4.36 -0.72 -1.66 121.20 116.54 1fxy s ILE 34 Ca 0.24 -1.05 0.00 0.00 -0.26 0.00 0.00 60.65 59.58 1fxy s ILE 34 Cb -0.15 -1.67 0.00 0.00 1.25 0.00 0.00 42.46 41.89 1fxy s ILE 34 CO 0.09 0.56 0.00 -0.46 0.24 0.00 0.00 174.94 175.37 1fxy n ASN 35 N 2.76 0.00 -0.33 4.36 0.23 -0.32 -1.70 115.26 120.27 1fxy n ASN 35 Ca -0.17 -0.76 -0.01 0.00 -0.53 0.00 0.00 54.58 53.11 1fxy n ASN 35 Cb 0.52 0.00 0.12 0.00 -2.08 0.00 0.00 39.78 38.34 1fxy n ASN 35 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1fxy h GLU 36 N 0.00 1.09 -0.80 -3.83 4.57 -1.89 -2.02 114.58 111.69 1fxy h GLU 36 Ca 0.00 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1fxy h GLU 36 Cb 0.00 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 28.34 1fxy h GLU 36 CO 0.00 0.72 0.00 0.39 -1.18 0.00 0.00 179.01 178.94 1fxy n GLU 37 N -4.52 0.97 -2.33 1.92 1.02 -1.26 -4.84 120.64 111.60 1fxy n GLU 37 Ca 0.11 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 57.07 1fxy n GLU 37 Cb 0.09 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.09 1fxy n GLU 37 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1fxy n ASN 38 N -0.07 -5.33 -4.67 1.62 4.13 -0.76 -4.98 115.26 105.20 1fxy n ASN 38 Ca 0.00 0.08 -0.34 0.00 1.68 0.00 0.00 54.58 56.00 1fxy n ASN 38 Cb 0.20 -4.48 -0.09 0.00 -1.54 0.00 0.00 39.78 33.86 1fxy n ASN 38 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1fxy s GLU 39 N -4.90 2.87 0.10 3.52 0.41 -1.26 -4.86 118.70 114.58 1fxy s GLU 39 Ca 0.00 -0.51 -0.30 0.00 -0.41 0.00 0.00 54.97 53.75 1fxy s GLU 39 Cb 0.00 -2.72 -0.06 0.00 -1.78 0.00 0.00 34.13 29.58 1fxy s GLU 39 CO 0.00 0.67 1.03 0.20 -0.49 0.00 0.00 175.26 176.67 1fxy s GLY 40 N -1.15 2.86 0.00 -1.39 0.00 -1.26 -1.17 107.32 105.21 1fxy s GLY 40 Ca 0.16 0.67 0.00 0.00 0.00 0.00 0.00 44.72 45.54 1fxy s GLY 40 CO 0.05 1.64 0.00 1.97 0.00 0.00 0.00 173.10 176.76 1fxy n PHE 41 N 3.07 0.00 -3.45 1.90 -1.74 -0.66 -4.96 117.46 111.61 1fxy n PHE 41 Ca 0.04 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.81 1fxy n PHE 41 Cb 0.48 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.46 1fxy n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1fxy n GLY 43 N -0.19 1.52 3.64 0.00 0.00 0.11 -0.59 105.19 109.69 1fxy n GLY 43 Ca -0.15 -2.13 -0.05 0.00 0.00 0.00 0.00 46.02 43.69 1fxy n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fxy s GLY 44 N -3.79 -0.34 -0.06 -0.02 0.00 0.03 -4.07 107.32 99.08 1fxy s GLY 44 Ca 0.39 0.52 0.03 0.00 0.00 0.00 0.00 44.72 45.66 1fxy s GLY 44 CO 0.25 0.15 -0.13 -1.59 0.00 0.00 0.00 173.10 171.78 1fxy s THR 45 N -3.17 1.19 0.02 0.90 2.01 0.44 -1.15 115.64 115.88 1fxy s THR 45 Ca 0.09 -0.52 -0.30 0.00 0.31 0.00 0.00 61.69 61.27 1fxy s THR 45 Cb -0.01 -1.07 -0.04 0.00 0.01 0.00 0.00 72.50 71.38 1fxy s THR 45 CO -0.03 0.36 1.14 -0.63 -0.69 0.00 0.00 174.62 174.78 1fxy s ILE 46 N 0.56 4.29 -0.14 1.82 1.01 0.23 -0.29 121.20 128.68 1fxy s ILE 46 Ca -0.13 1.64 0.07 0.00 0.00 0.00 0.00 60.65 62.23 1fxy s ILE 46 Cb -0.15 -4.05 -0.14 0.00 0.01 0.00 0.00 42.46 38.13 1fxy s ILE 46 CO 0.04 0.10 -0.03 0.18 0.00 0.00 0.00 174.94 175.23 1fxy n LEU 47 N 4.15 1.23 0.00 2.97 4.77 -0.40 -0.92 117.00 128.79 1fxy n LEU 47 Ca 0.09 -0.04 -0.05 0.00 -0.03 0.00 0.00 56.01 55.98 1fxy n LEU 47 Cb 0.48 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.53 1fxy n LEU 47 CO 0.55 0.51 0.33 -1.54 -1.33 0.00 0.00 177.39 175.91 1fxy n SER 48 N -2.69 -1.30 0.24 -1.43 3.41 -1.10 -4.59 113.62 106.16 1fxy n SER 48 Ca -0.25 -1.88 0.07 0.00 -0.26 0.00 0.00 58.87 56.55 1fxy n SER 48 Cb 0.88 2.17 0.59 0.00 -0.26 0.00 0.00 64.21 67.59 1fxy n SER 48 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1fxy h GLU 49 N 0.00 0.00 0.00 4.33 4.11 -1.98 -3.18 114.58 117.86 1fxy h GLU 49 Ca -0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.24 1fxy h GLU 49 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1fxy h GLU 49 CO 0.24 0.10 -1.07 1.19 0.07 0.00 0.00 179.01 179.55 1fxy n PHE 50 N -4.32 0.00 -4.72 2.06 3.72 -1.26 -0.46 117.46 112.47 1fxy n PHE 50 Ca -0.03 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.04 1fxy n PHE 50 Cb 0.18 -0.14 -0.12 0.00 -0.94 0.00 0.00 39.48 38.46 1fxy n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1fxy s TYR 51 N -2.39 2.84 -0.03 1.38 2.02 -1.20 -0.90 117.35 119.07 1fxy s TYR 51 Ca -0.01 -0.15 0.05 0.00 -0.37 0.00 0.00 57.07 56.59 1fxy s TYR 51 Cb 0.07 -1.72 -0.01 0.00 -0.40 0.00 0.00 41.96 39.90 1fxy s TYR 51 CO 0.41 0.18 -0.18 0.42 -1.57 0.00 0.00 175.55 174.81 1fxy s ILE 52 N -0.53 1.47 -0.14 2.71 -1.09 -0.67 -1.28 121.20 121.66 1fxy s ILE 52 Ca 0.08 -0.76 -0.06 0.00 -2.23 0.00 0.00 60.65 57.67 1fxy s ILE 52 Cb -0.12 -1.25 -0.04 0.00 -1.58 0.00 0.00 42.46 39.47 1fxy s ILE 52 CO 0.02 0.42 0.08 -0.22 -1.23 0.00 0.00 174.94 174.01 1fxy s LEU 53 N -0.13 4.00 0.00 2.97 2.96 0.60 -0.41 118.68 128.68 1fxy s LEU 53 Ca -0.00 0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 54.14 1fxy s LEU 53 Cb -0.10 -1.98 0.01 0.00 0.50 0.00 0.00 46.19 44.61 1fxy s LEU 53 CO 0.01 0.30 0.15 1.07 -1.32 0.00 0.00 176.35 176.57 1fxy n THR 54 N 2.71 0.00 -3.45 3.68 5.66 -0.47 -0.42 114.28 121.99 1fxy n THR 54 Ca -0.18 -0.42 -0.38 0.00 -3.05 0.00 0.00 64.05 60.02 1fxy n THR 54 Cb 0.53 0.29 -0.06 0.00 -1.55 0.00 0.00 70.33 69.54 1fxy n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1fxy s ALA 55 N -1.72 3.66 0.34 1.79 0.00 -1.26 -0.95 121.76 123.62 1fxy s ALA 55 Ca 0.07 -0.18 0.02 0.00 0.00 0.00 0.00 51.96 51.87 1fxy s ALA 55 Cb -0.01 -2.45 0.61 0.00 0.00 0.00 0.00 23.12 21.27 1fxy s ALA 55 CO 0.05 0.42 1.99 0.00 0.00 0.00 0.00 175.76 178.22 1fxy h ALA 56 N 4.87 1.50 0.00 0.00 0.00 -1.72 -2.35 119.26 121.56 1fxy h ALA 56 Ca -0.50 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1fxy h ALA 56 Cb 1.21 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1fxy h ALA 56 CO 0.63 0.44 0.00 -2.39 0.00 0.00 0.00 179.25 177.93 1fxy n HIS 57 N -4.41 0.74 0.17 0.00 1.44 -1.26 -1.67 115.22 110.23 1fxy n HIS 57 Ca 0.06 0.32 0.05 0.00 -2.01 0.00 0.00 57.72 56.14 1fxy n HIS 57 Cb 0.07 -1.02 0.18 0.00 0.12 0.00 0.00 29.99 29.33 1fxy n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1fxy h LEU 59 N 0.00 0.00 -2.79 0.00 3.38 -1.44 -2.26 115.31 112.21 1fxy h LEU 59 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1fxy h LEU 59 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1fxy h LEU 59 CO 0.05 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.64 1fxy n TYR 60 N -4.40 0.91 0.58 1.13 0.18 -1.23 -4.18 117.16 110.14 1fxy n TYR 60 Ca -0.03 -0.50 0.11 0.00 1.88 0.00 0.00 57.90 59.35 1fxy n TYR 60 Cb 0.14 -0.01 0.27 0.00 -0.38 0.00 0.00 39.34 39.36 1fxy n TYR 60 CO 0.00 0.00 0.00 1.04 -2.08 0.00 0.00 176.86 175.82 1fxy n GLN 61 N 1.45 2.21 -3.62 -3.48 6.02 -0.85 -4.90 117.38 114.21 1fxy n GLN 61 Ca 0.22 -1.84 -0.10 0.00 -0.01 0.00 0.00 57.00 55.28 1fxy n GLN 61 Cb 0.60 -1.45 -0.06 0.00 1.02 0.00 0.00 30.24 30.34 1fxy n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fxy s ALA 61 N -1.53 -1.96 -0.02 -1.58 0.00 -1.26 -5.09 121.76 110.32 1fxy s ALA 61 Ca 0.36 1.79 -0.10 0.00 0.00 0.00 0.00 51.96 54.01 1fxy s ALA 61 Cb 0.20 -1.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.05 1fxy s ALA 61 CO 0.28 -0.26 0.54 1.57 0.00 0.00 0.00 175.76 177.89 1fxy h LYS 62 N 3.73 -0.34 -6.69 0.00 2.10 -1.90 -3.47 116.57 110.01 1fxy h LYS 62 Ca -0.26 0.02 -0.68 0.00 -2.00 0.00 0.00 60.65 57.74 1fxy h LYS 62 Cb 1.17 0.08 -0.20 0.00 -0.90 0.00 0.00 32.23 32.38 1fxy h LYS 62 CO 0.17 -0.23 -0.81 1.03 -2.00 0.00 0.00 179.45 177.61 1fxy s ARG 63 N -2.77 1.85 0.17 0.07 1.81 -1.26 -5.10 118.95 113.72 1fxy s ARG 63 Ca -0.05 -1.12 -0.23 0.00 -1.72 0.00 0.00 55.73 52.60 1fxy s ARG 63 Cb 0.01 -2.12 0.06 0.00 -0.45 0.00 0.00 34.95 32.45 1fxy s ARG 63 CO 0.15 0.50 0.67 -0.59 -0.68 0.00 0.00 175.30 175.36 1fxy s PHE 64 N -1.06 -0.43 0.40 -0.53 -0.12 -1.26 -3.39 117.98 111.60 1fxy s PHE 64 Ca 0.16 0.17 0.03 0.00 -0.05 0.00 0.00 56.93 57.25 1fxy s PHE 64 Cb -0.10 0.59 -0.03 0.00 -0.63 0.00 0.00 43.02 42.84 1fxy s PHE 64 CO 0.08 -0.90 0.09 0.15 -0.05 0.00 0.00 175.22 174.60 1fxy s LYS 65 N -3.69 1.89 -0.07 1.99 1.02 -0.69 -4.39 119.74 115.80 1fxy s LYS 65 Ca 0.04 -2.14 0.05 0.00 0.02 0.00 0.00 55.97 53.94 1fxy s LYS 65 Cb -0.02 -0.81 -0.01 0.00 -0.52 0.00 0.00 37.83 36.47 1fxy s LYS 65 CO -0.08 -0.38 -0.24 0.08 -0.92 0.00 0.00 175.35 173.81 1fxy s VAL 66 N -3.18 1.99 -0.12 3.17 1.01 0.45 -1.75 120.40 121.97 1fxy s VAL 66 Ca 0.25 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1fxy s VAL 66 Cb 0.04 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 1fxy s VAL 66 CO 0.13 0.55 -0.16 -0.60 0.00 0.00 0.00 175.10 175.02 1fxy s ARG 67 N 0.06 3.28 0.30 2.72 3.52 0.64 0.72 118.95 130.19 1fxy s ARG 67 Ca -0.10 -0.74 0.03 0.00 -0.13 0.00 0.00 55.73 54.80 1fxy s ARG 67 Cb -0.15 -2.53 -0.06 0.00 -1.56 0.00 0.00 34.95 30.64 1fxy s ARG 67 CO 0.06 0.21 0.05 0.14 -0.81 0.00 0.00 175.30 174.94 1fxy s VAL 68 N 0.34 1.07 0.00 7.11 -7.23 -0.39 -0.90 120.40 120.39 1fxy s VAL 68 Ca -0.13 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.03 1fxy s VAL 68 Cb -0.16 -2.68 0.00 0.00 0.56 0.00 0.00 36.38 34.09 1fxy s VAL 68 CO 0.07 -0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1fxy n GLY 69 N -0.60 -2.01 3.72 2.32 0.00 -1.26 -0.20 105.19 107.16 1fxy n GLY 69 Ca -0.02 -1.87 -0.08 0.00 0.00 0.00 0.00 46.02 44.05 1fxy n GLY 69 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fxy s ASP 70 N -3.66 -0.10 -0.01 1.61 1.47 -1.13 -4.78 116.67 110.07 1fxy s ASP 70 Ca 0.00 -0.84 0.20 0.00 1.18 0.00 0.00 52.55 53.09 1fxy s ASP 70 Cb 0.00 0.68 0.59 0.00 -0.34 0.00 0.00 42.92 43.84 1fxy s ASP 70 CO 0.00 -1.29 1.49 -2.11 0.68 0.00 0.00 175.17 173.94 1fxy n ARG 71 N -0.44 2.83 -2.62 2.11 1.85 -1.26 -3.03 116.66 116.09 1fxy n ARG 71 Ca -0.03 -2.56 -0.43 0.00 -1.00 0.00 0.00 57.85 53.82 1fxy n ARG 71 Cb 0.60 -1.53 0.00 0.00 -1.05 0.00 0.00 32.46 30.48 1fxy n ARG 71 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1fxy n ASN 72 N 1.38 4.96 0.03 2.89 3.02 -1.26 -4.75 115.26 121.53 1fxy n ASN 72 Ca 0.22 -2.95 0.10 0.00 -0.03 0.00 0.00 54.58 51.93 1fxy n ASN 72 Cb 0.60 -1.66 0.44 0.00 -0.61 0.00 0.00 39.78 38.55 1fxy n ASN 72 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1fxy n THR 73 N 5.42 0.65 0.08 3.41 -2.24 -1.24 -3.37 114.28 116.98 1fxy n THR 73 Ca 0.44 0.13 -0.12 0.00 -2.27 0.00 0.00 64.05 62.22 1fxy n THR 73 Cb 0.43 -0.84 -0.06 0.00 -2.10 0.00 0.00 70.33 67.76 1fxy n THR 73 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1fxy h GLU 74 N 0.00 -0.19 0.08 -0.78 4.81 -2.02 -3.11 114.58 113.38 1fxy h GLU 74 Ca 0.00 0.01 -0.25 0.00 -0.13 0.00 0.00 59.36 58.99 1fxy h GLU 74 Cb 0.38 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1fxy h GLU 74 CO 0.00 -0.12 -1.16 0.37 -0.73 0.00 0.00 179.01 177.37 1fxy h GLN 75 N -0.19 0.17 -1.85 1.92 5.75 -1.99 -3.47 115.11 115.45 1fxy h GLN 75 Ca 0.01 -0.30 0.00 0.00 -0.15 0.00 0.00 58.65 58.21 1fxy h GLN 75 Cb 0.19 0.11 -0.23 0.00 1.07 0.00 0.00 27.48 28.62 1fxy h GLN 75 CO -0.03 1.14 0.24 -2.00 -2.65 0.00 0.00 178.83 175.53 1fxy s GLU 76 N -2.67 0.71 0.37 1.69 2.12 -1.17 -5.12 118.70 114.62 1fxy s GLU 76 Ca -0.02 0.87 -0.08 0.00 0.36 0.00 0.00 54.97 56.10 1fxy s GLU 76 Cb 0.08 0.33 -0.06 0.00 0.26 0.00 0.00 34.13 34.74 1fxy s GLU 76 CO 0.86 -0.09 0.70 -1.21 -0.54 0.00 0.00 175.26 174.98 1fxy s GLU 77 N 0.44 3.72 0.00 4.30 2.02 -1.26 -3.71 118.70 124.21 1fxy s GLU 77 Ca 0.00 0.30 0.00 0.00 0.02 0.00 0.00 54.97 55.29 1fxy s GLU 77 Cb -0.05 -2.47 0.00 0.00 0.10 0.00 0.00 34.13 31.71 1fxy s GLU 77 CO -0.03 0.04 0.00 0.41 0.02 0.00 0.00 175.26 175.69 1fxy n GLY 78 N -1.24 3.55 7.00 -1.39 0.00 -1.26 -5.06 105.19 106.79 1fxy n GLY 78 Ca 0.01 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1fxy n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fxy n GLY 79 N 0.00 -0.76 3.89 -0.02 0.00 -1.22 -4.83 105.19 102.25 1fxy n GLY 79 Ca 0.00 -1.16 -0.33 0.00 0.00 0.00 0.00 46.02 44.54 1fxy n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fxy s GLU 80 N 0.00 3.63 -0.07 1.61 2.02 -1.17 -2.83 118.70 121.90 1fxy s GLU 80 Ca 0.00 -0.04 0.02 0.00 0.02 0.00 0.00 54.97 54.97 1fxy s GLU 80 Cb 0.00 -2.95 0.01 0.00 0.10 0.00 0.00 34.13 31.29 1fxy s GLU 80 CO 0.00 0.54 -0.13 0.00 0.02 0.00 0.00 175.26 175.69 1fxy s ALA 81 N -1.50 1.32 -0.20 5.21 0.00 0.72 -4.96 121.76 122.35 1fxy s ALA 81 Ca 0.36 -0.45 -0.09 0.00 0.00 0.00 0.00 51.96 51.78 1fxy s ALA 81 Cb -0.13 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 1fxy s ALA 81 CO 0.21 0.13 0.09 0.08 0.00 0.00 0.00 175.76 176.28 1fxy s VAL 82 N 0.62 5.04 0.07 0.00 1.01 -1.26 -1.27 120.40 124.61 1fxy s VAL 82 Ca -0.15 0.06 0.09 0.00 0.00 0.00 0.00 61.98 61.98 1fxy s VAL 82 Cb -0.16 -3.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1fxy s VAL 82 CO 0.04 0.44 -0.24 -1.00 0.00 0.00 0.00 175.10 174.33 1fxy s HIS 83 N 0.48 2.38 0.19 5.22 3.76 0.22 -4.94 115.29 122.60 1fxy s HIS 83 Ca 0.05 -0.36 -0.13 0.00 -0.15 0.00 0.00 55.06 54.47 1fxy s HIS 83 Cb -0.12 -1.37 -0.07 0.00 1.11 0.00 0.00 32.58 32.13 1fxy s HIS 83 CO 0.00 0.22 0.57 -1.21 -0.85 0.00 0.00 174.74 173.47 1fxy s GLU 84 N -1.53 3.94 -0.24 1.40 2.02 -1.26 -0.41 118.70 122.61 1fxy s GLU 84 Ca 0.13 0.45 -0.16 0.00 0.02 0.00 0.00 54.97 55.41 1fxy s GLU 84 Cb -0.10 -2.80 -0.04 0.00 0.10 0.00 0.00 34.13 31.30 1fxy s GLU 84 CO 0.04 0.40 0.42 0.08 0.02 0.00 0.00 175.26 176.22 1fxy s VAL 85 N -1.62 5.15 -0.17 2.63 1.01 -1.26 -1.22 120.40 124.92 1fxy s VAL 85 Ca 0.42 0.71 -0.25 0.00 0.00 0.00 0.00 61.98 62.87 1fxy s VAL 85 Cb -0.13 -3.75 -0.22 0.00 0.00 0.00 0.00 36.38 32.28 1fxy s VAL 85 CO 0.20 0.17 0.47 -0.08 0.00 0.00 0.00 175.10 175.86 1fxy h GLU 86 N 7.81 0.00 -4.62 2.72 4.81 0.40 -3.45 114.58 122.25 1fxy h GLU 86 Ca -0.33 0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.44 1fxy h GLU 86 Cb 1.16 0.00 -0.32 0.00 0.63 0.00 0.00 28.75 30.22 1fxy h GLU 86 CO 0.69 0.97 -0.80 0.08 -0.73 0.00 0.00 179.01 179.22 1fxy s VAL 87 N -2.28 0.92 -0.23 0.32 1.01 -0.82 -4.99 120.40 114.33 1fxy s VAL 87 Ca -0.24 -0.41 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 1fxy s VAL 87 Cb 0.02 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.55 1fxy s VAL 87 CO 0.62 0.29 0.01 -0.69 0.00 0.00 0.00 175.10 175.33 1fxy s VAL 88 N 0.35 3.90 -0.41 2.92 1.01 -1.26 -0.38 120.40 126.52 1fxy s VAL 88 Ca -0.07 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 61.64 1fxy s VAL 88 Cb -0.11 -2.79 0.11 0.00 0.00 0.00 0.00 36.38 33.59 1fxy s VAL 88 CO 0.01 0.39 0.14 -0.63 0.00 0.00 0.00 175.10 175.01 1fxy s ILE 89 N 1.38 2.37 0.20 2.22 1.01 0.17 -5.02 121.20 123.52 1fxy s ILE 89 Ca 0.05 -2.72 -0.19 0.00 0.00 0.00 0.00 60.65 57.79 1fxy s ILE 89 Cb -0.15 -2.71 -0.08 0.00 0.01 0.00 0.00 42.46 39.54 1fxy s ILE 89 CO 0.01 -0.68 0.68 -0.75 0.00 0.00 0.00 174.94 174.19 1fxy s LYS 90 N 0.43 4.19 -0.14 2.79 2.20 -1.26 -0.66 119.74 127.30 1fxy s LYS 90 Ca 0.13 0.78 -0.29 0.00 -0.36 0.00 0.00 55.97 56.23 1fxy s LYS 90 Cb -0.22 -2.92 -0.04 0.00 -1.51 0.00 0.00 37.83 33.14 1fxy s LYS 90 CO -0.05 0.43 1.65 -1.58 -0.36 0.00 0.00 175.35 175.44 1fxy s HIS 91 N -1.48 2.02 -0.45 4.03 5.65 -0.91 -4.85 115.29 119.30 1fxy s HIS 91 Ca 0.41 0.39 0.12 0.00 0.25 0.00 0.00 55.06 56.23 1fxy s HIS 91 Cb -0.17 -3.93 0.67 0.00 -1.18 0.00 0.00 32.58 27.96 1fxy s HIS 91 CO 0.21 -3.40 1.35 0.09 -0.65 0.00 0.00 174.74 172.34 1fxy n ASN 92 N 7.91 0.32 -0.75 9.88 4.13 -1.26 -1.42 115.26 134.07 1fxy n ASN 92 Ca 0.18 0.62 0.13 0.00 1.68 0.00 0.00 54.58 57.19 1fxy n ASN 92 Cb 0.44 -0.65 0.31 0.00 -1.54 0.00 0.00 39.78 38.34 1fxy n ASN 92 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1fxy n ARG 93 N -1.92 2.02 -2.09 3.52 1.74 -1.26 -4.94 116.66 113.72 1fxy n ARG 93 Ca -0.01 -1.49 -0.40 0.00 -0.77 0.00 0.00 57.85 55.18 1fxy n ARG 93 Cb 0.07 -1.47 -0.01 0.00 -1.02 0.00 0.00 32.46 30.03 1fxy n ARG 93 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1fxy s PHE 94 N -1.92 2.91 -0.16 -1.55 5.36 -0.51 -4.78 117.98 117.33 1fxy s PHE 94 Ca 0.34 1.42 -0.13 0.00 -0.96 0.00 0.00 56.93 57.60 1fxy s PHE 94 Cb 0.20 -3.65 0.05 0.00 -0.34 0.00 0.00 43.02 39.28 1fxy s PHE 94 CO 0.31 -1.96 0.41 -0.08 -1.46 0.00 0.00 175.22 172.44 1fxy s THR 95 N -1.24 -0.01 -2.00 0.12 -1.32 -1.24 -5.02 115.64 104.93 1fxy s THR 95 Ca 0.55 0.03 0.22 0.00 -1.21 0.00 0.00 61.69 61.28 1fxy s THR 95 Cb -0.38 -0.58 0.63 0.00 -1.51 0.00 0.00 72.50 70.66 1fxy s THR 95 CO 0.49 0.01 1.83 2.29 -2.21 0.00 0.00 174.62 177.03 1fxy n LYS 96 N 3.31 0.95 0.05 7.08 2.85 -1.26 -0.49 118.16 130.65 1fxy n LYS 96 Ca -0.16 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.02 1fxy n LYS 96 Cb 0.56 -1.37 0.09 0.00 -0.65 0.00 0.00 35.03 33.67 1fxy n LYS 96 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1fxy h GLU 97 N 0.00 0.37 0.00 -1.58 4.81 -1.97 -3.37 114.58 112.84 1fxy h GLU 97 Ca 0.00 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1fxy h GLU 97 Cb 0.00 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1fxy h GLU 97 CO 0.00 0.86 -0.75 0.25 -0.73 0.00 0.00 179.01 178.63 1fxy n THR 98 N -3.90 0.00 -1.74 0.32 -2.24 -1.17 -5.01 114.28 100.54 1fxy n THR 98 Ca -0.03 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.65 1fxy n THR 98 Cb 0.62 0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 1fxy n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1fxy n TYR 99 N -1.29 -0.24 -2.78 4.78 4.01 0.36 -5.01 117.16 116.99 1fxy n TYR 99 Ca 0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.42 1fxy n TYR 99 Cb 0.12 -2.25 -0.05 0.00 -0.31 0.00 0.00 39.34 36.85 1fxy n TYR 99 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1fxy s ASP 100 N -2.71 6.69 -1.42 7.72 2.15 -1.25 -3.76 116.67 124.08 1fxy s ASP 100 Ca 0.00 1.40 -0.03 0.00 0.43 0.00 0.00 52.55 54.35 1fxy s ASP 100 Cb 0.00 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 1fxy s ASP 100 CO 0.00 -0.40 0.39 0.49 -0.17 0.00 0.00 175.17 175.47 1fxy n PHE 101 N -1.04 -1.48 -1.70 -5.34 3.72 -1.26 -3.64 117.46 106.71 1fxy n PHE 101 Ca 0.05 0.33 -0.42 0.00 -0.05 0.00 0.00 57.45 57.36 1fxy n PHE 101 Cb 0.54 -3.95 -0.01 0.00 -0.94 0.00 0.00 39.48 35.12 1fxy n PHE 101 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1fxy n ASP 102 N -1.84 3.75 -3.75 4.37 2.03 -1.25 -4.26 116.55 115.60 1fxy n ASP 102 Ca -0.13 -2.82 -0.13 0.00 0.52 0.00 0.00 54.79 52.22 1fxy n ASP 102 Cb 0.62 -1.60 -0.10 0.00 -0.72 0.00 0.00 41.12 39.33 1fxy n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1fxy s ILE 103 N 3.54 0.01 -0.00 5.18 2.07 -1.26 -3.87 121.20 126.87 1fxy s ILE 103 Ca 0.49 -0.11 -0.15 0.00 -1.41 0.00 0.00 60.65 59.47 1fxy s ILE 103 Cb 0.13 -0.52 0.02 0.00 0.13 0.00 0.00 42.46 42.22 1fxy s ILE 103 CO -0.05 -0.06 0.31 0.00 -1.91 0.00 0.00 174.94 173.22 1fxy s ALA 104 N -0.18 -0.76 -0.08 1.50 0.00 -0.12 -2.13 121.76 119.97 1fxy s ALA 104 Ca -0.03 0.25 0.04 0.00 0.00 0.00 0.00 51.96 52.22 1fxy s ALA 104 Cb -0.03 0.13 -0.01 0.00 0.00 0.00 0.00 23.12 23.21 1fxy s ALA 104 CO 0.01 -0.29 -0.22 0.08 0.00 0.00 0.00 175.76 175.34 1fxy s VAL 105 N -1.60 2.25 -0.01 0.00 1.01 0.17 -1.37 120.40 120.85 1fxy s VAL 105 Ca -0.12 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 60.92 1fxy s VAL 105 Cb -0.04 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1fxy s VAL 105 CO 0.03 0.56 -0.07 -0.76 0.00 0.00 0.00 175.10 174.86 1fxy s LEU 106 N 0.08 3.17 -0.19 3.92 1.43 0.46 -0.66 118.68 126.89 1fxy s LEU 106 Ca -0.10 -0.11 -0.01 0.00 -1.03 0.00 0.00 54.13 52.87 1fxy s LEU 106 Cb -0.16 -1.78 0.00 0.00 0.03 0.00 0.00 46.19 44.28 1fxy s LEU 106 CO 0.06 0.30 -0.12 -0.60 0.23 0.00 0.00 176.35 176.22 1fxy s ARG 107 N -1.26 3.22 0.42 1.70 3.52 0.48 -1.67 118.95 125.36 1fxy s ARG 107 Ca 0.16 -0.72 -0.16 0.00 -0.13 0.00 0.00 55.73 54.88 1fxy s ARG 107 Cb -0.11 -2.77 -0.09 0.00 -1.56 0.00 0.00 34.95 30.42 1fxy s ARG 107 CO 0.06 -0.13 0.86 -0.51 -0.81 0.00 0.00 175.30 174.77 1fxy s LEU 108 N 1.22 3.87 0.10 -0.88 1.43 -0.08 1.00 118.68 125.34 1fxy s LEU 108 Ca 0.02 1.43 -0.16 0.00 -1.03 0.00 0.00 54.13 54.40 1fxy s LEU 108 Cb -0.14 -4.30 -0.07 0.00 0.03 0.00 0.00 46.19 41.71 1fxy s LEU 108 CO -0.05 -0.38 1.46 0.11 0.23 0.00 0.00 176.35 177.72 1fxy h LYS 109 N 1.62 0.65 -6.58 1.70 1.57 -1.48 -3.42 116.57 110.64 1fxy h LYS 109 Ca -0.48 -0.29 -0.69 0.00 -1.87 0.00 0.00 60.65 57.32 1fxy h LYS 109 Cb 1.18 -0.02 -0.27 0.00 0.08 0.00 0.00 32.23 33.21 1fxy h LYS 109 CO 0.63 0.88 -0.85 0.95 -0.57 0.00 0.00 179.45 180.49 1fxy s THR 110 N -4.58 2.38 0.60 -0.16 -4.23 -1.26 -5.03 115.64 103.37 1fxy s THR 110 Ca -0.13 -1.11 -0.17 0.00 -1.18 0.00 0.00 61.69 59.10 1fxy s THR 110 Cb 0.09 -1.90 -0.03 0.00 1.34 0.00 0.00 72.50 72.00 1fxy s THR 110 CO 0.80 0.50 1.12 -2.16 -0.54 0.00 0.00 174.62 174.34 1fxy s PRO 111 N -0.91 3.05 0.20 3.99 0.04 -1.26 -4.89 135.00 135.23 1fxy s PRO 111 Ca 0.11 1.51 -0.28 0.00 0.04 0.00 0.00 61.00 62.39 1fxy s PRO 111 Cb -0.10 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.38 1fxy s PRO 111 CO 0.01 -1.07 0.87 0.42 0.04 0.00 0.00 177.00 177.27 1fxy s ILE 112 N -2.04 4.21 -0.54 0.56 1.01 0.39 -5.00 121.20 119.78 1fxy s ILE 112 Ca 0.70 1.92 -0.21 0.00 0.00 0.00 0.00 60.65 63.06 1fxy s ILE 112 Cb -0.23 -4.25 0.05 0.00 0.01 0.00 0.00 42.46 38.05 1fxy s ILE 112 CO 0.34 0.51 0.79 0.42 0.00 0.00 0.00 174.94 177.00 1fxy s THR 113 N -1.13 4.63 0.63 2.92 -4.23 -1.26 -4.81 115.64 112.39 1fxy s THR 113 Ca 0.39 -0.17 -0.15 0.00 -1.18 0.00 0.00 61.69 60.58 1fxy s THR 113 Cb -0.25 -4.43 -0.01 0.00 1.34 0.00 0.00 72.50 69.15 1fxy s THR 113 CO 0.29 -0.99 1.09 -0.36 -0.54 0.00 0.00 174.62 174.11 1fxy s PHE 114 N 3.29 2.75 0.24 3.99 0.08 -1.26 -4.95 117.98 122.13 1fxy s PHE 114 Ca 0.22 1.54 -0.06 0.00 0.12 0.00 0.00 56.93 58.75 1fxy s PHE 114 Cb -0.16 -3.12 0.02 0.00 -0.57 0.00 0.00 43.02 39.20 1fxy s PHE 114 CO 0.15 -1.49 0.42 2.89 -0.10 0.00 0.00 175.22 177.09 1fxy n ARG 115 N -2.26 0.61 0.04 0.44 1.85 -0.62 -4.97 116.66 111.74 1fxy n ARG 115 Ca 0.10 -1.60 0.02 0.00 -1.00 0.00 0.00 57.85 55.37 1fxy n ARG 115 Cb 0.52 1.77 0.38 0.00 -1.05 0.00 0.00 32.46 34.09 1fxy n ARG 115 CO 0.00 0.00 0.00 1.98 -0.01 0.00 0.00 177.63 179.60 1fxy h MET 116 N 0.00 0.43 -0.61 2.89 1.85 -1.97 -2.67 114.93 114.86 1fxy h MET 116 Ca -0.20 -0.06 0.00 0.00 -0.61 0.00 0.00 59.70 58.83 1fxy h MET 116 Cb 0.78 -0.08 0.00 0.00 0.43 0.00 0.00 31.60 32.74 1fxy h MET 116 CO 0.26 0.41 0.00 0.09 -0.40 0.00 0.00 176.91 177.27 1fxy n ASN 117 N -4.36 3.53 -3.40 1.39 3.02 -1.26 -4.62 115.26 109.55 1fxy n ASN 117 Ca 0.01 -1.99 -0.25 0.00 -0.03 0.00 0.00 54.58 52.33 1fxy n ASN 117 Cb 0.18 -0.40 -0.10 0.00 -0.61 0.00 0.00 39.78 38.84 1fxy n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1fxy s VAL 118 N -1.20 0.00 0.05 2.41 1.01 -1.01 -4.39 120.40 117.29 1fxy s VAL 118 Ca 0.44 -1.64 -0.00 0.00 0.00 0.00 0.00 61.98 60.78 1fxy s VAL 118 Cb 0.23 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 1fxy s VAL 118 CO 0.31 -0.89 -0.04 0.00 0.00 0.00 0.00 175.10 174.48 1fxy s ALA 119 N 1.00 0.51 0.70 5.51 0.00 -0.97 -1.59 121.76 126.92 1fxy s ALA 119 Ca 0.20 -1.12 -0.12 0.00 0.00 0.00 0.00 51.96 50.92 1fxy s ALA 119 Cb -0.16 0.23 0.02 0.00 0.00 0.00 0.00 23.12 23.21 1fxy s ALA 119 CO -0.03 -0.31 1.08 -1.25 0.00 0.00 0.00 175.76 175.25 1fxy s PRO 120 N -3.46 2.68 0.39 0.00 0.04 -1.26 -2.69 135.00 130.70 1fxy s PRO 120 Ca 0.04 1.17 -0.01 0.00 0.04 0.00 0.00 61.00 62.24 1fxy s PRO 120 Cb 0.04 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 1fxy s PRO 120 CO -0.08 -1.31 0.61 0.00 0.04 0.00 0.00 177.00 176.26 1fxy s ALA 121 N -2.75 3.64 -0.14 8.56 0.00 -0.10 -4.84 121.76 126.14 1fxy s ALA 121 Ca 0.62 -0.84 -0.15 0.00 0.00 0.00 0.00 51.96 51.59 1fxy s ALA 121 Cb -0.17 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.69 1fxy s ALA 121 CO 0.50 -0.13 0.36 -1.12 0.00 0.00 0.00 175.76 175.37 1fxy s SER 122 N -4.07 6.54 0.68 0.00 0.01 -1.26 -4.80 113.70 110.80 1fxy s SER 122 Ca 0.42 0.64 -0.15 0.00 1.31 0.00 0.00 55.95 58.17 1fxy s SER 122 Cb -0.10 -2.22 0.01 0.00 0.21 0.00 0.00 66.02 63.92 1fxy s SER 122 CO 0.38 0.08 1.14 -0.76 0.41 0.00 0.00 173.24 174.50 1fxy s LEU 123 N 0.40 3.38 0.48 2.44 1.02 -1.26 -0.49 118.68 124.66 1fxy s LEU 123 Ca 0.20 2.13 -0.20 0.00 0.02 0.00 0.00 54.13 56.29 1fxy s LEU 123 Cb -0.14 -4.57 -0.09 0.00 0.02 0.00 0.00 46.19 41.42 1fxy s LEU 123 CO 0.07 -1.83 1.00 -2.16 0.02 0.00 0.00 176.35 173.45 1fxy s PRO 124 N -3.99 3.94 0.00 1.29 0.04 -1.24 -4.65 135.00 130.40 1fxy s PRO 124 Ca 0.70 1.19 0.04 0.00 0.04 0.00 0.00 61.00 62.97 1fxy s PRO 124 Cb -0.24 -2.13 0.02 0.00 0.04 0.00 0.00 34.50 32.20 1fxy s PRO 124 CO 0.42 -0.29 0.55 0.25 0.04 0.00 0.00 177.00 177.98 1fxy n THR 125 N -1.04 0.00 -3.63 1.26 -2.24 -1.26 -4.95 114.28 102.43 1fxy n THR 125 Ca 0.08 -0.48 -0.16 0.00 -2.27 0.00 0.00 64.05 61.22 1fxy n THR 125 Cb 0.53 1.07 -0.07 0.00 -2.10 0.00 0.00 70.33 69.76 1fxy n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fxy s ALA 127 N -0.53 -1.41 0.80 6.98 0.00 -1.26 -5.17 121.76 121.18 1fxy s ALA 127 Ca 0.04 1.12 -0.13 0.00 0.00 0.00 0.00 51.96 53.00 1fxy s ALA 127 Cb 0.03 -0.22 0.08 0.00 0.00 0.00 0.00 23.12 23.02 1fxy s ALA 127 CO 0.07 -0.32 1.17 -1.25 0.00 0.00 0.00 175.76 175.43 1fxy s PRO 128 N -0.85 1.74 0.24 0.00 0.04 -1.26 -4.94 135.00 129.97 1fxy s PRO 128 Ca -0.09 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 1fxy s PRO 128 Cb -0.02 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.62 1fxy s PRO 128 CO 0.06 -2.10 1.37 -1.25 0.04 0.00 0.00 177.00 175.12 1fxy s PRO 129 N -4.31 4.33 -0.12 0.56 0.04 -1.26 -5.01 135.00 129.22 1fxy s PRO 129 Ca 0.70 2.19 -0.10 0.00 0.04 0.00 0.00 61.00 63.83 1fxy s PRO 129 Cb -0.25 -3.14 -0.05 0.00 0.04 0.00 0.00 34.50 31.11 1fxy s PRO 129 CO 0.51 -0.32 0.21 0.00 0.04 0.00 0.00 177.00 177.45 1fxy s ALA 130 N -0.12 3.75 0.19 8.56 0.00 -1.26 -5.05 121.76 127.83 1fxy s ALA 130 Ca 0.57 -0.54 -0.33 0.00 0.00 0.00 0.00 51.96 51.66 1fxy s ALA 130 Cb -0.39 -2.17 -0.14 0.00 0.00 0.00 0.00 23.12 20.42 1fxy s ALA 130 CO 0.43 0.40 1.44 2.41 0.00 0.00 0.00 175.76 180.43 1fxy n THR 132 N 2.59 0.53 0.00 0.00 -1.04 -1.26 -1.76 114.28 113.33 1fxy n THR 132 Ca -0.17 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.71 1fxy n THR 132 Cb 0.53 -1.38 0.00 0.00 -1.82 0.00 0.00 70.33 67.67 1fxy n THR 132 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1fxy n GLY 133 N 2.61 3.20 3.72 3.41 0.00 0.15 -4.94 105.19 113.34 1fxy n GLY 133 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1fxy n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1fxy n THR 134 N -1.37 1.76 -3.07 2.61 -1.04 -0.72 -4.45 114.28 108.00 1fxy n THR 134 Ca 0.00 -0.44 -0.39 0.00 -2.04 0.00 0.00 64.05 61.18 1fxy n THR 134 Cb 0.00 -1.72 -0.06 0.00 -1.82 0.00 0.00 70.33 66.73 1fxy n THR 134 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1fxy s LYS 135 N -1.61 4.44 0.14 -2.82 -0.14 -1.26 -0.76 119.74 117.73 1fxy s LYS 135 Ca 0.57 0.99 0.05 0.00 -1.36 0.00 0.00 55.97 56.23 1fxy s LYS 135 Cb -0.54 -3.29 -0.04 0.00 -1.68 0.00 0.00 37.83 32.27 1fxy s LYS 135 CO 0.60 0.48 -0.12 0.00 -0.76 0.00 0.00 175.35 175.55 1fxy s LEU 137 N -2.81 3.05 -0.11 0.00 2.96 0.46 -1.27 118.68 120.95 1fxy s LEU 137 Ca 0.13 -0.50 -0.01 0.00 -0.22 0.00 0.00 54.13 53.53 1fxy s LEU 137 Cb -0.01 -1.74 -0.02 0.00 0.50 0.00 0.00 46.19 44.91 1fxy s LEU 137 CO 0.02 -0.06 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.29 1fxy s ILE 138 N 1.46 3.56 0.07 6.68 1.01 0.66 -1.61 121.20 133.03 1fxy s ILE 138 Ca 0.05 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 60.21 1fxy s ILE 138 Cb -0.15 -2.50 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 1fxy s ILE 138 CO -0.03 0.54 -0.07 -0.94 0.00 0.00 0.00 174.94 174.45 1fxy s SER 139 N -0.10 0.92 0.00 3.58 1.04 -1.22 -0.25 113.70 117.66 1fxy s SER 139 Ca 0.01 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.64 1fxy s SER 139 Cb -0.13 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.07 1fxy s SER 139 CO 0.03 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.50 1fxy n GLY 140 N 0.67 0.78 1.05 7.32 0.00 -0.88 -4.41 105.19 109.72 1fxy n GLY 140 Ca -0.17 -0.85 0.08 0.00 0.00 0.00 0.00 46.02 45.08 1fxy n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1fxy n TRP 141 N -0.22 0.89 -1.41 1.61 7.02 -1.26 -1.78 117.44 122.29 1fxy n TRP 141 Ca 0.00 -0.59 -0.26 0.00 -1.02 0.00 0.00 57.50 55.63 1fxy n TRP 141 Cb 0.00 -0.12 0.20 0.00 -2.42 0.00 0.00 31.31 28.97 1fxy n TRP 141 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1fxy n GLY 142 N 0.72 -2.09 3.63 6.99 0.00 -1.26 -4.50 105.19 108.69 1fxy n GLY 142 Ca 0.19 -1.60 -0.45 0.00 0.00 0.00 0.00 46.02 44.16 1fxy n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1fxy n ASN 143 N -4.20 2.06 -0.75 1.61 2.85 0.11 -3.18 115.26 113.76 1fxy n ASN 143 Ca 0.14 1.17 0.07 0.00 -0.11 0.00 0.00 54.58 55.85 1fxy n ASN 143 Cb 0.52 -1.36 0.15 0.00 1.24 0.00 0.00 39.78 40.32 1fxy n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1fxy n THR 144 N 1.01 0.59 -4.73 -0.44 -2.24 -0.40 -1.06 114.28 107.00 1fxy n THR 144 Ca 0.10 -0.79 -0.33 0.00 -2.27 0.00 0.00 64.05 60.76 1fxy n THR 144 Cb 0.31 0.84 -0.13 0.00 -2.10 0.00 0.00 70.33 69.24 1fxy n THR 144 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fxy s ALA 145 N -1.10 2.73 0.12 6.98 0.00 -1.26 -4.35 121.76 124.88 1fxy s ALA 145 Ca 0.25 -0.90 -0.20 0.00 0.00 0.00 0.00 51.96 51.11 1fxy s ALA 145 Cb 0.15 -1.20 -0.08 0.00 0.00 0.00 0.00 23.12 21.99 1fxy s ALA 145 CO 0.20 0.36 1.77 0.77 0.00 0.00 0.00 175.76 178.86 1fxy h SER 146 N 6.18 0.18 -3.25 0.00 0.02 -1.94 -3.40 113.55 111.35 1fxy h SER 146 Ca -0.34 -0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.09 1fxy h SER 146 Cb 1.19 -0.04 -0.38 0.00 0.14 0.00 0.00 62.40 63.31 1fxy h SER 146 CO 0.55 0.14 -0.79 -0.94 -1.14 0.00 0.00 176.83 174.65 1fxy s SER 147 N -5.34 2.31 0.00 3.07 1.04 -1.26 -4.58 113.70 108.93 1fxy s SER 147 Ca -0.13 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 55.89 1fxy s SER 147 Cb 0.08 -0.73 0.00 0.00 0.10 0.00 0.00 66.02 65.47 1fxy s SER 147 CO 0.69 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.34 1fxy n GLY 148 N 4.99 -0.14 3.03 7.32 0.00 -1.26 -5.01 105.19 114.11 1fxy n GLY 148 Ca -0.11 -2.29 -0.31 0.00 0.00 0.00 0.00 46.02 43.31 1fxy n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fxy s ALA 149 N -1.03 2.28 -0.31 4.61 0.00 -1.26 -4.62 121.76 121.42 1fxy s ALA 149 Ca 0.00 -1.51 -0.02 0.00 0.00 0.00 0.00 51.96 50.43 1fxy s ALA 149 Cb 0.00 -1.46 0.11 0.00 0.00 0.00 0.00 23.12 21.77 1fxy s ALA 149 CO 0.00 -1.06 0.15 0.34 0.00 0.00 0.00 175.76 175.19 1fxy s ASP 150 N 1.25 3.48 0.08 0.00 2.15 -1.26 -5.02 116.67 117.35 1fxy s ASP 150 Ca -0.06 -1.62 -0.15 0.00 0.43 0.00 0.00 52.55 51.15 1fxy s ASP 150 Cb -0.18 -0.47 -0.06 0.00 -0.30 0.00 0.00 42.92 41.90 1fxy s ASP 150 CO -0.07 -0.40 0.50 -0.31 -0.17 0.00 0.00 175.17 174.73 1fxy s TYR 151 N 1.70 3.69 0.54 -5.34 1.51 -1.26 -1.28 117.35 116.91 1fxy s TYR 151 Ca 0.12 1.07 -0.14 0.00 -1.01 0.00 0.00 57.07 57.11 1fxy s TYR 151 Cb -0.18 -2.36 -0.06 0.00 -0.11 0.00 0.00 41.96 39.25 1fxy s TYR 151 CO -0.24 0.54 0.98 -1.25 -1.11 0.00 0.00 175.55 174.46 1fxy s PRO 152 N -1.50 3.81 0.11 -1.71 0.04 -1.26 -4.99 135.00 129.50 1fxy s PRO 152 Ca 0.31 0.82 0.23 0.00 0.04 0.00 0.00 61.00 62.40 1fxy s PRO 152 Cb -0.16 -2.14 -0.01 0.00 0.04 0.00 0.00 34.50 32.22 1fxy s PRO 152 CO 0.17 -0.35 0.97 -0.25 0.04 0.00 0.00 177.00 177.58 1fxy n ASP 153 N -1.97 0.62 -4.26 6.66 8.00 -1.26 -4.90 116.55 119.43 1fxy n ASP 153 Ca 0.06 0.09 -0.23 0.00 0.71 0.00 0.00 54.79 55.41 1fxy n ASP 153 Cb 0.54 0.79 -0.13 0.00 -0.02 0.00 0.00 41.12 42.31 1fxy n ASP 153 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1fxy s GLU 154 N -3.32 1.11 0.20 -1.24 1.03 -1.26 -5.10 118.70 110.12 1fxy s GLU 154 Ca 0.00 -1.10 -0.33 0.00 0.03 0.00 0.00 54.97 53.58 1fxy s GLU 154 Cb 0.12 -1.32 -0.13 0.00 -0.80 0.00 0.00 34.13 32.00 1fxy s GLU 154 CO 0.81 0.31 1.59 -0.11 -1.33 0.00 0.00 175.26 176.53 1fxy n LEU 155 N 1.23 3.46 -4.91 1.83 7.94 -1.26 -4.92 117.00 120.37 1fxy n LEU 155 Ca -0.19 1.09 -0.31 0.00 -1.11 0.00 0.00 56.01 55.49 1fxy n LEU 155 Cb 0.54 -1.48 -0.04 0.00 0.53 0.00 0.00 43.42 42.96 1fxy n LEU 155 CO 0.22 -0.15 -0.04 -1.10 -1.11 0.00 0.00 177.39 175.21 1fxy s GLN 156 N 0.62 3.54 0.05 1.96 -1.52 -0.73 -1.68 119.66 121.89 1fxy s GLN 156 Ca 0.75 -0.26 0.05 0.00 -1.95 0.00 0.00 55.36 53.94 1fxy s GLN 156 Cb -0.61 -2.92 -0.02 0.00 -0.22 0.00 0.00 33.01 29.24 1fxy s GLN 156 CO 0.39 0.51 -0.13 0.00 -0.25 0.00 0.00 175.29 175.81 1fxy s LEU 158 N -1.37 0.49 -0.24 0.00 2.96 0.65 -1.38 118.68 119.78 1fxy s LEU 158 Ca -0.01 0.50 -0.10 0.00 -0.22 0.00 0.00 54.13 54.30 1fxy s LEU 158 Cb -0.09 0.70 -0.05 0.00 0.50 0.00 0.00 46.19 47.26 1fxy s LEU 158 CO 0.01 -0.16 0.14 -1.81 -1.32 0.00 0.00 176.35 173.21 1fxy s ASP 159 N 1.18 5.91 -0.01 3.68 1.01 -1.26 -0.24 116.67 126.94 1fxy s ASP 159 Ca -0.09 0.05 -0.08 0.00 0.71 0.00 0.00 52.55 53.15 1fxy s ASP 159 Cb -0.10 -2.06 0.01 0.00 1.01 0.00 0.00 42.92 41.77 1fxy s ASP 159 CO -0.08 0.06 0.17 0.00 0.21 0.00 0.00 175.17 175.53 1fxy s ALA 160 N 1.10 -0.40 0.45 5.23 0.00 -0.40 -4.94 121.76 122.79 1fxy s ALA 160 Ca 0.07 0.02 -0.12 0.00 0.00 0.00 0.00 51.96 51.93 1fxy s ALA 160 Cb -0.14 0.04 -0.07 0.00 0.00 0.00 0.00 23.12 22.96 1fxy s ALA 160 CO 0.04 -0.20 0.85 -1.25 0.00 0.00 0.00 175.76 175.20 1fxy s PRO 161 N -1.16 3.80 0.08 0.00 0.04 -1.26 -0.74 135.00 135.76 1fxy s PRO 161 Ca -0.12 0.61 -0.30 0.00 0.04 0.00 0.00 61.00 61.22 1fxy s PRO 161 Cb -0.06 -2.30 -0.05 0.00 0.04 0.00 0.00 34.50 32.13 1fxy s PRO 161 CO 0.02 -0.14 1.00 0.08 0.04 0.00 0.00 177.00 178.00 1fxy s VAL 162 N -2.51 4.52 0.21 -0.36 1.01 0.06 -2.16 120.40 121.17 1fxy s VAL 162 Ca 0.53 1.97 -0.04 0.00 0.00 0.00 0.00 61.98 64.44 1fxy s VAL 162 Cb -0.10 -4.26 -0.05 0.00 0.00 0.00 0.00 36.38 31.96 1fxy s VAL 162 CO 0.33 0.25 0.45 -0.76 0.00 0.00 0.00 175.10 175.37 1fxy s LEU 163 N 0.38 4.18 0.53 3.92 1.43 -0.36 -0.68 118.68 128.08 1fxy s LEU 163 Ca 0.50 0.62 -0.21 0.00 -1.03 0.00 0.00 54.13 54.01 1fxy s LEU 163 Cb -0.24 -3.39 -0.06 0.00 0.03 0.00 0.00 46.19 42.54 1fxy s LEU 163 CO 0.30 -0.06 1.23 -0.94 0.23 0.00 0.00 176.35 177.10 1fxy s SER 164 N -2.81 5.62 0.48 2.29 1.04 -1.26 -4.58 113.70 114.48 1fxy s SER 164 Ca 0.42 2.44 0.15 0.00 0.48 0.00 0.00 55.95 59.44 1fxy s SER 164 Cb -0.11 -2.61 1.15 0.00 0.10 0.00 0.00 66.02 64.55 1fxy s SER 164 CO 0.27 -1.30 2.08 1.56 0.98 0.00 0.00 173.24 176.83 1fxy h GLN 165 N 1.50 0.19 -0.44 4.02 1.08 -1.97 -1.93 115.11 117.57 1fxy h GLN 165 Ca -0.50 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 56.68 1fxy h GLN 165 Cb 1.28 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 28.64 1fxy h GLN 165 CO 0.58 0.13 0.25 0.00 -0.95 0.00 0.00 178.83 178.83 1fxy h ALA 166 N 1.86 0.57 -0.16 3.87 0.00 -1.99 0.15 119.26 123.55 1fxy h ALA 166 Ca 0.11 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 1fxy h ALA 166 Cb 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1fxy h ALA 166 CO -0.02 0.08 -0.52 0.87 0.00 0.00 0.00 179.25 179.67 1fxy h LYS 167 N 0.58 0.45 0.46 0.00 1.57 -1.78 -1.00 116.57 116.85 1fxy h LYS 167 Ca 0.16 -0.27 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 1fxy h LYS 167 Cb 0.04 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1fxy h LYS 167 CO -0.03 0.86 -0.22 0.00 -0.57 0.00 0.00 179.45 179.50 1fxy h GLU 169 N -0.77 0.63 0.00 0.00 5.08 -0.71 0.29 114.58 119.09 1fxy h GLU 169 Ca -0.06 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.20 1fxy h GLU 169 Cb 0.55 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1fxy h GLU 169 CO 0.10 0.42 -0.26 0.00 -1.00 0.00 0.00 179.01 178.27 1fxy h ALA 170 N 1.69 1.20 0.08 3.43 0.00 -0.94 -2.35 119.26 122.38 1fxy h ALA 170 Ca 0.20 -0.24 -0.25 0.00 0.00 0.00 0.00 54.91 54.62 1fxy h ALA 170 Cb 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1fxy h ALA 170 CO -0.05 0.33 -1.13 0.77 0.00 0.00 0.00 179.25 179.17 1fxy h SER 171 N 0.00 0.36 -2.33 0.00 0.02 0.31 -3.39 113.55 108.51 1fxy h SER 171 Ca -0.00 -0.36 -0.59 0.00 -0.84 0.00 0.00 61.79 60.00 1fxy h SER 171 Cb 0.61 -0.11 -0.40 0.00 0.14 0.00 0.00 62.40 62.64 1fxy h SER 171 CO 0.03 1.25 -0.89 -1.22 -1.14 0.00 0.00 176.83 174.86 1fxy n TYR 172 N -3.54 0.67 -1.71 3.45 4.02 -0.80 -4.91 117.16 114.34 1fxy n TYR 172 Ca -0.06 -3.69 -0.57 0.00 -0.01 0.00 0.00 57.90 53.57 1fxy n TYR 172 Cb 0.97 -0.22 -0.07 0.00 -0.02 0.00 0.00 39.34 40.00 1fxy n TYR 172 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1fxy n PRO 173 N 1.90 1.27 -0.80 -0.72 -0.02 -0.90 -1.58 135.00 134.15 1fxy n PRO 173 Ca 0.25 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1fxy n PRO 173 Cb 0.46 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1fxy n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fxy n GLY 174 N 4.25 0.45 0.63 -1.23 0.00 -1.26 -4.82 105.19 103.21 1fxy n GLY 174 Ca 0.26 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.36 1fxy n GLY 174 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fxy n LYS 175 N -1.82 1.37 -3.62 1.61 5.02 -0.62 -4.93 118.16 115.18 1fxy n LYS 175 Ca 0.00 -1.41 -0.38 0.00 -2.02 0.00 0.00 58.31 54.50 1fxy n LYS 175 Cb 0.05 -1.31 -0.11 0.00 -0.02 0.00 0.00 35.03 33.63 1fxy n LYS 175 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1fxy s ILE 176 N -1.46 5.04 0.56 -0.18 -1.09 -1.24 -5.05 121.20 117.79 1fxy s ILE 176 Ca 0.19 0.02 0.06 0.00 -2.23 0.00 0.00 60.65 58.68 1fxy s ILE 176 Cb 0.14 -3.42 0.07 0.00 -1.58 0.00 0.00 42.46 37.66 1fxy s ILE 176 CO 0.23 0.23 0.78 0.42 -1.23 0.00 0.00 174.94 175.37 1fxy s THR 177 N 1.71 2.43 0.07 2.92 -4.23 -1.26 -4.98 115.64 112.30 1fxy s THR 177 Ca 0.07 -0.86 0.33 0.00 -1.18 0.00 0.00 61.69 60.04 1fxy s THR 177 Cb -0.16 -2.57 0.36 0.00 1.34 0.00 0.00 72.50 71.47 1fxy s THR 177 CO 0.09 0.00 1.98 0.77 -0.54 0.00 0.00 174.62 176.92 1fxy h SER 178 N 0.13 0.00 -0.37 3.99 4.64 -2.03 -2.19 113.55 117.72 1fxy h SER 178 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1fxy h SER 178 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1fxy h SER 178 CO 0.43 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.98 1fxy n ASN 179 N -2.85 2.45 -4.25 4.97 3.02 -1.26 -4.88 115.26 112.46 1fxy n ASN 179 Ca 0.00 -2.12 -0.19 0.00 -0.03 0.00 0.00 54.58 52.24 1fxy n ASN 179 Cb 0.22 -0.34 -0.11 0.00 -0.61 0.00 0.00 39.78 38.94 1fxy n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1fxy s MET 180 N -1.59 1.05 0.01 3.52 -1.94 -0.82 -1.35 119.30 118.18 1fxy s MET 180 Ca 0.27 -1.23 -0.18 0.00 -1.71 0.00 0.00 55.69 52.84 1fxy s MET 180 Cb 0.16 -0.99 0.03 0.00 2.01 0.00 0.00 34.83 36.04 1fxy s MET 180 CO 0.16 0.20 0.39 -0.59 -0.01 0.00 0.00 175.02 175.16 1fxy s PHE 181 N -1.98 -0.25 -0.08 -0.03 -0.71 -0.83 -4.77 117.98 109.32 1fxy s PHE 181 Ca 0.09 0.30 -0.05 0.00 -1.04 0.00 0.00 56.93 56.23 1fxy s PHE 181 Cb -0.06 0.17 -0.04 0.00 -1.21 0.00 0.00 43.02 41.89 1fxy s PHE 181 CO 0.04 -0.50 0.12 0.00 -1.34 0.00 0.00 175.22 173.54 1fxy s VAL 183 N -1.10 -0.05 -5.00 0.00 1.01 -1.08 -1.22 120.40 112.96 1fxy s VAL 183 Ca 0.18 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.34 1fxy s VAL 183 Cb -0.12 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 36.15 1fxy s VAL 183 CO 0.08 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.87 1fxy n GLY 183 N 4.02 0.50 3.06 4.51 0.00 -0.92 -3.31 105.19 113.05 1fxy n GLY 183 Ca -0.25 -1.47 -0.26 0.00 0.00 0.00 0.00 46.02 44.03 1fxy n GLY 183 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fxy s PHE 184 N -3.80 1.69 0.25 1.61 0.40 -1.26 -4.38 117.98 112.49 1fxy s PHE 184 Ca 0.00 -0.65 0.31 0.00 -0.60 0.00 0.00 56.93 56.00 1fxy s PHE 184 Cb 0.00 -1.21 1.41 0.00 0.51 0.00 0.00 43.02 43.73 1fxy s PHE 184 CO 0.00 -0.31 2.01 -0.07 0.70 0.00 0.00 175.22 177.55 1fxy h LEU 185 N 6.94 0.00 0.00 -0.37 3.38 -1.95 -3.42 115.31 119.88 1fxy h LEU 185 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1fxy h LEU 185 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1fxy h LEU 185 CO 0.47 0.08 -0.21 -0.33 0.09 0.00 0.00 178.44 178.54 1fxy h GLU 186 N 0.00 0.00 0.00 1.13 5.08 -1.94 0.94 114.58 119.78 1fxy h GLU 186 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1fxy h GLU 186 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1fxy h GLU 186 CO 0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.43 1fxy n GLY 187 N 1.72 1.03 2.79 -3.84 0.00 -0.24 -4.49 105.19 102.15 1fxy n GLY 187 Ca -0.03 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.57 1fxy n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fxy s LYS 188 N 0.00 0.59 0.13 1.61 1.02 -1.26 -3.92 119.74 117.91 1fxy s LYS 188 Ca 0.00 0.09 -0.25 0.00 0.02 0.00 0.00 55.97 55.83 1fxy s LYS 188 Cb 0.00 -0.90 0.08 0.00 -0.52 0.00 0.00 37.83 36.49 1fxy s LYS 188 CO 0.00 -0.26 1.05 0.34 -0.92 0.00 0.00 175.35 175.56 1fxy s ASP 189 N 1.77 -0.10 0.87 2.83 2.15 -1.05 -4.17 116.67 118.98 1fxy s ASP 189 Ca 0.02 -0.44 -0.09 0.00 0.43 0.00 0.00 52.55 52.47 1fxy s ASP 189 Cb -0.13 0.43 0.17 0.00 -0.30 0.00 0.00 42.92 43.10 1fxy s ASP 189 CO -0.04 -0.81 1.09 -1.54 -0.17 0.00 0.00 175.17 173.69 1fxy n SER 190 N -0.72 0.59 -1.05 -0.34 3.41 -1.26 -0.03 113.62 114.22 1fxy n SER 190 Ca -0.05 -1.70 -0.00 0.00 -0.26 0.00 0.00 58.87 56.85 1fxy n SER 190 Cb 0.61 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1fxy n SER 190 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fxy n GLN 192 N -0.02 1.97 0.00 0.00 3.00 -1.26 -1.87 117.38 119.20 1fxy n GLN 192 Ca -0.00 0.70 0.00 0.00 -0.01 0.00 0.00 57.00 57.69 1fxy n GLN 192 Cb 0.02 -2.33 0.00 0.00 0.00 0.00 0.00 30.24 27.92 1fxy n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1fxy n GLY 193 N 2.02 2.95 0.13 1.08 0.00 -1.26 -0.71 105.19 109.40 1fxy n GLY 193 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1fxy n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1fxy h ASP 194 N 0.00 0.00 -1.50 1.61 3.32 -1.65 -3.23 116.42 114.97 1fxy h ASP 194 Ca 0.00 -0.05 -0.66 0.00 0.02 0.00 0.00 57.03 56.34 1fxy h ASP 194 Cb 0.00 0.00 0.10 0.00 0.22 0.00 0.00 39.33 39.65 1fxy h ASP 194 CO 0.00 0.02 -0.20 -1.20 -1.72 0.00 0.00 179.24 176.15 1fxy n SER 195 N -2.63 -0.13 0.00 6.45 7.64 -1.26 -0.88 113.62 122.80 1fxy n SER 195 Ca 0.02 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 1fxy n SER 195 Cb 0.51 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.64 1fxy n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fxy n GLY 196 N 1.75 3.12 3.65 0.23 0.00 -0.37 0.09 105.19 113.67 1fxy n GLY 196 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 1fxy n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fxy s GLY 197 N -2.02 1.66 0.40 -0.02 0.00 -0.06 -3.52 107.32 103.76 1fxy s GLY 197 Ca 0.00 0.39 -0.19 0.00 0.00 0.00 0.00 44.72 44.92 1fxy s GLY 197 CO 0.00 0.86 0.89 2.56 0.00 0.00 0.00 173.10 177.42 1fxy s PRO 198 N -4.66 4.17 -0.34 2.90 0.04 -1.26 -1.62 135.00 134.23 1fxy s PRO 198 Ca 0.66 1.00 0.01 0.00 0.04 0.00 0.00 61.00 62.71 1fxy s PRO 198 Cb -0.22 -2.24 0.11 0.00 0.04 0.00 0.00 34.50 32.18 1fxy s PRO 198 CO 0.59 0.02 0.12 0.08 0.04 0.00 0.00 177.00 177.84 1fxy s VAL 199 N -2.13 1.20 -0.26 -0.36 1.01 -0.94 -3.37 120.40 115.55 1fxy s VAL 199 Ca 0.60 -1.77 -0.08 0.00 0.00 0.00 0.00 61.98 60.73 1fxy s VAL 199 Cb -0.09 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1fxy s VAL 199 CO 0.14 -0.71 0.10 -0.69 0.00 0.00 0.00 175.10 173.95 1fxy s VAL 200 N 1.26 4.55 -0.21 2.92 1.01 -0.64 -1.15 120.40 128.14 1fxy s VAL 200 Ca 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 1fxy s VAL 200 Cb -0.19 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.05 1fxy s VAL 200 CO -0.18 0.30 -0.11 0.00 0.00 0.00 0.00 175.10 175.11 1fxy n ASN 202 N 4.68 -2.97 0.00 0.00 4.13 -1.25 -1.88 115.26 117.97 1fxy n ASN 202 Ca -0.19 -0.80 0.00 0.00 1.68 0.00 0.00 54.58 55.28 1fxy n ASN 202 Cb 0.49 -3.99 0.00 0.00 -1.54 0.00 0.00 39.78 34.75 1fxy n ASN 202 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1fxy n GLY 203 N -1.65 1.02 3.39 7.41 0.00 -1.26 -5.03 105.19 109.06 1fxy n GLY 203 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 1fxy n GLY 203 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fxy s GLN 204 N -0.01 1.97 -0.56 1.61 -0.21 -0.79 -4.41 119.66 117.26 1fxy s GLN 204 Ca 0.00 -1.02 -0.28 0.00 0.02 0.00 0.00 55.36 54.08 1fxy s GLN 204 Cb 0.00 -2.09 0.02 0.00 1.00 0.00 0.00 33.01 31.94 1fxy s GLN 204 CO 0.00 0.53 1.30 -1.17 -2.12 0.00 0.00 175.29 173.83 1fxy s LEU 209 N -1.23 3.44 -0.04 2.90 2.96 0.36 -0.97 118.68 126.11 1fxy s LEU 209 Ca 0.13 0.23 0.19 0.00 -0.22 0.00 0.00 54.13 54.46 1fxy s LEU 209 Cb -0.10 -3.15 -0.30 0.00 0.50 0.00 0.00 46.19 43.14 1fxy s LEU 209 CO 0.03 -1.57 0.40 0.00 -1.32 0.00 0.00 176.35 173.89 1fxy n GLN 210 N 8.50 0.63 -4.00 1.98 1.13 -0.30 -3.63 117.38 121.68 1fxy n GLN 210 Ca 0.11 -0.16 -0.09 0.00 -1.94 0.00 0.00 57.00 54.91 1fxy n GLN 210 Cb 0.49 -1.46 -0.05 0.00 0.11 0.00 0.00 30.24 29.32 1fxy n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1fxy s GLY 211 N -4.33 0.55 -0.06 1.08 0.00 -1.06 -1.95 107.32 101.56 1fxy s GLY 211 Ca -0.07 -0.89 0.02 0.00 0.00 0.00 0.00 44.72 43.77 1fxy s GLY 211 CO 0.80 -0.65 -0.11 0.14 0.00 0.00 0.00 173.10 173.29 1fxy s VAL 212 N -4.02 1.03 0.17 1.40 1.01 -1.05 -2.21 120.40 116.73 1fxy s VAL 212 Ca 0.23 -0.43 -0.32 0.00 0.00 0.00 0.00 61.98 61.46 1fxy s VAL 212 Cb -0.00 -0.94 -0.12 0.00 0.00 0.00 0.00 36.38 35.32 1fxy s VAL 212 CO 0.09 0.33 1.76 0.52 0.00 0.00 0.00 175.10 177.80 1fxy n VAL 213 N 3.76 0.14 0.01 2.92 0.31 -0.64 -1.48 118.33 123.34 1fxy n VAL 213 Ca -0.23 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1fxy n VAL 213 Cb 0.52 -2.02 0.00 0.00 -0.91 0.00 0.00 33.84 31.43 1fxy n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1fxy n SER 214 N 4.58 0.07 -2.99 4.52 2.88 -1.13 -1.24 113.62 120.31 1fxy n SER 214 Ca 0.17 0.02 -0.09 0.00 -1.33 0.00 0.00 58.87 57.63 1fxy n SER 214 Cb 0.35 -0.02 0.02 0.00 -0.75 0.00 0.00 64.21 63.81 1fxy n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1fxy s TRP 215 N -1.08 0.20 0.00 0.66 1.48 -0.82 -4.91 118.94 114.47 1fxy s TRP 215 Ca 0.00 -0.83 0.00 0.00 -1.06 0.00 0.00 56.10 54.21 1fxy s TRP 215 Cb 0.00 0.75 0.00 0.00 -1.16 0.00 0.00 33.47 33.06 1fxy s TRP 215 CO 0.00 -1.52 0.00 0.41 -4.06 0.00 0.00 176.95 171.78 1fxy n GLY 216 N -0.53 0.55 3.41 3.67 0.00 -1.26 -0.28 105.19 110.75 1fxy n GLY 216 Ca -0.07 -0.87 -0.44 0.00 0.00 0.00 0.00 46.02 44.64 1fxy n GLY 216 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fxy s ASP 217 N 0.00 6.19 0.29 1.61 2.15 -1.26 -4.89 116.67 120.75 1fxy s ASP 217 Ca 0.00 -1.26 0.00 0.00 0.43 0.00 0.00 52.55 51.72 1fxy s ASP 217 Cb 0.00 -2.35 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 1fxy s ASP 217 CO 0.00 -1.25 0.00 0.61 -0.17 0.00 0.00 175.17 174.36 1fxy n GLY 219 N 5.30 -0.22 2.88 2.66 0.00 -1.26 -4.64 105.19 109.91 1fxy n GLY 219 Ca -0.07 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 44.78 1fxy n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fxy n ALA 220 N 4.62 -0.40 -1.79 0.00 0.00 -1.26 -4.68 120.51 116.99 1fxy n ALA 220 Ca -0.19 0.27 -0.33 0.00 0.00 0.00 0.00 53.44 53.20 1fxy n ALA 220 Cb 0.51 -2.06 -0.04 0.00 0.00 0.00 0.00 19.45 17.87 1fxy n ALA 220 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1fxy s GLN 221 N -4.14 3.86 0.19 0.00 -1.52 -1.26 -1.08 119.66 115.70 1fxy s GLN 221 Ca 0.00 1.18 -0.31 0.00 -1.95 0.00 0.00 55.36 54.28 1fxy s GLN 221 Cb 0.00 -2.11 -0.10 0.00 -0.22 0.00 0.00 33.01 30.58 1fxy s GLN 221 CO 0.00 -0.36 1.52 0.21 -0.25 0.00 0.00 175.29 176.41 1fxy s LYS 222 N -3.57 4.24 -1.21 2.91 2.20 -1.26 -2.14 119.74 120.91 1fxy s LYS 222 Ca 0.63 2.33 0.00 0.00 -0.36 0.00 0.00 55.97 58.57 1fxy s LYS 222 Cb -0.13 -3.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.04 1fxy s LYS 222 CO 0.24 -0.54 0.00 0.09 -0.36 0.00 0.00 175.35 174.77 1fxy n ASN 223 N 3.50 -5.13 -3.35 1.43 3.02 0.32 -4.91 115.26 110.14 1fxy n ASN 223 Ca 0.12 0.28 -0.26 0.00 -0.03 0.00 0.00 54.58 54.69 1fxy n ASN 223 Cb 0.39 -3.63 -0.08 0.00 -0.61 0.00 0.00 39.78 35.86 1fxy n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1fxy n LYS 224 N -1.66 1.71 -1.84 3.52 4.01 -0.91 -4.72 118.16 118.28 1fxy n LYS 224 Ca -0.11 -4.05 -0.32 0.00 -0.51 0.00 0.00 58.31 53.31 1fxy n LYS 224 Cb 0.50 -1.84 0.03 0.00 -0.51 0.00 0.00 35.03 33.21 1fxy n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1fxy s PRO 225 N -1.84 3.06 0.44 1.97 0.04 -1.26 -4.22 135.00 133.19 1fxy s PRO 225 Ca 0.37 1.19 -0.26 0.00 0.04 0.00 0.00 61.00 62.35 1fxy s PRO 225 Cb 0.14 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 32.60 1fxy s PRO 225 CO -0.06 -1.01 1.41 0.20 0.04 0.00 0.00 177.00 177.57 1fxy s GLY 226 N -2.98 2.92 -0.16 0.56 0.00 -1.21 -4.75 107.32 101.70 1fxy s GLY 226 Ca 0.63 1.43 -0.05 0.00 0.00 0.00 0.00 44.72 46.73 1fxy s GLY 226 CO 0.43 2.04 -0.02 0.14 0.00 0.00 0.00 173.10 175.69 1fxy s VAL 227 N -1.21 4.08 0.19 1.40 1.01 0.62 -2.62 120.40 123.87 1fxy s VAL 227 Ca 0.60 -0.29 0.11 0.00 0.00 0.00 0.00 61.98 62.40 1fxy s VAL 227 Cb -0.43 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1fxy s VAL 227 CO 0.55 0.48 -0.24 -0.31 0.00 0.00 0.00 175.10 175.59 1fxy s TYR 228 N 0.38 2.29 -0.04 5.22 1.51 -0.01 -1.95 117.35 124.75 1fxy s TYR 228 Ca -0.02 -0.36 -0.30 0.00 -1.01 0.00 0.00 57.07 55.37 1fxy s TYR 228 Cb -0.14 -1.13 -0.04 0.00 -0.11 0.00 0.00 41.96 40.54 1fxy s TYR 228 CO 0.02 0.49 1.22 0.99 -1.11 0.00 0.00 175.55 177.16 1fxy s THR 229 N -1.67 4.18 -0.93 -0.71 2.01 -0.55 -1.97 115.64 116.00 1fxy s THR 229 Ca 0.20 1.52 -0.24 0.00 0.31 0.00 0.00 61.69 63.48 1fxy s THR 229 Cb -0.08 -3.98 0.04 0.00 0.01 0.00 0.00 72.50 68.49 1fxy s THR 229 CO 0.10 0.01 1.42 -0.75 -0.69 0.00 0.00 174.62 174.71 1fxy s LYS 230 N 2.10 3.43 0.47 4.92 2.20 -0.45 -2.53 119.74 129.87 1fxy s LYS 230 Ca 0.57 -0.81 0.22 0.00 -0.36 0.00 0.00 55.97 55.59 1fxy s LYS 230 Cb -0.26 -5.00 1.23 0.00 -1.51 0.00 0.00 37.83 32.30 1fxy s LYS 230 CO 0.23 -2.24 1.90 0.28 -0.36 0.00 0.00 175.35 175.16 1fxy h VAL 231 N 6.60 0.67 -0.61 4.02 2.07 -1.70 -1.84 116.25 125.45 1fxy h VAL 231 Ca 0.05 -0.08 0.08 0.00 0.82 0.00 0.00 66.70 67.57 1fxy h VAL 231 Cb 1.02 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 1fxy h VAL 231 CO 1.38 0.04 0.41 0.22 0.02 0.00 0.00 177.57 179.64 1fxy h TYR 232 N 0.24 0.55 0.00 1.57 3.20 -1.84 0.17 116.97 120.85 1fxy h TYR 232 Ca 0.41 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.29 1fxy h TYR 232 Cb 1.23 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.32 1fxy h TYR 232 CO -0.00 0.28 0.00 0.09 -1.64 0.00 0.00 178.16 176.89 1fxy n ASN 233 N -4.48 0.70 -0.65 -2.11 4.13 -0.69 -3.31 115.26 108.86 1fxy n ASN 233 Ca 0.09 0.63 0.06 0.00 1.68 0.00 0.00 54.58 57.04 1fxy n ASN 233 Cb 0.29 -0.79 0.15 0.00 -1.54 0.00 0.00 39.78 37.89 1fxy n ASN 233 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1fxy n TYR 234 N -2.23 0.46 -0.26 3.10 4.01 0.02 -4.65 117.16 117.61 1fxy n TYR 234 Ca 0.04 -0.49 0.01 0.00 -0.16 0.00 0.00 57.90 57.29 1fxy n TYR 234 Cb 0.31 -0.03 0.13 0.00 -0.31 0.00 0.00 39.34 39.44 1fxy n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1fxy h VAL 235 N 2.06 0.93 -0.40 -0.72 2.07 -1.48 0.12 116.25 118.84 1fxy h VAL 235 Ca 0.00 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.20 1fxy h VAL 235 Cb 0.73 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1fxy h VAL 235 CO 0.00 0.13 -0.03 0.50 0.02 0.00 0.00 177.57 178.20 1fxy h LYS 236 N 0.73 0.72 -0.46 1.57 3.64 -1.86 -1.32 116.57 119.60 1fxy h LYS 236 Ca 0.35 -0.24 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 1fxy h LYS 236 Cb 0.28 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1fxy h LYS 236 CO -0.22 0.82 0.13 2.35 -2.27 0.00 0.00 179.45 180.27 1fxy h TRP 237 N 0.54 0.74 0.03 1.91 7.01 -1.72 -1.68 115.95 122.77 1fxy h TRP 237 Ca 0.11 -0.08 -0.00 0.00 2.11 0.00 0.00 58.89 61.03 1fxy h TRP 237 Cb 0.52 -0.21 0.00 0.00 -2.10 0.00 0.00 29.16 27.37 1fxy h TRP 237 CO 0.04 0.67 -0.01 0.82 -2.79 0.00 0.00 178.44 177.17 1fxy h ILE 238 N 0.60 1.10 -0.09 2.65 2.04 -0.70 -1.04 117.51 122.07 1fxy h ILE 238 Ca 0.15 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.63 1fxy h ILE 238 Cb 0.28 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1fxy h ILE 238 CO -0.00 0.10 0.02 0.11 0.00 0.00 0.00 178.15 178.37 1fxy h LYS 239 N -0.20 0.05 -0.12 2.37 1.57 -1.21 -1.43 116.57 117.61 1fxy h LYS 239 Ca -0.00 -0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.64 1fxy h LYS 239 Cb 0.19 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1fxy h LYS 239 CO 0.01 0.04 -0.51 -0.91 -0.57 0.00 0.00 179.45 177.51 1fxy h ASN 240 N 0.06 0.35 -0.51 0.86 2.35 -1.35 -1.57 115.58 115.78 1fxy h ASN 240 Ca 0.04 -0.18 -0.12 0.00 -0.55 0.00 0.00 56.30 55.50 1fxy h ASN 240 Cb 0.03 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1fxy h ASN 240 CO -0.05 0.80 -0.13 0.74 -1.65 0.00 0.00 177.43 177.14 1fxy h THR 241 N 0.26 1.27 -0.39 2.81 2.02 -1.04 0.27 112.91 118.11 1fxy h THR 241 Ca 0.01 -1.29 -0.15 0.00 0.77 0.00 0.00 66.41 65.75 1fxy h THR 241 Cb 0.98 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 1fxy h THR 241 CO 0.08 0.45 -0.36 0.40 0.37 0.00 0.00 175.52 176.46 1fxy h ILE 242 N 0.88 1.27 0.00 3.11 2.04 -1.16 -2.48 117.51 121.18 1fxy h ILE 242 Ca 0.13 -1.54 -0.12 0.00 1.00 0.00 0.00 64.86 64.34 1fxy h ILE 242 Cb 0.70 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 1fxy h ILE 242 CO 0.05 0.51 -0.59 0.00 0.00 0.00 0.00 178.15 178.13 1fxy h ALA 243 N 0.82 0.99 0.00 1.87 0.00 -1.07 -1.94 119.26 119.92 1fxy h ALA 243 Ca 0.07 -0.53 -0.09 0.00 0.00 0.00 0.00 54.91 54.36 1fxy h ALA 243 Cb 0.95 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1fxy h ALA 243 CO 0.09 0.73 -0.42 0.00 0.00 0.00 0.00 179.25 179.65 1fxy h ALA 244 N 1.41 1.01 -0.37 0.00 0.00 -0.32 -2.93 119.26 118.07 1fxy h ALA 244 Ca -0.01 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 1fxy h ALA 244 Cb 1.06 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1fxy h ALA 244 CO 0.08 0.52 0.03 0.09 0.00 0.00 0.00 179.25 179.96 1fxy n ASN 245 N -3.61 4.04 0.00 0.00 3.02 -0.95 -5.08 115.26 112.68 1fxy n ASN 245 Ca -0.00 -3.13 0.00 0.00 -0.03 0.00 0.00 54.58 51.41 1fxy n ASN 245 Cb 0.52 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 1fxy n ASN 245 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44