#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fqj s THR 29 N 0.00 1.95 -0.09 5.15 2.01 -1.26 -1.66 115.64 121.74 1fqj s THR 29 Ca 0.00 -1.14 0.03 0.00 0.31 0.00 0.00 61.69 60.89 1fqj s THR 29 Cb 0.00 -1.64 0.00 0.00 0.01 0.00 0.00 72.50 70.88 1fqj s THR 29 CO 0.00 0.47 -0.20 0.54 -0.69 0.00 0.00 174.62 174.75 1fqj s VAL 30 N -0.65 1.71 -0.35 3.82 0.11 0.06 -4.94 120.40 120.16 1fqj s VAL 30 Ca 0.10 -0.81 -0.13 0.00 -2.93 0.00 0.00 61.98 58.21 1fqj s VAL 30 Cb -0.09 -1.50 -0.01 0.00 -1.53 0.00 0.00 36.38 33.25 1fqj s VAL 30 CO 0.00 0.48 0.24 -0.75 -3.33 0.00 0.00 175.10 171.74 1fqj s LYS 31 N 0.46 3.35 -0.16 1.54 2.20 -1.26 -0.88 119.74 124.99 1fqj s LYS 31 Ca -0.17 -0.75 0.01 0.00 -0.36 0.00 0.00 55.97 54.70 1fqj s LYS 31 Cb -0.17 -3.81 0.00 0.00 -1.51 0.00 0.00 37.83 32.34 1fqj s LYS 31 CO 0.07 -0.51 -0.17 -1.17 -0.36 0.00 0.00 175.35 173.21 1fqj s LEU 32 N 1.70 2.40 -0.19 5.43 2.96 -0.73 -0.68 118.68 129.57 1fqj s LEU 32 Ca 0.06 -0.50 -0.07 0.00 -0.22 0.00 0.00 54.13 53.39 1fqj s LEU 32 Cb -0.18 -1.54 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 1fqj s LEU 32 CO 0.10 0.08 0.05 -0.76 -1.32 0.00 0.00 176.35 174.49 1fqj s LEU 33 N 0.87 3.66 -0.53 -0.68 1.43 -0.56 -1.11 118.68 121.75 1fqj s LEU 33 Ca -0.05 -0.01 -0.18 0.00 -1.03 0.00 0.00 54.13 52.87 1fqj s LEU 33 Cb -0.15 -1.93 0.08 0.00 0.03 0.00 0.00 46.19 44.22 1fqj s LEU 33 CO -0.01 0.13 0.61 -0.76 0.23 0.00 0.00 176.35 176.55 1fqj s LEU 34 N 0.61 5.31 0.30 1.79 1.02 -0.45 -1.21 118.68 126.04 1fqj s LEU 34 Ca 0.02 -1.22 0.09 0.00 0.02 0.00 0.00 54.13 53.05 1fqj s LEU 34 Cb -0.13 -2.34 -0.05 0.00 0.02 0.00 0.00 46.19 43.69 1fqj s LEU 34 CO 0.02 -0.93 0.03 -0.76 0.02 0.00 0.00 176.35 174.73 1fqj s LEU 35 N 2.41 3.15 0.00 1.79 1.43 -0.57 -3.95 118.68 122.95 1fqj s LEU 35 Ca 0.11 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 52.45 1fqj s LEU 35 Cb -0.22 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.37 1fqj s LEU 35 CO 0.08 -0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.15 1fqj n GLY 36 N -0.97 3.09 3.67 -3.19 0.00 -1.26 -0.03 105.19 106.51 1fqj n GLY 36 Ca -0.05 -1.36 -0.30 0.00 0.00 0.00 0.00 46.02 44.31 1fqj n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fqj s ALA 37 N -2.00 0.99 0.45 4.61 0.00 -1.26 -4.39 121.76 120.15 1fqj s ALA 37 Ca 0.00 -0.85 -0.25 0.00 0.00 0.00 0.00 51.96 50.86 1fqj s ALA 37 Cb 0.00 -2.92 -0.08 0.00 0.00 0.00 0.00 23.12 20.11 1fqj s ALA 37 CO 0.00 -3.19 1.37 0.41 0.00 0.00 0.00 175.76 174.35 1fqj n GLY 38 N -1.48 0.84 3.01 0.00 0.00 -1.14 -3.16 105.19 103.26 1fqj n GLY 38 Ca 0.11 0.17 -0.21 0.00 0.00 0.00 0.00 46.02 46.09 1fqj n GLY 38 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fqj n GLU 39 N -0.21 -3.86 0.03 1.61 1.02 -1.26 -4.89 120.64 113.08 1fqj n GLU 39 Ca 0.06 0.75 0.11 0.00 -0.02 0.00 0.00 57.16 58.06 1fqj n GLU 39 Cb 0.41 -5.52 0.06 0.00 -0.02 0.00 0.00 31.44 26.38 1fqj n GLU 39 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1fqj n SER 40 N -2.33 0.63 0.00 1.62 3.41 -1.19 -4.87 113.62 110.90 1fqj n SER 40 Ca -0.10 -0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.31 1fqj n SER 40 Cb 0.60 0.66 0.00 0.00 -0.26 0.00 0.00 64.21 65.21 1fqj n SER 40 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fqj n GLY 41 N 1.38 1.02 0.31 5.00 0.00 -1.26 -4.31 105.19 107.34 1fqj n GLY 41 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 1fqj n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fqj h LYS 42 N 0.00 -0.12 0.00 1.61 1.57 -1.93 -1.74 116.57 115.97 1fqj h LYS 42 Ca 0.00 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1fqj h LYS 42 Cb 0.00 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1fqj h LYS 42 CO 0.00 -0.08 -0.18 0.77 -0.57 0.00 0.00 179.45 179.39 1fqj h SER 43 N -0.12 0.00 -0.17 0.86 0.02 -1.97 -2.46 113.55 109.71 1fqj h SER 43 Ca 0.25 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 61.01 1fqj h SER 43 Cb 0.53 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.07 1fqj h SER 43 CO -0.66 0.18 -0.64 0.74 -1.14 0.00 0.00 176.83 175.32 1fqj h THR 44 N 0.00 1.30 -0.99 -2.27 2.02 -1.70 -0.43 112.91 110.85 1fqj h THR 44 Ca -0.00 -1.86 0.04 0.00 0.77 0.00 0.00 66.41 65.36 1fqj h THR 44 Cb 0.71 1.96 -0.06 0.00 -1.74 0.00 0.00 68.15 69.02 1fqj h THR 44 CO 0.02 0.59 0.64 0.40 0.37 0.00 0.00 175.52 177.54 1fqj h ILE 45 N 0.44 1.15 -0.40 3.11 1.08 -1.14 -0.42 117.51 121.32 1fqj h ILE 45 Ca -0.03 -0.42 -0.04 0.00 -0.39 0.00 0.00 64.86 63.98 1fqj h ILE 45 Cb 1.27 -0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.82 1fqj h ILE 45 CO 0.13 0.22 0.09 0.58 -0.69 0.00 0.00 178.15 178.49 1fqj h VAL 46 N 1.22 1.23 -1.00 1.67 2.07 -1.18 -2.14 116.25 118.13 1fqj h VAL 46 Ca 0.40 -0.81 0.10 0.00 0.82 0.00 0.00 66.70 67.21 1fqj h VAL 46 Cb 0.05 0.99 -0.08 0.00 -1.52 0.00 0.00 31.29 30.73 1fqj h VAL 46 CO -0.14 0.28 0.64 0.11 0.02 0.00 0.00 177.57 178.48 1fqj h LYS 47 N 0.51 1.03 -0.41 1.57 1.57 -0.11 -1.67 116.57 119.06 1fqj h LYS 47 Ca 0.13 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1fqj h LYS 47 Cb 0.33 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1fqj h LYS 47 CO 0.00 0.68 0.23 1.96 -0.57 0.00 0.00 179.45 181.75 1fqj h GLN 48 N 1.06 0.58 -0.57 3.15 1.08 -0.67 -1.96 115.11 117.78 1fqj h GLN 48 Ca 0.47 -0.07 0.15 0.00 -1.45 0.00 0.00 58.65 57.75 1fqj h GLN 48 Cb 0.36 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.65 1fqj h GLN 48 CO -0.22 0.46 0.40 0.52 -0.95 0.00 0.00 178.83 179.04 1fqj h MET 49 N 0.54 0.08 0.02 1.46 2.86 -0.68 0.16 114.93 119.37 1fqj h MET 49 Ca 0.15 -0.01 -0.21 0.00 -2.06 0.00 0.00 59.70 57.57 1fqj h MET 49 Cb 0.05 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1fqj h MET 49 CO -0.02 0.06 -0.95 -0.22 1.06 0.00 0.00 176.91 176.83 1fqj h LYS 50 N 0.09 0.17 -0.16 1.72 3.64 -1.03 -0.89 116.57 120.12 1fqj h LYS 50 Ca 0.27 -0.22 -0.17 0.00 -1.27 0.00 0.00 60.65 59.26 1fqj h LYS 50 Cb 0.96 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.85 1fqj h LYS 50 CO -0.03 1.00 -0.58 0.82 -2.27 0.00 0.00 179.45 178.39 1fqj h ILE 51 N 0.08 1.32 0.00 2.00 2.04 -0.28 0.24 117.51 122.92 1fqj h ILE 51 Ca -0.05 -1.83 0.00 0.00 1.00 0.00 0.00 64.86 63.98 1fqj h ILE 51 Cb 1.61 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 39.69 1fqj h ILE 51 CO 0.14 0.57 -0.15 0.40 0.00 0.00 0.00 178.15 179.11 1fqj h ILE 52 N 0.35 0.00 -0.33 -0.67 2.04 -0.90 -3.40 117.51 114.60 1fqj h ILE 52 Ca -0.03 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.19 1fqj h ILE 52 Cb 1.21 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1fqj h ILE 52 CO 0.12 0.00 0.00 1.41 0.00 0.00 0.00 178.15 179.68 1fqj n HIS 53 N -3.77 0.57 -3.63 1.37 8.25 -0.34 -4.93 115.22 112.74 1fqj n HIS 53 Ca -0.02 -0.25 0.00 0.00 -0.26 0.00 0.00 57.72 57.19 1fqj n HIS 53 Cb 0.08 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.13 1fqj n HIS 53 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1fqj n GLN 54 N 0.47 0.00 0.00 -0.41 6.02 -1.14 -4.76 117.38 117.56 1fqj n GLN 54 Ca 0.12 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.15 1fqj n GLN 54 Cb 0.37 0.00 0.27 0.00 1.02 0.00 0.00 30.24 31.91 1fqj n GLN 54 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1fqj n ASP 55 N -1.99 0.00 0.00 1.08 10.43 -1.24 -4.71 116.55 120.12 1fqj n ASP 55 Ca 0.00 -1.17 0.00 0.00 2.57 0.00 0.00 54.79 56.19 1fqj n ASP 55 Cb 0.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 42.96 1fqj n ASP 55 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1fqj n GLY 56 N 0.32 0.95 3.38 0.44 0.00 0.84 -4.64 105.19 106.48 1fqj n GLY 56 Ca 0.07 -0.66 -0.34 0.00 0.00 0.00 0.00 46.02 45.09 1fqj n GLY 56 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fqj s TYR 57 N 0.00 2.95 0.95 1.61 1.51 -1.26 -4.85 117.35 118.26 1fqj s TYR 57 Ca 0.00 -0.67 -0.15 0.00 -1.01 0.00 0.00 57.07 55.25 1fqj s TYR 57 Cb 0.00 -2.02 0.17 0.00 -0.11 0.00 0.00 41.96 40.00 1fqj s TYR 57 CO 0.00 -0.32 1.21 -1.54 -1.11 0.00 0.00 175.55 173.79 1fqj s SER 58 N 0.94 3.22 0.10 2.29 1.04 -1.26 -4.84 113.70 115.20 1fqj s SER 58 Ca -0.00 0.62 -0.19 0.00 0.48 0.00 0.00 55.95 56.85 1fqj s SER 58 Cb -0.15 -0.93 -0.07 0.00 0.10 0.00 0.00 66.02 64.97 1fqj s SER 58 CO 0.01 -2.70 1.65 0.25 0.98 0.00 0.00 173.24 173.43 1fqj h LEU 59 N -1.61 0.32 -1.91 2.42 5.85 -1.99 -1.56 115.31 116.82 1fqj h LEU 59 Ca -0.46 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.07 1fqj h LEU 59 Cb 1.29 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 1fqj h LEU 59 CO 0.50 0.39 -0.11 -0.33 -0.34 0.00 0.00 178.44 178.55 1fqj h GLU 60 N 0.23 0.00 0.05 1.25 5.08 -2.00 -1.16 114.58 118.03 1fqj h GLU 60 Ca 0.08 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.20 1fqj h GLU 60 Cb 0.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1fqj h GLU 60 CO -0.01 0.11 -1.06 0.93 -1.00 0.00 0.00 179.01 177.99 1fqj h GLU 61 N 0.00 0.30 -0.28 2.33 5.08 -1.82 -3.18 114.58 117.00 1fqj h GLU 61 Ca -0.00 -0.39 -0.11 0.00 -1.00 0.00 0.00 59.36 57.85 1fqj h GLU 61 Cb 0.33 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 1fqj h GLU 61 CO 0.01 1.12 -0.27 0.00 -1.00 0.00 0.00 179.01 178.88 1fqj h LEU 63 N 0.41 0.28 -2.04 0.00 3.38 -1.31 0.48 115.31 116.51 1fqj h LEU 63 Ca 0.05 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1fqj h LEU 63 Cb 0.83 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 1fqj h LEU 63 CO 0.07 0.16 -0.09 -0.33 0.09 0.00 0.00 178.44 178.34 1fqj h GLU 64 N 0.31 0.00 -0.00 1.13 4.39 -1.50 -2.17 114.58 116.74 1fqj h GLU 64 Ca 0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1fqj h GLU 64 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1fqj h GLU 64 CO -0.07 0.09 -0.00 1.19 -1.16 0.00 0.00 179.01 179.06 1fqj n PHE 65 N -3.73 0.00 0.05 4.33 3.72 0.16 -3.96 117.46 118.02 1fqj n PHE 65 Ca -0.02 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.25 1fqj n PHE 65 Cb 0.20 -0.24 -0.08 0.00 -0.94 0.00 0.00 39.48 38.42 1fqj n PHE 65 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1fqj h ILE 66 N 0.01 1.06 -0.81 4.37 2.04 -1.47 0.15 117.51 122.86 1fqj h ILE 66 Ca 0.00 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.51 1fqj h ILE 66 Cb 0.24 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 1fqj h ILE 66 CO 0.00 0.09 0.53 0.00 0.00 0.00 0.00 178.15 178.77 1fqj h ALA 67 N 0.71 1.02 -0.15 1.87 0.00 -1.75 0.12 119.26 121.09 1fqj h ALA 67 Ca -0.01 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1fqj h ALA 67 Cb 0.20 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1fqj h ALA 67 CO 0.01 0.44 0.02 0.82 0.00 0.00 0.00 179.25 180.54 1fqj h ILE 68 N 1.09 0.92 -0.50 0.00 1.08 -1.69 0.43 117.51 118.85 1fqj h ILE 68 Ca 0.30 -0.03 -0.06 0.00 -0.39 0.00 0.00 64.86 64.68 1fqj h ILE 68 Cb -0.12 0.83 -0.02 0.00 -3.07 0.00 0.00 36.82 34.44 1fqj h ILE 68 CO -0.06 0.01 0.09 0.40 -0.69 0.00 0.00 178.15 177.90 1fqj h ILE 69 N 0.08 1.25 -0.40 -0.67 2.04 -0.16 -0.74 117.51 118.91 1fqj h ILE 69 Ca 0.07 -0.91 -0.06 0.00 1.00 0.00 0.00 64.86 64.96 1fqj h ILE 69 Cb 0.07 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1fqj h ILE 69 CO -0.10 0.33 -0.01 1.88 0.00 0.00 0.00 178.15 180.25 1fqj h TYR 70 N 0.70 0.67 -0.20 1.37 0.05 -0.58 -0.57 116.97 118.41 1fqj h TYR 70 Ca 0.15 -0.08 -0.03 0.00 0.05 0.00 0.00 58.73 58.82 1fqj h TYR 70 Cb 0.38 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 1fqj h TYR 70 CO 0.03 0.64 0.01 0.78 -1.05 0.00 0.00 178.16 178.57 1fqj h GLY 71 N 0.91 0.37 0.73 3.88 0.00 -0.60 -1.76 103.07 106.60 1fqj h GLY 71 Ca 0.12 -0.26 0.06 0.00 0.00 0.00 0.00 47.33 47.25 1fqj h GLY 71 CO 0.02 0.24 0.61 3.43 0.00 0.00 0.00 176.54 180.84 1fqj h ASN 72 N 0.12 0.98 -0.09 0.19 -0.26 -0.77 -0.86 115.58 114.89 1fqj h ASN 72 Ca 0.06 0.01 -0.02 0.00 -0.56 0.00 0.00 56.30 55.79 1fqj h ASN 72 Cb 0.36 -0.20 -0.00 0.00 -1.06 0.00 0.00 38.32 37.42 1fqj h ASN 72 CO 0.01 0.62 -0.00 0.74 -1.06 0.00 0.00 177.43 177.74 1fqj h THR 73 N 1.11 1.26 -0.23 2.81 2.02 -0.96 -1.60 112.91 117.32 1fqj h THR 73 Ca 0.41 -0.82 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 1fqj h THR 73 Cb 0.17 1.63 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 1fqj h THR 73 CO -0.17 0.23 0.13 0.25 0.37 0.00 0.00 175.52 176.33 1fqj h LEU 74 N -0.13 0.29 -1.46 2.58 5.85 -1.07 -2.35 115.31 119.02 1fqj h LEU 74 Ca 0.03 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1fqj h LEU 74 Cb 0.36 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1fqj h LEU 74 CO 0.01 0.29 0.36 1.56 -0.34 0.00 0.00 178.44 180.31 1fqj h GLN 75 N 0.27 0.72 0.08 1.25 4.20 -1.17 -1.39 115.11 119.07 1fqj h GLN 75 Ca 0.08 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1fqj h GLN 75 Cb 0.06 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.68 1fqj h GLN 75 CO -0.01 0.48 -0.04 0.77 -0.67 0.00 0.00 178.83 179.36 1fqj h SER 76 N 0.74 -0.09 0.19 1.46 0.02 -0.94 -1.81 113.55 113.12 1fqj h SER 76 Ca 0.20 -0.26 -0.07 0.00 -0.84 0.00 0.00 61.79 60.82 1fqj h SER 76 Cb -0.08 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1fqj h SER 76 CO -0.04 0.21 -0.27 -0.29 -1.14 0.00 0.00 176.83 175.30 1fqj h ILE 77 N -0.39 1.23 -0.47 3.27 6.09 -1.25 -2.35 117.51 123.63 1fqj h ILE 77 Ca -0.01 -1.07 -0.13 0.00 -1.37 0.00 0.00 64.86 62.28 1fqj h ILE 77 Cb 0.34 1.47 -0.01 0.00 0.47 0.00 0.00 36.82 39.08 1fqj h ILE 77 CO 0.02 0.32 -0.20 -0.07 -3.07 0.00 0.00 178.15 175.14 1fqj h LEU 78 N 0.13 0.97 -0.73 2.19 3.38 -1.17 -0.17 115.31 119.91 1fqj h LEU 78 Ca 0.02 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1fqj h LEU 78 Cb 0.55 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1fqj h LEU 78 CO 0.04 1.14 0.40 0.00 0.09 0.00 0.00 178.44 180.10 1fqj h ALA 79 N 0.93 0.93 -0.25 1.53 0.00 -0.92 -0.15 119.26 121.35 1fqj h ALA 79 Ca 0.11 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1fqj h ALA 79 Cb 0.77 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1fqj h ALA 79 CO 0.06 0.45 -0.05 0.82 0.00 0.00 0.00 179.25 180.53 1fqj h ILE 80 N 1.00 1.28 -0.70 0.00 2.04 -1.17 -1.79 117.51 118.18 1fqj h ILE 80 Ca 0.26 -1.04 0.03 0.00 1.00 0.00 0.00 64.86 65.10 1fqj h ILE 80 Cb 0.04 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 1fqj h ILE 80 CO -0.04 0.32 0.44 0.58 0.00 0.00 0.00 178.15 179.45 1fqj h VAL 81 N 0.22 1.10 -0.31 1.67 2.07 -0.73 -1.92 116.25 118.35 1fqj h VAL 81 Ca 0.06 -0.29 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 1fqj h VAL 81 Cb 0.51 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1fqj h VAL 81 CO 0.02 0.16 -0.17 0.03 0.02 0.00 0.00 177.57 177.63 1fqj h ARG 82 N 0.86 0.56 0.00 1.57 3.08 -0.95 -2.57 114.38 116.92 1fqj h ARG 82 Ca 0.28 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 1fqj h ARG 82 Cb 0.01 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 1fqj h ARG 82 CO -0.10 0.70 -0.09 0.00 -1.07 0.00 0.00 179.97 179.41 1fqj h ALA 83 N 1.32 1.07 -0.88 0.04 0.00 -0.63 -2.42 119.26 117.76 1fqj h ALA 83 Ca 0.08 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1fqj h ALA 83 Cb 0.58 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 1fqj h ALA 83 CO 0.04 0.11 0.54 0.52 0.00 0.00 0.00 179.25 180.46 1fqj h MET 84 N 0.00 0.92 0.11 0.00 2.86 -0.94 0.19 114.93 118.08 1fqj h MET 84 Ca -0.00 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1fqj h MET 84 Cb 0.48 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1fqj h MET 84 CO 0.01 0.61 -0.05 1.15 1.06 0.00 0.00 176.91 179.69 1fqj h THR 85 N 0.95 0.94 -0.39 2.22 2.02 -1.57 0.96 112.91 118.04 1fqj h THR 85 Ca 0.40 -1.30 0.08 0.00 0.77 0.00 0.00 66.41 66.36 1fqj h THR 85 Cb 0.26 1.63 -0.09 0.00 -1.74 0.00 0.00 68.15 68.21 1fqj h THR 85 CO -0.20 0.26 -0.25 0.74 0.37 0.00 0.00 175.52 176.44 1fqj h THR 86 N -0.88 0.34 -0.00 3.16 2.02 -1.21 -0.61 112.91 115.73 1fqj h THR 86 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1fqj h THR 86 Cb 0.55 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1fqj h THR 86 CO 0.03 0.00 -0.01 0.18 0.37 0.00 0.00 175.52 176.09 1fqj n LEU 87 N -5.40 0.01 -3.07 2.58 4.77 0.66 -4.94 117.00 111.61 1fqj n LEU 87 Ca 0.02 0.40 -0.14 0.00 -0.03 0.00 0.00 56.01 56.26 1fqj n LEU 87 Cb 0.31 -0.40 0.06 0.00 -2.33 0.00 0.00 43.42 41.06 1fqj n LEU 87 CO 0.10 0.00 0.03 -3.20 -1.33 0.00 0.00 177.39 172.99 1fqj n ASN 88 N -1.40 -5.69 -4.34 -1.43 5.15 -0.24 -5.02 115.26 102.29 1fqj n ASN 88 Ca 0.10 -0.62 -0.33 0.00 -0.60 0.00 0.00 54.58 53.13 1fqj n ASN 88 Cb 0.30 -4.69 -0.15 0.00 -0.53 0.00 0.00 39.78 34.71 1fqj n ASN 88 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1fqj s ILE 89 N -3.34 2.74 0.38 -1.44 1.01 0.23 -5.03 121.20 115.74 1fqj s ILE 89 Ca 0.36 -0.78 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 1fqj s ILE 89 Cb -0.05 -2.11 -0.07 0.00 0.01 0.00 0.00 42.46 40.24 1fqj s ILE 89 CO 0.66 0.54 0.74 -1.10 0.00 0.00 0.00 174.94 175.78 1fqj s GLN 90 N 0.19 3.82 0.45 2.79 -0.21 -1.26 -4.67 119.66 120.76 1fqj s GLN 90 Ca -0.10 0.48 -0.22 0.00 0.02 0.00 0.00 55.36 55.55 1fqj s GLN 90 Cb -0.16 -2.42 -0.09 0.00 1.00 0.00 0.00 33.01 31.35 1fqj s GLN 90 CO 0.06 0.03 1.04 0.71 -2.12 0.00 0.00 175.29 175.01 1fqj s TYR 91 N -2.25 3.12 0.13 0.91 2.02 -1.26 -4.31 117.35 115.70 1fqj s TYR 91 Ca 0.51 1.61 -0.19 0.00 -0.37 0.00 0.00 57.07 58.63 1fqj s TYR 91 Cb -0.10 -3.09 -0.03 0.00 -0.40 0.00 0.00 41.96 38.34 1fqj s TYR 91 CO 0.28 -0.73 1.76 0.78 -1.57 0.00 0.00 175.55 176.07 1fqj h GLY 92 N 1.99 0.31 -6.51 0.71 0.00 -1.90 -3.39 103.07 94.28 1fqj h GLY 92 Ca -0.49 -0.08 -0.67 0.00 0.00 0.00 0.00 47.33 46.10 1fqj h GLY 92 CO 0.61 0.06 -0.84 -0.35 0.00 0.00 0.00 176.54 176.01 1fqj s ASP 93 N -5.35 3.44 0.58 0.19 3.68 -1.26 -5.00 116.67 112.94 1fqj s ASP 93 Ca -0.13 -0.83 0.32 0.00 2.13 0.00 0.00 52.55 54.04 1fqj s ASP 93 Cb 0.10 -1.49 1.41 0.00 -1.45 0.00 0.00 42.92 41.49 1fqj s ASP 93 CO 0.70 -0.05 1.76 0.28 0.13 0.00 0.00 175.17 177.99 1fqj h SER 94 N 7.90 0.00 -0.17 -0.34 0.02 -2.00 0.60 113.55 119.56 1fqj h SER 94 Ca -0.39 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.61 1fqj h SER 94 Cb 1.12 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 1fqj h SER 94 CO 0.59 0.00 0.27 0.00 -1.14 0.00 0.00 176.83 176.55 1fqj h ALA 95 N 1.28 1.66 0.00 3.77 0.00 -1.96 0.31 119.26 124.32 1fqj h ALA 95 Ca 0.40 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.23 1fqj h ALA 95 Cb 1.90 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.69 1fqj h ALA 95 CO -0.00 -0.36 -0.32 0.00 0.00 0.00 0.00 179.25 178.57 1fqj h ARG 96 N 0.00 0.00 -0.97 0.00 2.47 -1.29 -3.03 114.38 111.56 1fqj h ARG 96 Ca 0.08 0.00 0.09 0.00 -1.26 0.00 0.00 59.98 58.89 1fqj h ARG 96 Cb 0.62 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.86 1fqj h ARG 96 CO -0.00 0.32 0.61 1.96 0.56 0.00 0.00 179.97 183.42 1fqj h GLN 97 N 0.00 0.99 -0.32 0.04 4.20 -1.12 0.28 115.11 119.18 1fqj h GLN 97 Ca -0.00 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.55 1fqj h GLN 97 Cb 0.78 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 1fqj h GLN 97 CO 0.04 0.66 -0.17 -0.44 -0.67 0.00 0.00 178.83 178.25 1fqj h ASP 98 N 1.02 0.70 -0.42 1.46 5.19 -1.69 -2.01 116.42 120.69 1fqj h ASP 98 Ca 0.45 -0.41 0.03 0.00 -0.62 0.00 0.00 57.03 56.48 1fqj h ASP 98 Cb 0.34 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.62 1fqj h ASP 98 CO -0.23 0.96 0.22 0.44 -3.12 0.00 0.00 179.24 177.51 1fqj h ASP 99 N 0.44 0.32 -0.42 6.45 3.32 -1.23 -0.94 116.42 124.37 1fqj h ASP 99 Ca 0.07 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.17 1fqj h ASP 99 Cb 0.70 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 1fqj h ASP 99 CO 0.05 0.23 0.21 0.00 -1.72 0.00 0.00 179.24 178.01 1fqj h ALA 100 N 1.21 0.52 -0.39 3.45 0.00 -0.39 0.40 119.26 124.06 1fqj h ALA 100 Ca 0.18 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.14 1fqj h ALA 100 Cb 0.07 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1fqj h ALA 100 CO -0.12 -0.14 0.16 0.00 0.00 0.00 0.00 179.25 179.16 1fqj h ARG 101 N 0.43 0.33 -0.71 0.00 3.08 -0.79 -1.34 114.38 115.38 1fqj h ARG 101 Ca 0.18 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 1fqj h ARG 101 Cb 0.07 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1fqj h ARG 101 CO -0.12 0.22 0.37 -0.22 -1.07 0.00 0.00 179.97 179.15 1fqj h LYS 102 N 0.34 1.01 -0.54 0.04 3.64 -0.62 -2.32 116.57 118.11 1fqj h LYS 102 Ca 0.17 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1fqj h LYS 102 Cb 0.12 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1fqj h LYS 102 CO -0.15 0.77 0.34 1.25 -2.27 0.00 0.00 179.45 179.38 1fqj h LEU 103 N 0.98 0.63 -1.83 5.20 5.85 -0.48 -0.63 115.31 125.04 1fqj h LEU 103 Ca 0.25 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 1fqj h LEU 103 Cb 0.07 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 1fqj h LEU 103 CO -0.04 0.48 -0.14 0.24 -0.34 0.00 0.00 178.44 178.64 1fqj h MET 104 N 0.72 0.00 0.18 1.25 2.86 -0.94 -0.88 114.93 118.12 1fqj h MET 104 Ca 0.19 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.51 1fqj h MET 104 Cb -0.05 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.62 1fqj h MET 104 CO -0.04 0.14 -1.53 1.25 1.06 0.00 0.00 176.91 177.79 1fqj h HIS 105 N 0.00 0.67 -0.33 -0.22 -0.00 -0.86 -3.16 115.15 111.25 1fqj h HIS 105 Ca -0.00 -0.49 -0.05 0.00 -0.00 0.00 0.00 60.37 59.83 1fqj h HIS 105 Cb 0.35 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.72 1fqj h HIS 105 CO 0.00 1.49 0.03 0.52 -0.00 0.00 0.00 177.93 179.97 1fqj h MET 106 N 0.10 0.57 -0.84 5.26 2.07 -0.89 -2.42 114.93 118.78 1fqj h MET 106 Ca -0.26 -0.17 0.20 0.00 -2.07 0.00 0.00 59.70 57.41 1fqj h MET 106 Cb 2.08 -0.06 -0.05 0.00 -1.87 0.00 0.00 31.60 31.69 1fqj h MET 106 CO 0.20 0.67 0.57 0.00 1.07 0.00 0.00 176.91 179.43 1fqj h ALA 107 N 0.87 2.33 -0.00 6.32 0.00 -1.26 0.44 119.26 127.96 1fqj h ALA 107 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1fqj h ALA 107 Cb 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1fqj h ALA 107 CO 0.01 -0.58 -0.17 -3.47 0.00 0.00 0.00 179.25 175.04 1fqj n ASP 108 N -4.45 0.28 0.00 0.00 2.03 -0.94 -4.40 116.55 109.07 1fqj n ASP 108 Ca 0.17 -0.05 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1fqj n ASP 108 Cb 0.70 -0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 1fqj n ASP 108 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1fqj n THR 109 N -1.33 0.00 -0.75 5.18 -2.24 0.11 -5.08 114.28 110.17 1fqj n THR 109 Ca 0.09 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.58 1fqj n THR 109 Cb 0.32 -0.71 0.24 0.00 -2.10 0.00 0.00 70.33 68.08 1fqj n THR 109 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1fqj s ILE 110 N -1.83 1.86 0.08 2.28 -4.36 0.99 -4.95 121.20 115.28 1fqj s ILE 110 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 60.65 60.09 1fqj s ILE 110 Cb 0.00 -2.23 -0.05 0.00 1.25 0.00 0.00 42.46 41.42 1fqj s ILE 110 CO 0.00 0.00 1.06 -0.70 0.24 0.00 0.00 174.94 175.54 1fqj s GLU 111 N -4.78 4.57 0.33 0.37 2.12 -1.26 -4.97 118.70 115.08 1fqj s GLU 111 Ca 0.68 1.58 -0.29 0.00 0.36 0.00 0.00 54.97 57.30 1fqj s GLU 111 Cb -0.20 -3.37 -0.12 0.00 0.26 0.00 0.00 34.13 30.70 1fqj s GLU 111 CO 0.61 -0.01 1.38 -1.91 -0.54 0.00 0.00 175.26 174.79 1fqj n GLU 112 N 3.29 2.29 -0.77 4.30 0.00 -1.26 -2.55 120.64 125.94 1fqj n GLU 112 Ca 0.05 0.80 0.00 0.00 0.00 0.00 0.00 57.16 58.02 1fqj n GLU 112 Cb 0.48 -2.45 0.00 0.00 0.00 0.00 0.00 31.44 29.47 1fqj n GLU 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1fqj n GLY 113 N 1.07 0.72 3.74 8.31 0.00 -1.26 -5.05 105.19 112.71 1fqj n GLY 113 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 1fqj n GLY 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fqj s THR 114 N -2.59 2.80 -0.44 2.61 -4.23 -1.06 -4.29 115.64 108.45 1fqj s THR 114 Ca 0.00 -1.69 0.05 0.00 -1.18 0.00 0.00 61.69 58.87 1fqj s THR 114 Cb 0.00 -2.97 0.18 0.00 1.34 0.00 0.00 72.50 71.05 1fqj s THR 114 CO 0.00 -0.13 0.45 0.80 -0.54 0.00 0.00 174.62 175.20 1fqj n MET 115 N -1.18 0.29 -1.82 3.99 1.56 -1.26 -4.86 117.12 113.84 1fqj n MET 115 Ca -0.02 -2.87 -0.36 0.00 -0.27 0.00 0.00 57.70 54.17 1fqj n MET 115 Cb 0.62 -1.61 0.06 0.00 2.15 0.00 0.00 33.22 34.44 1fqj n MET 115 CO 0.00 0.00 0.00 -2.14 -0.73 0.00 0.00 175.97 173.10 1fqj s PRO 116 N 0.24 2.67 0.27 2.12 0.02 -1.26 -4.70 135.00 134.36 1fqj s PRO 116 Ca 0.32 1.98 -0.00 0.00 0.02 0.00 0.00 61.00 63.32 1fqj s PRO 116 Cb 0.03 -1.87 0.53 0.00 0.02 0.00 0.00 34.50 33.21 1fqj s PRO 116 CO -0.16 -1.48 1.81 0.87 -0.33 0.00 0.00 177.00 177.71 1fqj h LYS 117 N 0.62 0.83 0.00 5.54 1.57 -1.98 0.20 116.57 123.35 1fqj h LYS 117 Ca -0.51 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.20 1fqj h LYS 117 Cb 1.32 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 33.44 1fqj h LYS 117 CO 0.54 0.55 -0.09 1.49 -0.57 0.00 0.00 179.45 181.36 1fqj h GLU 118 N 0.85 0.00 0.00 3.15 4.81 -1.99 0.43 114.58 121.83 1fqj h GLU 118 Ca 0.47 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.63 1fqj h GLU 118 Cb 0.53 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 1fqj h GLU 118 CO -0.29 0.09 -0.47 1.98 -0.73 0.00 0.00 179.01 179.59 1fqj h MET 119 N 0.00 0.00 -0.84 1.92 4.05 -1.04 -3.19 114.93 115.84 1fqj h MET 119 Ca -0.00 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.47 1fqj h MET 119 Cb 0.28 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 31.03 1fqj h MET 119 CO 0.01 0.79 0.55 0.66 0.23 0.00 0.00 176.91 179.15 1fqj h SER 120 N -1.00 0.84 -0.40 1.39 4.64 -0.91 -1.04 113.55 117.07 1fqj h SER 120 Ca -0.12 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.24 1fqj h SER 120 Cb 0.94 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.81 1fqj h SER 120 CO -0.07 0.55 0.18 0.44 -0.87 0.00 0.00 176.83 177.05 1fqj h ASP 121 N 0.96 0.23 -0.63 4.97 5.19 -1.05 -0.45 116.42 125.65 1fqj h ASP 121 Ca 0.35 0.03 -0.04 0.00 -0.62 0.00 0.00 57.03 56.75 1fqj h ASP 121 Cb 0.17 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 39.64 1fqj h ASP 121 CO -0.12 0.17 0.22 0.40 -3.12 0.00 0.00 179.24 176.79 1fqj h ILE 122 N 0.36 1.24 -0.60 0.35 2.04 -1.28 -2.73 117.51 116.90 1fqj h ILE 122 Ca 0.18 -0.79 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 1fqj h ILE 122 Cb 0.12 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1fqj h ILE 122 CO -0.15 0.30 0.23 0.40 0.00 0.00 0.00 178.15 178.94 1fqj h ILE 123 N 0.89 1.23 -0.79 -0.67 2.04 -0.69 -1.60 117.51 117.92 1fqj h ILE 123 Ca 0.21 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 1fqj h ILE 123 Cb 0.25 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 1fqj h ILE 123 CO -0.01 0.28 0.38 1.56 0.00 0.00 0.00 178.15 180.36 1fqj h GLN 124 N 0.83 1.13 -0.50 2.37 4.20 -0.99 0.49 115.11 122.63 1fqj h GLN 124 Ca 0.20 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 1fqj h GLN 124 Cb 0.21 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1fqj h GLN 124 CO -0.02 0.88 0.16 0.00 -0.67 0.00 0.00 178.83 179.18 1fqj h ARG 125 N 1.11 0.78 -0.50 1.46 3.08 -1.23 -2.78 114.38 116.31 1fqj h ARG 125 Ca 0.27 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 1fqj h ARG 125 Cb 0.11 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1fqj h ARG 125 CO -0.03 0.73 0.18 -0.07 -1.07 0.00 0.00 179.97 179.70 1fqj h LEU 126 N 0.68 0.71 -1.52 3.04 3.38 -0.94 -2.86 115.31 117.80 1fqj h LEU 126 Ca 0.16 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 58.02 1fqj h LEU 126 Cb 0.27 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1fqj h LEU 126 CO -0.01 0.71 0.42 -0.25 0.09 0.00 0.00 178.44 179.40 1fqj h TRP 127 N 0.67 0.59 -0.01 1.13 -0.00 -0.74 -1.41 115.95 116.18 1fqj h TRP 127 Ca 0.16 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 59.07 1fqj h TRP 127 Cb 0.24 -0.19 0.00 0.00 -0.00 0.00 0.00 29.16 29.20 1fqj h TRP 127 CO 0.01 0.30 0.00 1.63 -0.00 0.00 0.00 178.44 180.38 1fqj n LYS 128 N -4.48 1.27 -2.69 2.65 5.02 -1.06 -4.58 118.16 114.28 1fqj n LYS 128 Ca 0.10 -0.39 -0.40 0.00 -2.02 0.00 0.00 58.31 55.59 1fqj n LYS 128 Cb 0.28 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.75 1fqj n LYS 128 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1fqj s ASP 129 N -1.98 7.55 0.47 4.39 2.15 -0.53 -4.94 116.67 123.77 1fqj s ASP 129 Ca 0.43 1.97 0.14 0.00 0.43 0.00 0.00 52.55 55.53 1fqj s ASP 129 Cb 0.21 -2.61 1.08 0.00 -0.30 0.00 0.00 42.92 41.31 1fqj s ASP 129 CO 0.35 0.05 2.05 0.77 -0.17 0.00 0.00 175.17 178.22 1fqj h SER 130 N 4.44 0.03 -0.11 -0.34 4.64 -1.89 -1.67 113.55 118.64 1fqj h SER 130 Ca -0.45 -0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.74 1fqj h SER 130 Cb 1.20 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1fqj h SER 130 CO 0.69 0.13 -0.43 1.23 -0.87 0.00 0.00 176.83 177.58 1fqj h GLY 131 N 0.36 0.54 1.01 -0.77 0.00 -1.88 -1.48 103.07 100.85 1fqj h GLY 131 Ca 0.01 -0.72 0.01 0.00 0.00 0.00 0.00 47.33 46.62 1fqj h GLY 131 CO 0.01 0.65 0.46 -2.22 0.00 0.00 0.00 176.54 175.44 1fqj h ILE 132 N 0.08 1.18 -0.54 2.60 1.08 -1.75 -0.40 117.51 119.77 1fqj h ILE 132 Ca -0.02 -0.35 -0.05 0.00 -0.39 0.00 0.00 64.86 64.05 1fqj h ILE 132 Cb 1.06 0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 34.94 1fqj h ILE 132 CO 0.09 0.18 0.14 1.56 -0.69 0.00 0.00 178.15 179.43 1fqj h GLN 133 N 0.95 0.87 -0.23 2.37 1.08 -1.29 0.35 115.11 119.22 1fqj h GLN 133 Ca 0.26 -0.21 -0.03 0.00 -1.45 0.00 0.00 58.65 57.22 1fqj h GLN 133 Cb -0.10 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.20 1fqj h GLN 133 CO -0.05 0.82 0.02 0.00 -0.95 0.00 0.00 178.83 178.66 1fqj h ALA 134 N 1.01 1.62 -0.07 3.87 0.00 -0.85 -0.84 119.26 124.00 1fqj h ALA 134 Ca 0.17 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 1fqj h ALA 134 Cb 0.33 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1fqj h ALA 134 CO 0.00 0.29 -0.66 0.00 0.00 0.00 0.00 179.25 178.87 1fqj h PHE 136 N 0.18 1.11 0.00 0.00 3.57 0.28 0.56 116.94 122.64 1fqj h PHE 136 Ca -0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1fqj h PHE 136 Cb 1.33 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1fqj h PHE 136 CO 0.12 0.49 0.00 -0.25 -2.23 0.00 0.00 178.31 176.44 1fqj n ASP 137 N -4.60 0.57 -1.34 0.41 8.00 -0.38 -2.20 116.55 117.00 1fqj n ASP 137 Ca 0.17 0.67 -0.05 0.00 0.71 0.00 0.00 54.79 56.29 1fqj n ASP 137 Cb 0.28 -0.78 0.22 0.00 -0.02 0.00 0.00 41.12 40.81 1fqj n ASP 137 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1fqj n ARG 138 N -2.16 2.26 0.08 -1.24 1.74 0.18 -4.70 116.66 112.82 1fqj n ARG 138 Ca 0.01 -3.09 0.19 0.00 -0.77 0.00 0.00 57.85 54.20 1fqj n ARG 138 Cb 0.16 -1.91 0.74 0.00 -1.02 0.00 0.00 32.46 30.43 1fqj n ARG 138 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1fqj h ALA 139 N 1.29 2.22 0.00 7.54 0.00 -1.38 0.15 119.26 129.08 1fqj h ALA 139 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1fqj h ALA 139 Cb 1.86 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.68 1fqj h ALA 139 CO 0.50 -0.56 0.06 0.77 0.00 0.00 0.00 179.25 180.02 1fqj h SER 140 N 0.00 0.00 0.12 0.00 0.02 -1.87 -0.99 113.55 110.83 1fqj h SER 140 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1fqj h SER 140 Cb 0.89 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1fqj h SER 140 CO -0.00 0.00 -0.11 -0.62 -1.14 0.00 0.00 176.83 174.95 1fqj n GLU 141 N -2.89 1.23 -1.16 3.45 1.02 0.04 -4.68 120.64 117.65 1fqj n GLU 141 Ca -0.03 -0.68 0.00 0.00 -0.02 0.00 0.00 57.16 56.43 1fqj n GLU 141 Cb 0.12 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1fqj n GLU 141 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 1fqj n TYR 142 N -0.29 -0.21 -3.52 -0.32 4.11 -0.38 -5.09 117.16 111.47 1fqj n TYR 142 Ca 0.16 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.64 1fqj n TYR 142 Cb 0.34 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.58 1fqj n TYR 142 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.86 176.21 1fqj s GLN 143 N -1.05 2.85 -0.03 -3.48 -1.52 -1.26 -4.92 119.66 110.25 1fqj s GLN 143 Ca 0.00 -1.20 0.02 0.00 -1.95 0.00 0.00 55.36 52.22 1fqj s GLN 143 Cb 0.00 -3.89 0.01 0.00 -0.22 0.00 0.00 33.01 28.91 1fqj s GLN 143 CO 0.00 -0.84 -0.06 -1.17 -0.25 0.00 0.00 175.29 172.97 1fqj s LEU 144 N 1.58 1.67 0.26 2.90 2.96 -1.26 -4.91 118.68 121.87 1fqj s LEU 144 Ca 0.03 -0.13 -0.30 0.00 -0.22 0.00 0.00 54.13 53.51 1fqj s LEU 144 Cb -0.21 -0.42 -0.14 0.00 0.50 0.00 0.00 46.19 45.92 1fqj s LEU 144 CO 0.07 0.02 1.29 0.59 -1.32 0.00 0.00 176.35 177.00 1fqj n ASN 145 N 3.48 2.35 -0.29 3.68 3.02 -1.26 -4.88 115.26 121.37 1fqj n ASN 145 Ca -0.20 1.16 0.06 0.00 -0.03 0.00 0.00 54.58 55.57 1fqj n ASN 145 Cb 0.54 -1.39 0.21 0.00 -0.61 0.00 0.00 39.78 38.53 1fqj n ASN 145 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1fqj h ASP 146 N 3.44 0.53 -0.09 6.41 5.19 -1.99 -1.28 116.42 128.62 1fqj h ASP 146 Ca -0.44 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.05 1fqj h ASP 146 Cb 1.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.81 1fqj h ASP 146 CO 0.70 0.24 0.00 -1.20 -3.12 0.00 0.00 179.24 175.86 1fqj n SER 147 N -4.86 0.48 0.02 6.45 7.64 -1.26 -4.32 113.62 117.77 1fqj n SER 147 Ca 0.16 -1.99 -0.10 0.00 1.01 0.00 0.00 58.87 57.95 1fqj n SER 147 Cb 0.40 -0.06 -0.04 0.00 -1.01 0.00 0.00 64.21 63.51 1fqj n SER 147 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fqj h ALA 148 N 3.18 -0.17 -0.21 -0.43 0.00 -1.59 -1.80 119.26 118.24 1fqj h ALA 148 Ca 0.00 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1fqj h ALA 148 Cb 0.12 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1fqj h ALA 148 CO 0.00 -0.66 0.11 0.78 0.00 0.00 0.00 179.25 179.48 1fqj h GLY 149 N -0.27 0.28 0.16 0.00 0.00 -1.82 -1.09 103.07 100.34 1fqj h GLY 149 Ca 0.08 -0.08 0.08 0.00 0.00 0.00 0.00 47.33 47.41 1fqj h GLY 149 CO -0.23 0.08 -0.14 -1.82 0.00 0.00 0.00 176.54 174.42 1fqj h TYR 150 N 0.24 -0.34 0.02 5.60 3.20 -1.75 -1.71 116.97 122.23 1fqj h TYR 150 Ca 0.08 0.04 -0.15 0.00 3.14 0.00 0.00 58.73 61.84 1fqj h TYR 150 Cb 0.00 0.21 0.01 0.00 1.54 0.00 0.00 36.73 38.49 1fqj h TYR 150 CO -0.08 -0.22 -0.58 1.88 -1.64 0.00 0.00 178.16 177.52 1fqj h TYR 151 N -0.07 0.55 -0.76 -3.82 0.05 -1.26 -3.27 116.97 108.40 1fqj h TYR 151 Ca 0.18 -0.31 -0.04 0.00 0.05 0.00 0.00 58.73 58.61 1fqj h TYR 151 Cb 0.35 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 37.99 1fqj h TYR 151 CO -0.37 1.14 0.32 -0.07 -1.05 0.00 0.00 178.16 178.13 1fqj h LEU 152 N -0.19 1.01 -0.41 3.88 3.38 -1.15 -2.21 115.31 119.63 1fqj h LEU 152 Ca -0.08 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1fqj h LEU 152 Cb 1.31 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1fqj h LEU 152 CO 0.11 0.88 0.00 -1.54 0.09 0.00 0.00 178.44 177.99 1fqj n SER 153 N -4.30 0.49 -1.34 -0.43 3.41 -0.65 -3.13 113.62 107.67 1fqj n SER 153 Ca 0.07 0.61 -0.02 0.00 -0.26 0.00 0.00 58.87 59.27 1fqj n SER 153 Cb 0.17 -0.71 0.11 0.00 -0.26 0.00 0.00 64.21 63.51 1fqj n SER 153 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1fqj n ASP 154 N -2.02 2.23 -0.07 4.04 2.03 -0.88 -4.86 116.55 117.02 1fqj n ASP 154 Ca 0.03 -3.24 0.02 0.00 0.52 0.00 0.00 54.79 52.11 1fqj n ASP 154 Cb 0.25 -0.43 0.33 0.00 -0.72 0.00 0.00 41.12 40.55 1fqj n ASP 154 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1fqj h LEU 155 N 1.42 0.60 -0.07 -2.67 5.85 -1.38 -3.05 115.31 116.02 1fqj h LEU 155 Ca 0.01 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1fqj h LEU 155 Cb 1.35 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 1fqj h LEU 155 CO 0.20 0.49 -0.05 -0.08 -0.34 0.00 0.00 178.44 178.66 1fqj h GLU 156 N 0.68 -0.06 -0.79 1.25 4.81 -1.89 -1.67 114.58 116.91 1fqj h GLU 156 Ca 0.18 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.48 1fqj h GLU 156 Cb 0.03 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.37 1fqj h GLU 156 CO -0.03 -0.04 0.52 -0.09 -0.73 0.00 0.00 179.01 178.64 1fqj h ARG 157 N -0.06 0.81 -0.19 1.92 2.43 -1.95 -1.63 114.38 115.71 1fqj h ARG 157 Ca 0.05 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 1fqj h ARG 157 Cb 0.13 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1fqj h ARG 157 CO -0.11 0.54 -0.22 -0.07 -1.51 0.00 0.00 179.97 178.60 1fqj h LEU 158 N 0.83 0.34 -2.83 3.80 4.07 -1.25 -3.10 115.31 117.17 1fqj h LEU 158 Ca 0.34 -0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.20 1fqj h LEU 158 Cb 0.26 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.91 1fqj h LEU 158 CO -0.12 0.57 0.00 1.33 -1.08 0.00 0.00 178.44 179.14 1fqj n VAL 159 N -4.17 1.03 -2.27 1.22 0.24 -0.75 -4.83 118.33 108.80 1fqj n VAL 159 Ca -0.00 -1.01 -0.42 0.00 -2.04 0.00 0.00 64.34 60.86 1fqj n VAL 159 Cb 0.36 0.48 -0.03 0.00 -1.47 0.00 0.00 33.84 33.18 1fqj n VAL 159 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1fqj s THR 160 N -1.04 3.60 0.08 3.34 2.01 -0.66 -4.91 115.64 118.07 1fqj s THR 160 Ca 0.36 1.15 -0.36 0.00 0.31 0.00 0.00 61.69 63.15 1fqj s THR 160 Cb 0.19 -3.73 -0.18 0.00 0.01 0.00 0.00 72.50 68.78 1fqj s THR 160 CO 0.24 0.09 0.97 -2.65 -0.69 0.00 0.00 174.62 172.57 1fqj n PRO 161 N 3.96 0.26 -2.24 4.92 -0.02 -1.26 -1.90 135.00 138.72 1fqj n PRO 161 Ca 0.10 0.09 -0.07 0.00 -2.02 0.00 0.00 63.50 61.61 1fqj n PRO 161 Cb 0.44 -1.48 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 1fqj n PRO 161 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fqj n GLY 162 N 1.77 0.16 3.76 -1.23 0.00 -1.26 -5.01 105.19 103.38 1fqj n GLY 162 Ca 0.19 -0.58 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 1fqj n GLY 162 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1fqj s TYR 163 N -2.45 3.50 -0.13 1.61 5.04 -0.80 -5.04 117.35 119.09 1fqj s TYR 163 Ca 0.03 1.63 -0.01 0.00 -2.44 0.00 0.00 57.07 56.28 1fqj s TYR 163 Cb -0.01 -3.35 0.03 0.00 0.35 0.00 0.00 41.96 38.98 1fqj s TYR 163 CO 0.04 -0.78 -0.05 0.08 -1.34 0.00 0.00 175.55 173.50 1fqj s VAL 164 N -0.98 0.90 0.10 3.14 1.01 -1.26 -5.02 120.40 118.30 1fqj s VAL 164 Ca 0.46 -0.33 -0.35 0.00 0.00 0.00 0.00 61.98 61.77 1fqj s VAL 164 Cb -0.33 -1.02 -0.15 0.00 0.00 0.00 0.00 36.38 34.88 1fqj s VAL 164 CO 0.42 0.25 1.52 -2.65 0.00 0.00 0.00 175.10 174.64 1fqj n PRO 165 N 4.97 1.76 -2.13 2.72 -0.02 -1.26 -4.98 135.00 136.06 1fqj n PRO 165 Ca -0.11 0.64 -0.27 0.00 -2.02 0.00 0.00 63.50 61.74 1fqj n PRO 165 Cb 0.49 -2.36 0.08 0.00 -0.02 0.00 0.00 33.50 31.69 1fqj n PRO 165 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1fqj s THR 166 N 1.09 2.20 0.12 3.45 -4.23 -1.26 -4.84 115.64 112.17 1fqj s THR 166 Ca 0.83 -0.21 -0.27 0.00 -1.18 0.00 0.00 61.69 60.86 1fqj s THR 166 Cb -0.79 -2.99 -0.05 0.00 1.34 0.00 0.00 72.50 70.00 1fqj s THR 166 CO 0.43 0.00 1.62 -0.08 -0.54 0.00 0.00 174.62 176.05 1fqj h GLU 167 N -0.74 -0.43 -0.79 3.99 4.81 -2.00 -0.67 114.58 118.75 1fqj h GLU 167 Ca -0.45 0.03 0.13 0.00 -0.13 0.00 0.00 59.36 58.94 1fqj h GLU 167 Cb 1.32 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 30.74 1fqj h GLU 167 CO 0.60 -0.29 0.52 0.37 -0.73 0.00 0.00 179.01 179.49 1fqj h GLN 168 N -0.44 0.57 -0.23 1.92 5.75 -1.93 -0.12 115.11 120.63 1fqj h GLN 168 Ca 0.06 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 1fqj h GLN 168 Cb 0.53 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.94 1fqj h GLN 168 CO -0.25 0.38 0.09 -0.44 -2.65 0.00 0.00 178.83 175.96 1fqj h ASP 169 N 0.59 0.33 -0.17 -0.69 3.32 -1.54 -1.30 116.42 116.97 1fqj h ASP 169 Ca 0.38 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 1fqj h ASP 169 Cb 0.65 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 1fqj h ASP 169 CO -0.15 0.42 0.09 0.58 -1.72 0.00 0.00 179.24 178.47 1fqj h VAL 170 N 0.22 1.10 0.00 -1.35 2.07 0.08 -2.22 116.25 116.16 1fqj h VAL 170 Ca 0.08 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1fqj h VAL 170 Cb 0.20 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1fqj h VAL 170 CO -0.00 0.10 -0.02 -0.07 0.02 0.00 0.00 177.57 177.60 1fqj h LEU 171 N 0.18 0.00 0.00 2.57 3.38 -0.96 -1.87 115.31 118.60 1fqj h LEU 171 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1fqj h LEU 171 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1fqj h LEU 171 CO -0.01 0.02 -0.46 0.54 0.09 0.00 0.00 178.44 178.61 1fqj n ARG 172 N -4.10 0.29 -2.05 1.13 5.12 -0.50 -4.89 116.66 111.67 1fqj n ARG 172 Ca -0.03 0.12 -0.36 0.00 -1.93 0.00 0.00 57.85 55.66 1fqj n ARG 172 Cb 0.10 -1.72 0.03 0.00 -1.16 0.00 0.00 32.46 29.71 1fqj n ARG 172 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1fqj s SER 173 N -4.34 5.28 -0.15 0.55 1.04 -0.71 -4.69 113.70 110.68 1fqj s SER 173 Ca 0.07 2.34 0.01 0.00 0.48 0.00 0.00 55.95 58.86 1fqj s SER 173 Cb 0.13 -2.59 0.01 0.00 0.10 0.00 0.00 66.02 63.66 1fqj s SER 173 CO 0.69 -1.53 -0.19 -0.60 0.98 0.00 0.00 173.24 172.59 1fqj s ARG 174 N -3.35 3.09 -0.08 4.02 6.06 -1.26 -5.04 118.95 122.40 1fqj s ARG 174 Ca 0.76 -0.81 -0.03 0.00 -2.50 0.00 0.00 55.73 53.15 1fqj s ARG 174 Cb -0.29 -2.53 0.05 0.00 0.06 0.00 0.00 34.95 32.24 1fqj s ARG 174 CO 0.32 -0.03 0.16 0.08 -2.50 0.00 0.00 175.30 173.33 1fqj s VAL 175 N 0.89 -0.22 0.03 7.11 1.01 -1.26 -4.90 120.40 123.06 1fqj s VAL 175 Ca -0.05 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 1fqj s VAL 175 Cb -0.15 -0.28 -0.06 0.00 0.00 0.00 0.00 36.38 35.88 1fqj s VAL 175 CO -0.03 0.13 1.39 -0.75 0.00 0.00 0.00 175.10 175.85 1fqj s LYS 176 N 2.06 4.30 0.14 2.72 2.20 -1.26 -4.99 119.74 124.91 1fqj s LYS 176 Ca 0.01 1.98 -0.25 0.00 -0.36 0.00 0.00 55.97 57.35 1fqj s LYS 176 Cb -0.12 -3.48 -0.07 0.00 -1.51 0.00 0.00 37.83 32.65 1fqj s LYS 176 CO -0.06 -0.52 0.78 0.99 -0.36 0.00 0.00 175.35 176.18 1fqj s THR 177 N 1.99 4.45 -0.06 3.43 2.01 -1.26 -5.05 115.64 121.15 1fqj s THR 177 Ca 0.64 1.69 0.01 0.00 0.31 0.00 0.00 61.69 64.34 1fqj s THR 177 Cb -0.33 -4.14 0.02 0.00 0.01 0.00 0.00 72.50 68.07 1fqj s THR 177 CO 0.28 0.49 -0.07 0.28 -0.69 0.00 0.00 174.62 174.90 1fqj s THR 178 N -0.89 0.80 0.00 -0.82 -1.32 -1.26 -4.33 115.64 107.82 1fqj s THR 178 Ca 0.36 -0.26 0.00 0.00 -1.21 0.00 0.00 61.69 60.58 1fqj s THR 178 Cb -0.23 -0.78 0.00 0.00 -1.51 0.00 0.00 72.50 69.98 1fqj s THR 178 CO 0.26 0.29 0.00 0.61 -2.21 0.00 0.00 174.62 173.56 1fqj n GLY 179 N 4.09 -1.84 3.04 6.08 0.00 -1.26 -4.89 105.19 110.41 1fqj n GLY 179 Ca -0.22 -1.98 -0.31 0.00 0.00 0.00 0.00 46.02 43.52 1fqj n GLY 179 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fqj s ILE 180 N 0.00 1.66 -0.12 -0.61 1.01 -1.26 -2.69 121.20 119.19 1fqj s ILE 180 Ca 0.00 -0.69 0.03 0.00 0.00 0.00 0.00 60.65 59.99 1fqj s ILE 180 Cb 0.00 -1.54 0.00 0.00 0.01 0.00 0.00 42.46 40.93 1fqj s ILE 180 CO 0.00 0.47 -0.22 -0.63 0.00 0.00 0.00 174.94 174.56 1fqj s ILE 181 N 1.43 2.13 0.11 2.92 1.01 0.53 -4.96 121.20 124.38 1fqj s ILE 181 Ca 0.04 -0.98 -0.01 0.00 0.00 0.00 0.00 60.65 59.71 1fqj s ILE 181 Cb -0.13 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 1fqj s ILE 181 CO -0.11 0.55 0.29 -0.70 0.00 0.00 0.00 174.94 174.97 1fqj s GLU 182 N 0.57 3.49 -0.07 2.79 2.12 -1.26 0.17 118.70 126.51 1fqj s GLU 182 Ca -0.13 -0.38 -0.11 0.00 0.36 0.00 0.00 54.97 54.71 1fqj s GLU 182 Cb -0.17 -2.96 0.02 0.00 0.26 0.00 0.00 34.13 31.29 1fqj s GLU 182 CO 0.04 0.53 0.28 -0.08 -0.54 0.00 0.00 175.26 175.49 1fqj s THR 183 N -1.64 0.03 0.02 -1.70 -1.32 0.85 -4.97 115.64 106.90 1fqj s THR 183 Ca 0.37 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.63 1fqj s THR 183 Cb -0.12 -0.47 -0.02 0.00 -1.51 0.00 0.00 72.50 70.38 1fqj s THR 183 CO 0.28 -0.12 -0.03 0.00 -2.21 0.00 0.00 174.62 172.54 1fqj s GLN 184 N -0.45 0.26 0.24 7.08 -2.07 -1.26 0.87 119.66 124.34 1fqj s GLN 184 Ca -0.06 -0.48 -0.21 0.00 -1.82 0.00 0.00 55.36 52.80 1fqj s GLN 184 Cb -0.04 0.04 0.03 0.00 -1.09 0.00 0.00 33.01 31.96 1fqj s GLN 184 CO 0.02 -0.03 0.66 -0.59 -1.32 0.00 0.00 175.29 174.03 1fqj s PHE 185 N -1.10 -0.23 -0.08 9.60 -0.71 -0.80 -4.97 117.98 119.68 1fqj s PHE 185 Ca -0.12 -0.16 0.01 0.00 -1.04 0.00 0.00 56.93 55.63 1fqj s PHE 185 Cb -0.08 0.61 -0.03 0.00 -1.21 0.00 0.00 43.02 42.32 1fqj s PHE 185 CO -0.01 -1.10 -0.10 -1.12 -1.34 0.00 0.00 175.22 171.56 1fqj s SER 186 N -2.88 4.39 -0.18 1.98 0.01 -1.26 0.10 113.70 115.86 1fqj s SER 186 Ca 0.09 -0.13 -0.10 0.00 1.31 0.00 0.00 55.95 57.12 1fqj s SER 186 Cb -0.04 -1.22 0.06 0.00 0.21 0.00 0.00 66.02 65.03 1fqj s SER 186 CO 0.02 0.30 0.44 0.12 0.41 0.00 0.00 173.24 174.53 1fqj s PHE 187 N -0.46 -0.67 -1.47 2.43 5.36 -0.36 -4.85 117.98 117.96 1fqj s PHE 187 Ca 0.06 1.40 -0.07 0.00 -0.96 0.00 0.00 56.93 57.36 1fqj s PHE 187 Cb -0.12 0.31 0.01 0.00 -0.34 0.00 0.00 43.02 42.88 1fqj s PHE 187 CO 0.02 -0.38 0.89 1.17 -1.46 0.00 0.00 175.22 175.46 1fqj n LYS 188 N 4.36 -6.36 -2.25 10.12 4.81 -1.26 -1.40 118.16 126.18 1fqj n LYS 188 Ca -0.22 0.86 -0.20 0.00 -0.87 0.00 0.00 58.31 57.89 1fqj n LYS 188 Cb 0.55 -5.82 -0.02 0.00 0.02 0.00 0.00 35.03 29.76 1fqj n LYS 188 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1fqj n ASP 189 N -2.76 -5.61 -4.44 3.14 9.92 -1.26 -4.99 116.55 110.54 1fqj n ASP 189 Ca -0.05 0.10 -0.32 0.00 -0.53 0.00 0.00 54.79 53.99 1fqj n ASP 189 Cb 0.59 -4.73 -0.13 0.00 -0.64 0.00 0.00 41.12 36.21 1fqj n ASP 189 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1fqj s LEU 190 N -5.74 2.59 -0.44 0.64 1.43 -0.49 -4.85 118.68 111.81 1fqj s LEU 190 Ca 0.00 -0.30 -0.19 0.00 -1.03 0.00 0.00 54.13 52.60 1fqj s LEU 190 Cb 0.00 -1.51 0.03 0.00 0.03 0.00 0.00 46.19 44.73 1fqj s LEU 190 CO 0.00 0.32 0.57 0.20 0.23 0.00 0.00 176.35 177.67 1fqj s ASN 191 N -0.90 6.27 -0.16 2.29 0.01 -0.67 -1.22 114.94 120.56 1fqj s ASN 191 Ca 0.12 -0.52 -0.19 0.00 -0.71 0.00 0.00 52.86 51.57 1fqj s ASN 191 Cb -0.10 -2.28 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 1fqj s ASN 191 CO 0.02 -0.72 0.51 -0.36 -1.51 0.00 0.00 177.10 175.03 1fqj s PHE 192 N 2.57 3.44 -0.51 2.20 0.40 0.28 -0.76 117.98 125.59 1fqj s PHE 192 Ca 0.18 0.84 -0.05 0.00 -0.60 0.00 0.00 56.93 57.30 1fqj s PHE 192 Cb -0.16 -2.63 0.13 0.00 0.51 0.00 0.00 43.02 40.88 1fqj s PHE 192 CO 0.16 0.01 0.34 1.03 0.70 0.00 0.00 175.22 177.47 1fqj s ARG 193 N 1.20 2.37 -0.23 0.44 0.52 -0.06 -1.91 118.95 121.27 1fqj s ARG 193 Ca 0.25 -2.07 -0.13 0.00 -0.52 0.00 0.00 55.73 53.27 1fqj s ARG 193 Cb -0.15 -3.75 -0.05 0.00 0.52 0.00 0.00 34.95 31.52 1fqj s ARG 193 CO 0.10 -1.15 0.26 1.41 0.02 0.00 0.00 175.30 175.95 1fqj s MET 194 N 0.76 4.10 -0.24 3.54 1.75 0.25 -1.76 119.30 127.69 1fqj s MET 194 Ca 0.11 -0.08 -0.07 0.00 -1.25 0.00 0.00 55.69 54.40 1fqj s MET 194 Cb -0.22 -3.55 -0.03 0.00 2.84 0.00 0.00 34.83 33.87 1fqj s MET 194 CO -0.03 -0.01 0.05 -0.06 -0.65 0.00 0.00 175.02 174.32 1fqj s PHE 195 N 1.25 3.07 -0.18 4.11 0.08 -0.26 -0.11 117.98 125.94 1fqj s PHE 195 Ca 0.12 -0.48 -0.08 0.00 0.12 0.00 0.00 56.93 56.61 1fqj s PHE 195 Cb -0.14 -2.21 -0.04 0.00 -0.57 0.00 0.00 43.02 40.05 1fqj s PHE 195 CO 0.06 -0.37 0.09 0.34 -0.10 0.00 0.00 175.22 175.25 1fqj s ASP 196 N 1.54 5.89 0.30 1.36 2.15 0.13 -1.34 116.67 126.69 1fqj s ASP 196 Ca 0.06 0.18 0.04 0.00 0.43 0.00 0.00 52.55 53.26 1fqj s ASP 196 Cb -0.15 -2.00 -0.06 0.00 -0.30 0.00 0.00 42.92 40.41 1fqj s ASP 196 CO 0.03 0.21 0.03 0.68 -0.17 0.00 0.00 175.17 175.95 1fqj s VAL 197 N 0.17 1.20 0.41 1.11 -7.23 -1.25 -0.34 120.40 114.45 1fqj s VAL 197 Ca 0.06 -2.02 -0.17 0.00 -1.81 0.00 0.00 61.98 58.04 1fqj s VAL 197 Cb -0.12 -2.66 -0.09 0.00 0.56 0.00 0.00 36.38 34.07 1fqj s VAL 197 CO -0.00 -0.10 0.87 -0.83 -0.31 0.00 0.00 175.10 174.72 1fqj s GLY 198 N -3.44 2.26 -0.00 2.32 0.00 -1.09 -4.92 107.32 102.44 1fqj s GLY 198 Ca 0.34 0.18 0.13 0.00 0.00 0.00 0.00 44.72 45.37 1fqj s GLY 198 CO 0.14 0.42 0.49 0.61 0.00 0.00 0.00 173.10 174.76 1fqj n GLY 199 N -0.80 -0.29 3.72 0.20 0.00 -1.26 -4.58 105.19 102.17 1fqj n GLY 199 Ca 0.05 -0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 1fqj n GLY 199 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fqj s GLN 200 N -2.36 1.82 0.26 1.61 1.11 -1.26 -2.86 119.66 117.98 1fqj s GLN 200 Ca 0.03 1.49 -0.01 0.00 0.01 0.00 0.00 55.36 56.88 1fqj s GLN 200 Cb 0.09 -1.82 0.56 0.00 -1.01 0.00 0.00 33.01 30.83 1fqj s GLN 200 CO 0.53 -2.03 1.72 0.00 0.01 0.00 0.00 175.29 175.53 1fqj h ARG 201 N -1.07 0.44 0.00 2.91 3.08 -2.00 -0.95 114.38 116.80 1fqj h ARG 201 Ca -0.45 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.55 1fqj h ARG 201 Cb 1.26 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.21 1fqj h ARG 201 CO 0.47 0.29 -0.15 0.66 -1.07 0.00 0.00 179.97 180.18 1fqj h SER 202 N 0.45 0.00 1.71 7.04 4.64 -1.99 -2.81 113.55 122.59 1fqj h SER 202 Ca 0.47 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.78 1fqj h SER 202 Cb 0.78 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1fqj h SER 202 CO -0.45 0.15 -0.30 -0.08 -0.87 0.00 0.00 176.83 175.29 1fqj h GLU 203 N 0.00 0.00 0.00 4.77 4.57 -1.50 -3.37 114.58 119.06 1fqj h GLU 203 Ca -0.00 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.10 1fqj h GLU 203 Cb 0.42 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 1fqj h GLU 203 CO 0.02 0.05 -0.38 0.00 -1.18 0.00 0.00 179.01 177.51 1fqj h ARG 204 N 0.00 0.00 0.00 1.92 3.08 -1.36 -2.78 114.38 115.25 1fqj h ARG 204 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1fqj h ARG 204 Cb 1.04 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 1fqj h ARG 204 CO 0.01 0.38 -0.10 1.57 -1.07 0.00 0.00 179.97 180.76 1fqj h LYS 205 N 0.00 0.00 0.00 0.04 2.10 -1.75 -1.26 116.57 115.69 1fqj h LYS 205 Ca -0.00 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.62 1fqj h LYS 205 Cb 0.68 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.01 1fqj h LYS 205 CO 0.05 0.10 -0.14 0.87 -2.00 0.00 0.00 179.45 178.32 1fqj h LYS 206 N 0.00 0.00 -0.92 0.07 1.57 -1.76 -3.27 116.57 112.26 1fqj h LYS 206 Ca -0.00 0.00 0.22 0.00 -1.87 0.00 0.00 60.65 59.00 1fqj h LYS 206 Cb 0.26 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.51 1fqj h LYS 206 CO 0.01 0.14 0.62 -1.49 -0.57 0.00 0.00 179.45 178.16 1fqj h TRP 207 N 0.00 0.47 -0.70 -1.35 4.06 -1.34 -1.64 115.95 115.45 1fqj h TRP 207 Ca -0.00 0.01 0.18 0.00 2.06 0.00 0.00 58.89 61.14 1fqj h TRP 207 Cb 0.71 -0.14 -0.04 0.00 -1.00 0.00 0.00 29.16 28.69 1fqj h TRP 207 CO 0.00 0.11 0.49 0.97 -3.56 0.00 0.00 178.44 176.45 1fqj h ILE 208 N 0.34 0.71 0.00 1.49 6.09 -1.75 -1.14 117.51 123.24 1fqj h ILE 208 Ca 0.48 -0.05 0.00 0.00 -1.37 0.00 0.00 64.86 63.92 1fqj h ILE 208 Cb 1.31 0.54 0.00 0.00 0.47 0.00 0.00 36.82 39.15 1fqj h ILE 208 CO -0.17 0.03 0.00 1.41 -3.07 0.00 0.00 178.15 176.35 1fqj n HIS 209 N -4.40 0.00 -1.39 2.19 8.25 -0.62 -2.23 115.22 117.03 1fqj n HIS 209 Ca 0.14 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.62 1fqj n HIS 209 Cb 0.67 -0.34 0.03 0.00 1.12 0.00 0.00 29.99 31.46 1fqj n HIS 209 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fqj n PHE 211 N -0.35 0.79 -2.37 0.00 3.01 -0.95 -4.83 117.46 112.77 1fqj n PHE 211 Ca 0.03 0.23 -0.42 0.00 1.01 0.00 0.00 57.45 58.30 1fqj n PHE 211 Cb 0.60 -0.87 -0.03 0.00 -0.01 0.00 0.00 39.48 39.17 1fqj n PHE 211 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1fqj s GLU 212 N -3.09 4.37 -1.18 -1.08 2.02 -1.26 -4.04 118.70 114.45 1fqj s GLU 212 Ca 0.11 1.80 -0.11 0.00 0.02 0.00 0.00 54.97 56.79 1fqj s GLU 212 Cb 0.13 -3.45 -0.02 0.00 0.10 0.00 0.00 34.13 30.90 1fqj s GLU 212 CO 0.59 -0.39 0.77 0.41 0.02 0.00 0.00 175.26 176.66 1fqj n GLY 213 N 3.37 -0.80 3.68 -1.39 0.00 -1.26 -4.96 105.19 103.82 1fqj n GLY 213 Ca 0.11 0.38 -0.38 0.00 0.00 0.00 0.00 46.02 46.12 1fqj n GLY 213 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fqj s VAL 214 N -3.53 5.17 -0.07 1.61 1.01 -1.26 -4.69 120.40 118.64 1fqj s VAL 214 Ca 0.32 0.82 -0.24 0.00 0.00 0.00 0.00 61.98 62.88 1fqj s VAL 214 Cb -0.09 -3.78 -0.20 0.00 0.00 0.00 0.00 36.38 32.31 1fqj s VAL 214 CO 0.83 0.24 0.93 0.74 0.00 0.00 0.00 175.10 177.83 1fqj h THR 215 N 5.01 1.31 -3.90 3.92 2.02 -1.27 -3.42 112.91 116.59 1fqj h THR 215 Ca -0.36 -1.55 -0.15 0.00 0.77 0.00 0.00 66.41 65.12 1fqj h THR 215 Cb 1.16 2.28 -0.20 0.00 -1.74 0.00 0.00 68.15 69.66 1fqj h THR 215 CO 0.73 0.37 -0.64 0.00 0.37 0.00 0.00 175.52 176.36 1fqj s ALA 216 N -3.32 0.06 -0.13 6.16 0.00 -0.82 -1.35 121.76 122.36 1fqj s ALA 216 Ca -0.15 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.24 1fqj s ALA 216 Cb -0.00 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.31 1fqj s ALA 216 CO 0.59 -0.21 -0.12 0.42 0.00 0.00 0.00 175.76 176.44 1fqj s ILE 217 N -1.88 1.38 -0.37 0.00 1.01 -0.08 -1.50 121.20 119.76 1fqj s ILE 217 Ca -0.12 -0.52 -0.14 0.00 0.00 0.00 0.00 60.65 59.87 1fqj s ILE 217 Cb -0.06 -1.31 -0.00 0.00 0.01 0.00 0.00 42.46 41.09 1fqj s ILE 217 CO -0.02 0.42 0.27 -0.63 0.00 0.00 0.00 174.94 174.98 1fqj s ILE 218 N 1.46 5.27 -0.32 2.92 1.01 -0.35 -0.92 121.20 130.27 1fqj s ILE 218 Ca 0.03 -0.39 -0.14 0.00 0.00 0.00 0.00 60.65 60.15 1fqj s ILE 218 Cb -0.13 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 1fqj s ILE 218 CO -0.08 -0.13 0.30 0.12 0.00 0.00 0.00 174.94 175.15 1fqj s PHE 219 N 1.71 3.22 -0.07 3.97 2.19 -0.41 -1.50 117.98 127.08 1fqj s PHE 219 Ca 0.06 0.01 -0.20 0.00 0.33 0.00 0.00 56.93 57.13 1fqj s PHE 219 Cb -0.18 -2.56 -0.04 0.00 -1.31 0.00 0.00 43.02 38.93 1fqj s PHE 219 CO 0.10 -0.34 0.55 0.00 1.83 0.00 0.00 175.22 177.36 1fqj s VAL 221 N 0.37 0.91 -0.42 0.00 1.01 -0.09 -4.18 120.40 118.00 1fqj s VAL 221 Ca 0.29 -0.39 -0.22 0.00 0.00 0.00 0.00 61.98 61.66 1fqj s VAL 221 Cb -0.16 -0.83 0.02 0.00 0.00 0.00 0.00 36.38 35.40 1fqj s VAL 221 CO 0.14 0.29 0.72 0.00 0.00 0.00 0.00 175.10 176.25 1fqj s ALA 222 N 0.45 3.35 0.18 5.51 0.00 -1.26 0.16 121.76 130.16 1fqj s ALA 222 Ca -0.08 -0.99 -0.13 0.00 0.00 0.00 0.00 51.96 50.76 1fqj s ALA 222 Cb -0.12 -3.36 0.15 0.00 0.00 0.00 0.00 23.12 19.79 1fqj s ALA 222 CO 0.02 -1.73 1.79 -0.07 0.00 0.00 0.00 175.76 175.77 1fqj h LEU 223 N 9.83 0.39 0.00 0.00 3.38 -1.16 -2.33 115.31 125.42 1fqj h LEU 223 Ca -0.25 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1fqj h LEU 223 Cb 1.09 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1fqj h LEU 223 CO 0.91 0.26 0.00 -1.54 0.09 0.00 0.00 178.44 178.17 1fqj n SER 224 N -4.87 0.00 -0.26 -0.43 3.41 -1.26 -3.12 113.62 107.08 1fqj n SER 224 Ca 0.05 -0.31 0.15 0.00 -0.26 0.00 0.00 58.87 58.49 1fqj n SER 224 Cb 0.14 -0.01 0.67 0.00 -0.26 0.00 0.00 64.21 64.76 1fqj n SER 224 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1fqj n ASP 225 N -1.01 0.85 0.27 4.04 9.92 -0.88 -4.26 116.55 125.48 1fqj n ASP 225 Ca 0.08 -1.19 0.18 0.00 -0.53 0.00 0.00 54.79 53.33 1fqj n ASP 225 Cb 0.04 -0.00 0.90 0.00 -0.64 0.00 0.00 41.12 41.41 1fqj n ASP 225 CO 0.00 0.00 0.00 0.10 0.13 0.00 0.00 177.20 177.43 1fqj h TYR 226 N 1.29 0.00 -0.09 1.24 -0.00 -1.76 -1.54 116.97 116.11 1fqj h TYR 226 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1fqj h TYR 226 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.04 1fqj h TYR 226 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 177.76 1fqj n ASP 227 N -3.33 2.68 -4.85 0.10 3.85 -1.26 -3.92 116.55 109.82 1fqj n ASP 227 Ca -0.00 -2.75 -0.21 0.00 -0.71 0.00 0.00 54.79 51.11 1fqj n ASP 227 Cb 0.32 -0.35 -0.04 0.00 -1.35 0.00 0.00 41.12 39.71 1fqj n ASP 227 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1fqj s LEU 228 N -2.32 3.64 0.18 -2.12 1.43 -0.58 -4.85 118.68 114.07 1fqj s LEU 228 Ca 0.27 -0.45 0.11 0.00 -1.03 0.00 0.00 54.13 53.03 1fqj s LEU 228 Cb 0.22 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 1fqj s LEU 228 CO 0.05 -0.31 -0.22 0.68 0.23 0.00 0.00 176.35 176.78 1fqj s VAL 229 N -2.28 2.52 0.37 -1.59 -7.23 -1.26 -1.04 120.40 109.89 1fqj s VAL 229 Ca 0.40 -1.90 -0.28 0.00 -1.81 0.00 0.00 61.98 58.38 1fqj s VAL 229 Cb -0.06 -2.20 -0.11 0.00 0.56 0.00 0.00 36.38 34.57 1fqj s VAL 229 CO 0.27 -0.08 1.49 -0.76 -0.31 0.00 0.00 175.10 175.71 1fqj s LEU 230 N -2.59 4.32 0.36 1.32 1.43 -0.06 -4.74 118.68 118.72 1fqj s LEU 230 Ca 0.20 3.05 0.17 0.00 -1.03 0.00 0.00 54.13 56.52 1fqj s LEU 230 Cb -0.08 -3.67 0.67 0.00 0.03 0.00 0.00 46.19 43.14 1fqj s LEU 230 CO 0.10 -0.88 1.74 0.00 0.23 0.00 0.00 176.35 177.54 1fqj h ALA 231 N 3.09 1.05 0.00 4.21 0.00 -1.99 -2.36 119.26 123.26 1fqj h ALA 231 Ca -0.51 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.03 1fqj h ALA 231 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1fqj h ALA 231 CO 0.65 0.51 -0.57 1.05 0.00 0.00 0.00 179.25 180.89 1fqj h GLU 232 N 0.00 0.00 -1.31 0.00 9.09 -1.99 -3.41 114.58 116.95 1fqj h GLU 232 Ca -0.00 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.22 1fqj h GLU 232 Cb 0.87 0.00 -0.22 0.00 -1.65 0.00 0.00 28.75 27.75 1fqj h GLU 232 CO 0.05 0.00 -0.55 0.34 0.05 0.00 0.00 179.01 178.90 1fqj s ASP 233 N -4.58 -0.69 0.00 3.06 3.68 -1.09 -5.04 116.67 112.01 1fqj s ASP 233 Ca 0.06 -1.35 0.00 0.00 2.13 0.00 0.00 52.55 53.39 1fqj s ASP 233 Cb 0.12 1.46 0.00 0.00 -1.45 0.00 0.00 42.92 43.05 1fqj s ASP 233 CO 0.71 -0.16 0.37 -0.62 0.13 0.00 0.00 175.17 175.60 1fqj n GLU 234 N 3.92 0.38 0.00 4.34 1.02 -0.91 -1.66 120.64 127.72 1fqj n GLU 234 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1fqj n GLU 234 Cb 0.53 -1.31 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 1fqj n GLU 234 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1fqj n GLU 235 N 0.80 0.94 -4.07 3.49 2.13 -1.26 -4.89 120.64 117.78 1fqj n GLU 235 Ca 0.00 -0.15 -0.35 0.00 0.66 0.00 0.00 57.16 57.32 1fqj n GLU 235 Cb 0.19 -0.56 -0.12 0.00 0.27 0.00 0.00 31.44 31.21 1fqj n GLU 235 CO 0.00 0.00 0.00 1.41 -0.41 0.00 0.00 177.13 178.13 1fqj s MET 236 N -0.18 3.64 0.19 5.31 1.75 -0.67 -5.03 119.30 124.32 1fqj s MET 236 Ca 0.00 -0.51 -0.30 0.00 -1.25 0.00 0.00 55.69 53.63 1fqj s MET 236 Cb 0.00 -3.09 -0.09 0.00 2.84 0.00 0.00 34.83 34.49 1fqj s MET 236 CO 0.00 0.03 1.38 1.21 -0.65 0.00 0.00 175.02 176.99 1fqj s ASN 237 N 0.96 6.79 0.26 1.11 3.84 -1.26 -0.88 114.94 125.76 1fqj s ASN 237 Ca 0.02 2.47 -0.04 0.00 0.21 0.00 0.00 52.86 55.51 1fqj s ASN 237 Cb -0.14 -2.61 0.34 0.00 -0.55 0.00 0.00 41.25 38.29 1fqj s ASN 237 CO 0.02 -0.63 1.90 0.03 -2.79 0.00 0.00 177.10 175.64 1fqj h ARG 238 N 5.76 1.23 -0.34 0.43 3.08 -1.25 -1.76 114.38 121.52 1fqj h ARG 238 Ca -0.44 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.53 1fqj h ARG 238 Cb 1.21 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.97 1fqj h ARG 238 CO 0.81 0.81 0.21 1.98 -1.07 0.00 0.00 179.97 182.71 1fqj h MET 239 N 1.26 0.47 -0.65 0.04 4.05 -1.81 -1.16 114.93 117.13 1fqj h MET 239 Ca 0.41 -0.04 0.02 0.00 -0.28 0.00 0.00 59.70 59.80 1fqj h MET 239 Cb 0.02 -0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 30.69 1fqj h MET 239 CO -0.13 0.35 0.42 0.45 0.23 0.00 0.00 176.91 178.23 1fqj h HIS 240 N 0.45 0.80 0.03 1.39 3.86 -1.79 -0.84 115.15 119.04 1fqj h HIS 240 Ca 0.12 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.36 1fqj h HIS 240 Cb 0.00 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.19 1fqj h HIS 240 CO -0.04 0.48 -0.08 1.49 0.86 0.00 0.00 177.93 180.64 1fqj h GLU 241 N 0.85 -0.16 -0.96 2.45 4.57 -0.95 -1.23 114.58 119.16 1fqj h GLU 241 Ca 0.25 0.01 0.10 0.00 -1.18 0.00 0.00 59.36 58.53 1fqj h GLU 241 Cb -0.06 0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.50 1fqj h GLU 241 CO -0.07 -0.10 0.62 0.77 -1.18 0.00 0.00 179.01 179.04 1fqj h SER 242 N -0.16 0.91 0.17 1.04 0.02 -0.83 -0.25 113.55 114.45 1fqj h SER 242 Ca 0.02 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1fqj h SER 242 Cb 0.18 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1fqj h SER 242 CO -0.06 0.53 -0.08 0.24 -1.14 0.00 0.00 176.83 176.32 1fqj h MET 243 N 1.01 -0.22 -0.51 3.45 2.86 -0.57 0.53 114.93 121.47 1fqj h MET 243 Ca 0.45 0.02 0.05 0.00 -2.06 0.00 0.00 59.70 58.15 1fqj h MET 243 Cb 0.37 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 1fqj h MET 243 CO -0.20 0.04 0.34 0.87 1.06 0.00 0.00 176.91 179.01 1fqj h LYS 244 N -0.47 0.48 -0.13 1.72 1.57 -0.78 -1.03 116.57 117.93 1fqj h LYS 244 Ca -0.02 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1fqj h LYS 244 Cb 0.36 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 1fqj h LYS 244 CO 0.04 0.31 -0.22 1.25 -0.57 0.00 0.00 179.45 180.27 1fqj h LEU 245 N 0.49 0.41 -1.32 2.94 5.85 -0.79 -2.98 115.31 119.91 1fqj h LEU 245 Ca 0.22 -0.54 0.01 0.00 0.84 0.00 0.00 57.88 58.41 1fqj h LEU 245 Cb 0.24 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1fqj h LEU 245 CO -0.06 0.87 0.46 0.15 -0.34 0.00 0.00 178.44 179.52 1fqj h PHE 246 N -0.04 0.87 -0.43 1.25 3.57 -0.24 -2.04 116.94 119.88 1fqj h PHE 246 Ca 0.01 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 1fqj h PHE 246 Cb 0.79 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 1fqj h PHE 246 CO 0.10 0.54 0.19 0.22 -2.23 0.00 0.00 178.31 177.14 1fqj h ASP 247 N 0.93 0.57 1.19 0.41 1.82 -1.20 0.48 116.42 120.62 1fqj h ASP 247 Ca 0.26 -0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.75 1fqj h ASP 247 Cb -0.10 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 39.77 1fqj h ASP 247 CO -0.06 0.55 0.00 0.77 -1.61 0.00 0.00 179.24 178.89 1fqj h SER 248 N 0.55 0.00 0.20 2.28 4.64 -1.30 -2.09 113.55 117.83 1fqj h SER 248 Ca 0.14 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.12 1fqj h SER 248 Cb 0.14 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.18 1fqj h SER 248 CO -0.02 0.00 -2.09 -0.38 -0.87 0.00 0.00 176.83 173.48 1fqj n ILE 249 N -2.71 1.56 0.34 0.95 2.08 -0.81 -4.10 119.36 116.69 1fqj n ILE 249 Ca 0.02 -0.75 -0.14 0.00 0.56 0.00 0.00 62.75 62.44 1fqj n ILE 249 Cb 0.34 -1.06 -0.07 0.00 -0.75 0.00 0.00 39.64 38.11 1fqj n ILE 249 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1fqj n ASN 251 N -5.03 7.25 -4.27 0.00 3.02 -0.80 -4.82 115.26 110.62 1fqj n ASN 251 Ca -0.11 -3.01 -0.34 0.00 -0.03 0.00 0.00 54.58 51.09 1fqj n ASN 251 Cb 0.35 -1.35 -0.15 0.00 -0.61 0.00 0.00 39.78 38.03 1fqj n ASN 251 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1fqj s ASN 252 N 0.80 3.85 0.63 6.41 3.84 -1.23 -4.91 114.94 124.34 1fqj s ASN 252 Ca 0.59 -0.45 0.29 0.00 0.21 0.00 0.00 52.86 53.50 1fqj s ASN 252 Cb 0.27 -1.62 1.55 0.00 -0.55 0.00 0.00 41.25 40.90 1fqj s ASN 252 CO -0.12 0.04 1.91 0.11 -2.79 0.00 0.00 177.10 176.24 1fqj h LYS 253 N 7.66 0.00 0.00 0.43 1.57 -1.92 0.19 116.57 124.50 1fqj h LYS 253 Ca -0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 1fqj h LYS 253 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1fqj h LYS 253 CO 0.60 0.00 0.00 -1.49 -0.57 0.00 0.00 179.45 177.99 1fqj h TRP 254 N 0.00 0.00 0.00 -1.35 4.06 -1.94 -3.24 115.95 113.48 1fqj h TRP 254 Ca 0.08 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.03 1fqj h TRP 254 Cb 0.86 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.02 1fqj h TRP 254 CO 0.00 0.00 0.00 1.19 -3.56 0.00 0.00 178.44 176.07 1fqj n PHE 255 N -3.08 0.00 0.12 0.49 3.72 0.63 -4.72 117.46 114.61 1fqj n PHE 255 Ca 0.01 -0.43 0.04 0.00 -0.05 0.00 0.00 57.45 57.02 1fqj n PHE 255 Cb 0.30 -0.04 0.24 0.00 -0.94 0.00 0.00 39.48 39.04 1fqj n PHE 255 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1fqj n THR 256 N -0.43 0.68 -1.41 4.37 -2.24 -1.05 0.79 114.28 114.99 1fqj n THR 256 Ca 0.00 0.68 0.06 0.00 -2.27 0.00 0.00 64.05 62.52 1fqj n THR 256 Cb 0.27 -1.68 0.09 0.00 -2.10 0.00 0.00 70.33 66.91 1fqj n THR 256 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1fqj n ASP 257 N -1.82 1.51 -4.79 3.42 -0.08 -1.26 -5.05 116.55 108.48 1fqj n ASP 257 Ca -0.01 -2.71 -0.31 0.00 -1.51 0.00 0.00 54.79 50.26 1fqj n ASP 257 Cb 0.33 -0.35 -0.06 0.00 2.34 0.00 0.00 41.12 43.38 1fqj n ASP 257 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1fqj s THR 258 N -1.85 4.61 -0.43 5.18 2.01 0.24 -4.98 115.64 120.40 1fqj s THR 258 Ca 0.21 -0.72 -0.26 0.00 0.31 0.00 0.00 61.69 61.23 1fqj s THR 258 Cb 0.18 -3.22 0.02 0.00 0.01 0.00 0.00 72.50 69.50 1fqj s THR 258 CO 0.02 0.14 0.95 -0.44 -0.69 0.00 0.00 174.62 174.60 1fqj s SER 259 N -2.37 6.57 -0.33 3.53 0.01 -0.45 -4.92 113.70 115.74 1fqj s SER 259 Ca 0.29 0.31 -0.12 0.00 1.31 0.00 0.00 55.95 57.74 1fqj s SER 259 Cb -0.12 -2.47 -0.02 0.00 0.21 0.00 0.00 66.02 63.62 1fqj s SER 259 CO 0.22 -1.02 0.23 -0.63 0.41 0.00 0.00 173.24 172.45 1fqj s ILE 260 N 3.76 5.27 -0.26 1.44 1.01 -1.26 -0.90 121.20 130.26 1fqj s ILE 260 Ca 0.39 -0.14 -0.04 0.00 0.00 0.00 0.00 60.65 60.86 1fqj s ILE 260 Cb -0.10 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.71 1fqj s ILE 260 CO 0.25 0.05 -0.00 -0.63 0.00 0.00 0.00 174.94 174.60 1fqj s ILE 261 N 1.73 3.43 0.04 2.92 1.09 -0.10 -2.17 121.20 128.14 1fqj s ILE 261 Ca 0.06 -0.76 -0.26 0.00 -1.10 0.00 0.00 60.65 58.60 1fqj s ILE 261 Cb -0.17 -2.71 -0.05 0.00 -1.06 0.00 0.00 42.46 38.47 1fqj s ILE 261 CO 0.11 0.21 0.80 -0.22 -0.10 0.00 0.00 174.94 175.73 1fqj s LEU 262 N 1.43 4.44 -0.37 2.97 2.96 -0.77 -1.29 118.68 128.05 1fqj s LEU 262 Ca 0.02 1.48 -0.02 0.00 -0.22 0.00 0.00 54.13 55.39 1fqj s LEU 262 Cb -0.16 -3.28 0.09 0.00 0.50 0.00 0.00 46.19 43.34 1fqj s LEU 262 CO -0.01 -0.02 0.13 -0.36 -1.32 0.00 0.00 176.35 174.77 1fqj s PHE 263 N 0.08 3.51 -1.05 5.38 0.40 0.10 -1.95 117.98 124.45 1fqj s PHE 263 Ca 0.40 -2.30 -0.20 0.00 -0.60 0.00 0.00 56.93 54.23 1fqj s PHE 263 Cb -0.21 -2.88 0.09 0.00 0.51 0.00 0.00 43.02 40.54 1fqj s PHE 263 CO 0.24 -0.92 1.38 -0.51 0.70 0.00 0.00 175.22 176.11 1fqj s LEU 264 N 1.15 4.25 0.78 -0.37 1.43 -0.75 -0.92 118.68 124.25 1fqj s LEU 264 Ca 0.05 -1.98 -0.09 0.00 -1.03 0.00 0.00 54.13 51.08 1fqj s LEU 264 Cb -0.22 -2.49 0.10 0.00 0.03 0.00 0.00 46.19 43.61 1fqj s LEU 264 CO -0.04 -1.22 1.11 0.21 0.23 0.00 0.00 176.35 176.64 1fqj s ASN 265 N 4.17 4.33 -1.22 2.29 2.47 0.12 -1.71 114.94 125.39 1fqj s ASN 265 Ca 0.42 0.37 -0.07 0.00 0.42 0.00 0.00 52.86 54.00 1fqj s ASN 265 Cb -0.01 -0.82 0.01 0.00 -1.45 0.00 0.00 41.25 38.97 1fqj s ASN 265 CO -0.06 -1.93 0.97 0.29 -3.72 0.00 0.00 177.10 172.65 1fqj n LYS 266 N -3.16 -6.66 0.07 0.43 5.02 -0.83 -0.70 118.16 112.34 1fqj n LYS 266 Ca 0.10 0.74 0.01 0.00 -2.02 0.00 0.00 58.31 57.14 1fqj n LYS 266 Cb 0.60 -5.48 0.33 0.00 -0.02 0.00 0.00 35.03 30.47 1fqj n LYS 266 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1fqj h LYS 267 N -2.23 0.34 -0.37 1.97 2.10 -1.67 -1.05 116.57 115.66 1fqj h LYS 267 Ca -0.50 -0.09 -0.03 0.00 -2.00 0.00 0.00 60.65 58.04 1fqj h LYS 267 Cb 1.33 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.60 1fqj h LYS 267 CO 0.49 0.47 0.12 0.38 -2.00 0.00 0.00 179.45 178.91 1fqj h ASP 268 N 0.32 0.54 0.08 7.07 -0.00 -1.91 -0.03 116.42 122.49 1fqj h ASP 268 Ca 0.06 -0.20 -0.14 0.00 -0.00 0.00 0.00 57.03 56.74 1fqj h ASP 268 Cb 0.42 -0.14 -0.01 0.00 -0.00 0.00 0.00 39.33 39.60 1fqj h ASP 268 CO 0.02 0.60 -0.50 -0.07 -0.00 0.00 0.00 179.24 179.29 1fqj h LEU 269 N 0.45 0.52 -0.74 0.15 3.38 -1.90 -3.03 115.31 114.14 1fqj h LEU 269 Ca 0.12 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 1fqj h LEU 269 Cb 0.25 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1fqj h LEU 269 CO -0.00 0.93 0.21 0.15 0.09 0.00 0.00 178.44 179.82 1fqj h PHE 270 N 0.38 1.21 -0.53 1.13 3.57 -0.98 -1.36 116.94 120.36 1fqj h PHE 270 Ca 0.02 -0.13 0.01 0.00 3.53 0.00 0.00 57.97 61.39 1fqj h PHE 270 Cb 1.01 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 39.38 1fqj h PHE 270 CO 0.04 0.96 0.34 1.49 -2.23 0.00 0.00 178.31 178.91 1fqj h GLU 271 N 1.10 0.67 -0.30 1.11 4.81 -0.88 -0.94 114.58 120.15 1fqj h GLU 271 Ca 0.23 -0.04 -0.16 0.00 -0.13 0.00 0.00 59.36 59.26 1fqj h GLU 271 Cb 0.34 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1fqj h GLU 271 CO -0.00 0.45 -0.45 0.93 -0.73 0.00 0.00 179.01 179.20 1fqj h GLU 272 N 0.69 0.84 -0.27 1.92 4.39 -1.48 -3.32 114.58 117.35 1fqj h GLU 272 Ca 0.20 -0.50 -0.15 0.00 0.34 0.00 0.00 59.36 59.25 1fqj h GLU 272 Cb -0.06 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1fqj h GLU 272 CO -0.06 1.13 -0.45 -0.22 -1.16 0.00 0.00 179.01 178.26 1fqj h LYS 273 N 0.61 0.70 0.00 2.33 3.64 -1.03 -3.10 116.57 119.73 1fqj h LYS 273 Ca 0.03 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1fqj h LYS 273 Cb 1.05 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1fqj h LYS 273 CO 0.10 1.00 0.00 0.97 -2.27 0.00 0.00 179.45 179.25 1fqj h ILE 274 N 0.56 0.00 0.00 2.00 6.09 -1.27 0.12 117.51 125.01 1fqj h ILE 274 Ca 0.04 -0.13 -0.07 0.00 -1.37 0.00 0.00 64.86 63.33 1fqj h ILE 274 Cb 0.99 1.11 -0.01 0.00 0.47 0.00 0.00 36.82 39.38 1fqj h ILE 274 CO 0.09 0.00 -0.31 0.11 -3.07 0.00 0.00 178.15 174.97 1fqj h LYS 275 N 0.00 0.00 0.00 2.19 1.57 -1.67 -3.35 116.57 115.31 1fqj h LYS 275 Ca 0.00 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.56 1fqj h LYS 275 Cb 0.13 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 1fqj h LYS 275 CO 0.00 0.31 -1.84 1.63 -0.57 0.00 0.00 179.45 178.98 1fqj n LYS 276 N -3.44 1.06 -4.78 3.15 5.02 -0.23 -5.00 118.16 113.94 1fqj n LYS 276 Ca 0.00 0.05 -0.33 0.00 -2.02 0.00 0.00 58.31 56.01 1fqj n LYS 276 Cb 0.49 -1.30 -0.14 0.00 -0.02 0.00 0.00 35.03 34.06 1fqj n LYS 276 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1fqj s SER 277 N -5.05 4.08 0.11 4.39 0.15 0.25 -5.11 113.70 112.51 1fqj s SER 277 Ca -0.14 -0.27 -0.30 0.00 0.70 0.00 0.00 55.95 55.93 1fqj s SER 277 Cb 0.05 -1.42 -0.06 0.00 -1.71 0.00 0.00 66.02 62.88 1fqj s SER 277 CO 0.40 0.22 1.11 -2.16 1.20 0.00 0.00 173.24 174.01 1fqj s PRO 278 N 0.04 4.53 0.25 5.44 0.04 -1.26 -4.40 135.00 139.65 1fqj s PRO 278 Ca -0.04 1.68 0.15 0.00 0.04 0.00 0.00 61.00 62.82 1fqj s PRO 278 Cb -0.14 -3.33 0.81 0.00 0.04 0.00 0.00 34.50 31.87 1fqj s PRO 278 CO 0.04 -0.06 1.42 -0.11 0.04 0.00 0.00 177.00 178.34 1fqj n LEU 279 N 3.18 0.39 0.24 -3.56 7.94 -1.26 -1.52 117.00 122.40 1fqj n LEU 279 Ca 0.05 0.65 0.16 0.00 -1.11 0.00 0.00 56.01 55.77 1fqj n LEU 279 Cb 0.47 -0.68 0.71 0.00 0.53 0.00 0.00 43.42 44.46 1fqj n LEU 279 CO 0.54 -0.78 0.97 0.00 -1.11 0.00 0.00 177.39 177.01 1fqj h THR 280 N 0.00 0.00 -0.12 1.96 1.03 -1.91 -1.76 112.91 112.11 1fqj h THR 280 Ca 0.00 -0.31 -0.07 0.00 -0.01 0.00 0.00 66.41 66.02 1fqj h THR 280 Cb 0.15 1.19 -0.01 0.00 -1.07 0.00 0.00 68.15 68.41 1fqj h THR 280 CO 0.00 0.00 -0.23 0.40 -0.01 0.00 0.00 175.52 175.68 1fqj h ILE 281 N 0.00 1.22 0.00 0.00 2.04 -1.61 -3.28 117.51 115.89 1fqj h ILE 281 Ca 0.00 -1.04 -0.13 0.00 1.00 0.00 0.00 64.86 64.68 1fqj h ILE 281 Cb 0.35 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1fqj h ILE 281 CO 0.00 0.32 -0.99 0.00 0.00 0.00 0.00 178.15 177.47 1fqj s TYR 283 N -2.34 3.32 0.26 0.00 1.51 -0.71 -4.97 117.35 114.42 1fqj s TYR 283 Ca -0.23 -1.74 0.03 0.00 -1.01 0.00 0.00 57.07 54.12 1fqj s TYR 283 Cb 0.05 -2.47 0.33 0.00 -0.11 0.00 0.00 41.96 39.76 1fqj s TYR 283 CO 0.41 -0.81 1.64 -1.35 -1.11 0.00 0.00 175.55 174.33 1fqj h PRO 284 N 8.15 0.37 -0.21 -1.71 0.11 -1.85 -2.92 132.00 133.93 1fqj h PRO 284 Ca -0.21 -0.19 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1fqj h PRO 284 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1fqj h PRO 284 CO 0.62 0.74 0.00 0.39 -0.21 0.00 0.00 178.00 179.54 1fqj n GLU 285 N -4.01 0.52 -3.26 1.05 1.02 -1.26 -4.73 120.64 109.97 1fqj n GLU 285 Ca -0.02 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.74 1fqj n GLU 285 Cb 0.51 -1.11 -0.06 0.00 -0.02 0.00 0.00 31.44 30.77 1fqj n GLU 285 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1fqj s TYR 286 N -1.59 3.49 -0.00 -0.32 5.04 -1.10 -4.92 117.35 117.95 1fqj s TYR 286 Ca 0.00 0.91 0.00 0.00 -2.44 0.00 0.00 57.07 55.54 1fqj s TYR 286 Cb 0.00 -2.61 -0.00 0.00 0.35 0.00 0.00 41.96 39.70 1fqj s TYR 286 CO 0.00 0.09 0.00 0.00 -1.34 0.00 0.00 175.55 174.30 1fqj n ALA 287 N 3.96 2.00 -0.97 3.97 0.00 -1.26 -4.91 120.51 123.30 1fqj n ALA 287 Ca -0.06 -0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.35 1fqj n ALA 287 Cb 0.51 -0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.01 1fqj n ALA 287 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fqj n GLY 288 N 1.10 -2.87 0.00 0.00 0.00 -1.26 -5.08 105.19 97.09 1fqj n GLY 288 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1fqj n GLY 288 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1fqj n SER 289 N -3.41 0.00 -3.68 1.61 3.41 -1.26 -5.07 113.62 105.22 1fqj n SER 289 Ca 0.03 -0.45 -0.27 0.00 -0.26 0.00 0.00 58.87 57.92 1fqj n SER 289 Cb 0.11 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.96 1fqj n SER 289 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1fqj n ASN 290 N -1.34 2.62 -4.30 4.04 5.03 -1.26 -4.29 115.26 115.75 1fqj n ASN 290 Ca 0.00 -3.14 -0.24 0.00 0.87 0.00 0.00 54.58 52.07 1fqj n ASN 290 Cb 0.00 -0.70 -0.12 0.00 -1.02 0.00 0.00 39.78 37.93 1fqj n ASN 290 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1fqj s THR 291 N -1.52 1.77 0.28 3.41 2.01 -1.26 -4.69 115.64 115.63 1fqj s THR 291 Ca 0.30 -1.65 0.01 0.00 0.31 0.00 0.00 61.69 60.66 1fqj s THR 291 Cb 0.03 -1.65 0.26 0.00 0.01 0.00 0.00 72.50 71.15 1fqj s THR 291 CO -0.13 -0.12 1.76 0.22 -0.69 0.00 0.00 174.62 175.66 1fqj h TYR 292 N 3.85 0.85 0.07 4.92 5.03 -1.93 -0.99 116.97 128.77 1fqj h TYR 292 Ca -0.45 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 60.89 1fqj h TYR 292 Cb 1.19 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 39.23 1fqj h TYR 292 CO 0.63 0.19 -0.03 1.49 -1.32 0.00 0.00 178.16 179.12 1fqj h GLU 293 N 0.66 -0.09 0.00 1.82 4.81 -1.95 -2.86 114.58 116.97 1fqj h GLU 293 Ca 0.50 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.74 1fqj h GLU 293 Cb 0.74 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.14 1fqj h GLU 293 CO -0.38 0.49 0.00 -1.91 -0.73 0.00 0.00 179.01 176.48 1fqj n GLU 294 N -4.79 0.00 -0.04 1.92 4.07 -0.91 -2.86 120.64 118.03 1fqj n GLU 294 Ca -0.08 0.14 0.21 0.00 -0.06 0.00 0.00 57.16 57.38 1fqj n GLU 294 Cb 0.30 -0.92 0.68 0.00 -0.06 0.00 0.00 31.44 31.45 1fqj n GLU 294 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1fqj h ALA 295 N -2.06 2.53 0.00 4.31 0.00 -1.38 0.25 119.26 122.90 1fqj h ALA 295 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1fqj h ALA 295 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1fqj h ALA 295 CO 0.00 -0.70 0.00 0.41 0.00 0.00 0.00 179.25 178.96 1fqj n GLY 296 N -1.64 -0.80 0.08 0.00 0.00 -1.08 -2.58 105.19 99.17 1fqj n GLY 296 Ca 0.12 0.01 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 1fqj n GLY 296 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fqj n ASN 297 N -1.64 1.80 0.21 1.61 3.02 0.07 -3.82 115.26 116.51 1fqj n ASN 297 Ca 0.01 -0.03 0.05 0.00 -0.03 0.00 0.00 54.58 54.59 1fqj n ASN 297 Cb 0.09 0.50 0.48 0.00 -0.61 0.00 0.00 39.78 40.24 1fqj n ASN 297 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1fqj h TYR 298 N 0.00 0.00 0.21 3.10 3.20 -1.42 -0.99 116.97 121.07 1fqj h TYR 298 Ca -0.40 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.46 1fqj h TYR 298 Cb 1.81 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.08 1fqj h TYR 298 CO 0.01 0.26 -0.10 0.82 -1.64 0.00 0.00 178.16 177.50 1fqj h ILE 299 N 0.00 0.60 -1.02 1.81 2.04 -1.70 -2.65 117.51 116.59 1fqj h ILE 299 Ca -0.00 -1.01 0.25 0.00 1.00 0.00 0.00 64.86 65.10 1fqj h ILE 299 Cb 0.49 1.02 -0.10 0.00 -0.74 0.00 0.00 36.82 37.49 1fqj h ILE 299 CO 0.03 0.16 0.65 0.50 0.00 0.00 0.00 178.15 179.49 1fqj h LYS 300 N -0.94 0.45 0.00 2.37 3.64 -1.61 0.61 116.57 121.09 1fqj h LYS 300 Ca -0.03 -0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 59.14 1fqj h LYS 300 Cb 0.48 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1fqj h LYS 300 CO 0.05 0.30 -0.86 0.28 -2.27 0.00 0.00 179.45 176.95 1fqj h VAL 301 N 0.46 1.57 0.00 2.00 2.07 -1.22 -2.41 116.25 118.73 1fqj h VAL 301 Ca 0.60 -2.80 -0.03 0.00 0.82 0.00 0.00 66.70 65.28 1fqj h VAL 301 Cb 1.38 2.53 -0.00 0.00 -1.52 0.00 0.00 31.29 33.68 1fqj h VAL 301 CO -0.33 0.81 -0.17 1.56 0.02 0.00 0.00 177.57 179.46 1fqj h GLN 302 N 0.03 0.00 0.04 1.57 1.08 -0.50 -2.10 115.11 115.23 1fqj h GLN 302 Ca -0.02 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.03 1fqj h GLN 302 Cb 1.50 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.92 1fqj h GLN 302 CO 0.12 0.17 -0.79 0.74 -0.95 0.00 0.00 178.83 178.11 1fqj h PHE 303 N 0.00 0.15 0.00 2.96 0.04 -1.47 -3.34 116.94 115.29 1fqj h PHE 303 Ca -0.00 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1fqj h PHE 303 Cb 0.31 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.45 1fqj h PHE 303 CO 0.00 1.31 0.00 -0.07 -0.60 0.00 0.00 178.31 178.95 1fqj h LEU 304 N -0.78 0.00 -1.12 1.54 3.38 -1.35 -0.22 115.31 116.76 1fqj h LEU 304 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1fqj h LEU 304 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1fqj h LEU 304 CO -0.04 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.87 1fqj n GLU 305 N -2.90 1.72 0.00 1.13 -0.58 -0.80 -3.37 120.64 115.84 1fqj n GLU 305 Ca -0.02 -1.10 0.11 0.00 -0.42 0.00 0.00 57.16 55.72 1fqj n GLU 305 Cb 0.08 -1.31 -0.04 0.00 -0.57 0.00 0.00 31.44 29.60 1fqj n GLU 305 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1fqj n LEU 306 N 0.36 0.79 -4.60 -4.62 4.77 -0.09 -4.86 117.00 108.74 1fqj n LEU 306 Ca 0.13 -0.32 -0.43 0.00 -0.03 0.00 0.00 56.01 55.37 1fqj n LEU 306 Cb 0.29 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.30 1fqj n LEU 306 CO 0.10 0.18 1.09 0.21 -1.33 0.00 0.00 177.39 177.64 1fqj s ASN 307 N -3.24 6.52 0.06 -1.43 2.47 -1.22 -4.77 114.94 113.35 1fqj s ASN 307 Ca 0.07 0.49 -0.22 0.00 0.42 0.00 0.00 52.86 53.61 1fqj s ASN 307 Cb 0.16 -2.55 -0.13 0.00 -1.45 0.00 0.00 41.25 37.28 1fqj s ASN 307 CO 0.84 -1.35 1.56 0.24 -3.72 0.00 0.00 177.10 174.67 1fqj h MET 308 N 9.67 0.18 -1.53 0.43 2.86 -1.91 -2.47 114.93 122.15 1fqj h MET 308 Ca -0.24 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1fqj h MET 308 Cb 1.07 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.71 1fqj h MET 308 CO 1.13 0.34 0.00 0.54 1.06 0.00 0.00 176.91 179.98 1fqj n ARG 309 N -4.87 0.80 -0.24 1.72 5.12 -1.26 -4.28 116.66 113.65 1fqj n ARG 309 Ca -0.06 0.00 0.03 0.00 -1.93 0.00 0.00 57.85 55.89 1fqj n ARG 309 Cb 0.15 -1.10 0.15 0.00 -1.16 0.00 0.00 32.46 30.50 1fqj n ARG 309 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 1fqj h ARG 310 N 0.90 0.51 -0.94 5.56 2.43 -1.61 2.17 114.38 123.39 1fqj h ARG 310 Ca 0.00 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.05 1fqj h ARG 310 Cb 0.80 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 30.18 1fqj h ARG 310 CO 0.00 0.34 0.12 -0.25 -1.51 0.00 0.00 179.97 178.66 1fqj n ASP 311 N -4.93 2.91 0.07 -3.80 8.00 -1.26 -4.11 116.55 113.43 1fqj n ASP 311 Ca 0.12 -2.41 0.00 0.00 0.71 0.00 0.00 54.79 53.21 1fqj n ASP 311 Cb 0.33 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.84 1fqj n ASP 311 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1fqj n VAL 312 N 0.08 0.00 -4.19 2.53 0.31 0.07 -5.10 118.33 112.03 1fqj n VAL 312 Ca 0.14 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 64.13 1fqj n VAL 312 Cb 0.73 -0.31 -0.11 0.00 -0.91 0.00 0.00 33.84 33.24 1fqj n VAL 312 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1fqj s LYS 313 N -2.00 3.76 -0.32 5.55 2.20 0.71 -5.09 119.74 124.56 1fqj s LYS 313 Ca 0.00 -0.46 -0.11 0.00 -0.36 0.00 0.00 55.97 55.04 1fqj s LYS 313 Cb 0.00 -3.06 -0.02 0.00 -1.51 0.00 0.00 37.83 33.24 1fqj s LYS 313 CO 0.00 0.20 0.20 -2.00 -0.36 0.00 0.00 175.35 173.39 1fqj s GLU 314 N 0.51 3.57 -0.21 4.03 2.12 -1.26 -4.19 118.70 123.28 1fqj s GLU 314 Ca -0.01 -0.58 -0.23 0.00 0.36 0.00 0.00 54.97 54.51 1fqj s GLU 314 Cb -0.14 -3.70 -0.01 0.00 0.26 0.00 0.00 34.13 30.54 1fqj s GLU 314 CO 0.02 -0.37 0.75 0.42 -0.54 0.00 0.00 175.26 175.55 1fqj s ILE 315 N 1.70 4.92 0.53 -3.70 -1.09 -1.26 -4.79 121.20 117.51 1fqj s ILE 315 Ca 0.06 1.44 -0.09 0.00 -2.23 0.00 0.00 60.65 59.83 1fqj s ILE 315 Cb -0.17 -4.06 0.12 0.00 -1.58 0.00 0.00 42.46 36.78 1fqj s ILE 315 CO 0.09 0.02 0.71 -1.22 -1.23 0.00 0.00 174.94 173.31 1fqj n TYR 316 N 5.47 -3.97 -3.63 3.97 4.02 -0.92 -4.90 117.16 117.20 1fqj n TYR 316 Ca 0.03 -0.62 -0.03 0.00 -0.01 0.00 0.00 57.90 57.26 1fqj n TYR 316 Cb 0.49 -0.55 -0.03 0.00 -0.02 0.00 0.00 39.34 39.22 1fqj n TYR 316 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1fqj s SER 317 N -3.58 -0.08 -0.11 7.72 1.04 -1.25 -1.85 113.70 115.58 1fqj s SER 317 Ca 0.40 0.06 -0.13 0.00 0.48 0.00 0.00 55.95 56.77 1fqj s SER 317 Cb -0.01 0.08 0.03 0.00 0.10 0.00 0.00 66.02 66.22 1fqj s SER 317 CO 0.28 -0.10 0.34 -1.00 0.98 0.00 0.00 173.24 173.75 1fqj s HIS 318 N -1.50 -0.35 -0.21 5.02 3.76 -0.82 -4.94 115.29 116.25 1fqj s HIS 318 Ca 0.08 0.83 -0.28 0.00 -0.15 0.00 0.00 55.06 55.54 1fqj s HIS 318 Cb -0.01 0.13 0.00 0.00 1.11 0.00 0.00 32.58 33.81 1fqj s HIS 318 CO -0.05 -0.22 0.96 -1.64 -0.85 0.00 0.00 174.74 172.94 1fqj s MET 319 N -0.06 4.27 0.15 1.40 -1.94 -1.26 -1.81 119.30 120.04 1fqj s MET 319 Ca -0.02 1.23 0.04 0.00 -1.71 0.00 0.00 55.69 55.23 1fqj s MET 319 Cb -0.03 -3.62 -0.04 0.00 2.01 0.00 0.00 34.83 33.15 1fqj s MET 319 CO 0.01 -0.52 -0.08 0.95 -0.01 0.00 0.00 175.02 175.37 1fqj s THR 320 N 2.82 1.02 -0.33 2.05 -4.23 -0.70 -4.97 115.64 111.30 1fqj s THR 320 Ca 0.42 -2.03 -0.00 0.00 -1.18 0.00 0.00 61.69 58.90 1fqj s THR 320 Cb -0.16 -1.89 0.11 0.00 1.34 0.00 0.00 72.50 71.90 1fqj s THR 320 CO 0.09 -0.71 0.12 0.00 -0.54 0.00 0.00 174.62 173.58 1fqj h ALA 322 N 7.85 2.14 -0.00 0.00 0.00 -1.96 -0.10 119.26 127.19 1fqj h ALA 322 Ca -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1fqj h ALA 322 Cb 1.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1fqj h ALA 322 CO 0.46 -0.46 -0.10 0.25 0.00 0.00 0.00 179.25 179.40 1fqj n THR 323 N -4.09 0.00 -3.10 0.00 -2.24 -1.26 -4.61 114.28 98.98 1fqj n THR 323 Ca 0.05 -0.03 -0.44 0.00 -2.27 0.00 0.00 64.05 61.36 1fqj n THR 323 Cb 0.45 -0.24 -0.05 0.00 -2.10 0.00 0.00 70.33 68.39 1fqj n THR 323 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1fqj s ASP 324 N -2.67 6.19 0.30 3.42 -1.08 -0.05 -4.94 116.67 117.85 1fqj s ASP 324 Ca 0.24 -1.26 0.03 0.00 -0.52 0.00 0.00 52.55 51.04 1fqj s ASP 324 Cb 0.20 -2.31 0.61 0.00 -1.46 0.00 0.00 42.92 39.95 1fqj s ASP 324 CO 0.51 -1.09 1.85 0.74 0.52 0.00 0.00 175.17 177.69 1fqj h THR 325 N 5.92 0.91 -0.25 1.71 2.02 -1.83 -1.41 112.91 119.98 1fqj h THR 325 Ca -0.29 -0.32 -0.15 0.00 0.77 0.00 0.00 66.41 66.42 1fqj h THR 325 Cb 1.09 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1fqj h THR 325 CO 1.08 0.17 -0.47 -0.61 0.37 0.00 0.00 175.52 176.05 1fqj h GLN 326 N 0.94 0.66 -0.18 6.66 5.75 -1.94 -2.20 115.11 124.79 1fqj h GLN 326 Ca 0.48 -0.37 -0.14 0.00 -0.15 0.00 0.00 58.65 58.47 1fqj h GLN 326 Cb 0.52 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.09 1fqj h GLN 326 CO -0.25 0.99 -0.47 -0.97 -2.65 0.00 0.00 178.83 175.48 1fqj h ASN 327 N 0.52 0.50 -0.32 -0.69 -0.00 -1.70 -2.76 115.58 111.14 1fqj h ASN 327 Ca 0.03 -0.24 -0.12 0.00 -0.00 0.00 0.00 56.30 55.98 1fqj h ASN 327 Cb 1.02 -0.14 -0.01 0.00 -0.00 0.00 0.00 38.32 39.19 1fqj h ASN 327 CO 0.10 0.89 -0.26 0.58 -0.00 0.00 0.00 177.43 178.74 1fqj h VAL 328 N 0.37 1.29 -0.59 2.57 2.07 -1.19 -2.10 116.25 118.67 1fqj h VAL 328 Ca 0.02 -1.41 0.08 0.00 0.82 0.00 0.00 66.70 66.21 1fqj h VAL 328 Cb 0.96 1.50 -0.07 0.00 -1.52 0.00 0.00 31.29 32.17 1fqj h VAL 328 CO 0.08 0.46 0.24 0.50 0.02 0.00 0.00 177.57 178.87 1fqj h LYS 329 N 0.49 0.42 0.48 1.57 3.64 -1.32 0.22 116.57 122.07 1fqj h LYS 329 Ca 0.06 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1fqj h LYS 329 Cb 0.82 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1fqj h LYS 329 CO 0.07 0.28 -0.23 0.35 -2.27 0.00 0.00 179.45 177.65 1fqj h PHE 330 N 0.44 -0.59 -0.05 1.91 3.57 -1.35 -2.08 116.94 118.78 1fqj h PHE 330 Ca 0.29 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 1fqj h PHE 330 Cb 0.32 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 1fqj h PHE 330 CO -0.15 -0.29 -0.09 0.28 -2.23 0.00 0.00 178.31 175.82 1fqj h VAL 331 N -0.82 1.10 -0.13 1.41 2.07 -1.11 -1.16 116.25 117.62 1fqj h VAL 331 Ca -0.07 -0.45 -0.08 0.00 0.82 0.00 0.00 66.70 66.93 1fqj h VAL 331 Cb 0.57 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1fqj h VAL 331 CO 0.11 0.13 -0.23 0.15 0.02 0.00 0.00 177.57 177.75 1fqj h PHE 332 N 0.08 0.48 -0.77 1.57 3.57 -0.51 -0.71 116.94 120.65 1fqj h PHE 332 Ca 0.02 -0.17 0.11 0.00 3.53 0.00 0.00 57.97 61.46 1fqj h PHE 332 Cb 0.21 -0.09 -0.08 0.00 2.79 0.00 0.00 35.95 38.79 1fqj h PHE 332 CO 0.00 0.85 0.39 0.22 -2.23 0.00 0.00 178.31 177.54 1fqj h ASP 333 N -0.02 0.50 -0.23 0.41 1.82 -0.95 0.67 116.42 118.63 1fqj h ASP 333 Ca 0.01 0.07 0.01 0.00 -0.39 0.00 0.00 57.03 56.72 1fqj h ASP 333 Cb 0.81 -0.02 -0.02 0.00 0.68 0.00 0.00 39.33 40.79 1fqj h ASP 333 CO 0.05 0.27 0.13 0.00 -1.61 0.00 0.00 179.24 178.08 1fqj h ALA 334 N 1.47 0.28 -0.54 -0.78 0.00 -1.02 -1.66 119.26 117.02 1fqj h ALA 334 Ca 0.39 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.35 1fqj h ALA 334 Cb 0.45 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1fqj h ALA 334 CO -0.30 -0.27 0.26 0.28 0.00 0.00 0.00 179.25 179.22 1fqj h VAL 335 N 0.27 0.92 0.37 0.00 2.07 0.39 -1.85 116.25 118.42 1fqj h VAL 335 Ca 0.09 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1fqj h VAL 335 Cb -0.00 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 1fqj h VAL 335 CO -0.04 0.09 -0.35 0.74 0.02 0.00 0.00 177.57 178.02 1fqj h THR 336 N 0.49 0.00 -1.20 2.57 2.02 -0.53 -1.15 112.91 115.12 1fqj h THR 336 Ca 0.24 0.00 0.38 0.00 0.77 0.00 0.00 66.41 67.81 1fqj h THR 336 Cb 0.19 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.47 1fqj h THR 336 CO -0.19 0.00 0.75 0.44 0.37 0.00 0.00 175.52 176.89 1fqj h ASP 337 N -0.72 0.33 0.33 4.18 3.45 -1.10 0.33 116.42 123.22 1fqj h ASP 337 Ca -0.05 0.14 -0.02 0.00 0.43 0.00 0.00 57.03 57.54 1fqj h ASP 337 Cb 0.62 0.12 0.00 0.00 -0.56 0.00 0.00 39.33 39.51 1fqj h ASP 337 CO -0.04 -0.14 -0.16 0.40 -1.57 0.00 0.00 179.24 177.73 1fqj h ILE 338 N 0.17 0.68 0.10 0.35 2.04 -0.48 -2.43 117.51 117.94 1fqj h ILE 338 Ca 0.77 -0.42 0.02 0.00 1.00 0.00 0.00 64.86 66.23 1fqj h ILE 338 Cb 2.21 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 39.14 1fqj h ILE 338 CO -0.45 0.08 -0.36 0.40 0.00 0.00 0.00 178.15 177.83 1fqj h ILE 339 N -0.69 0.26 -0.78 -0.67 2.04 0.75 -2.68 117.51 115.73 1fqj h ILE 339 Ca -0.05 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.96 1fqj h ILE 339 Cb 0.48 0.26 -0.14 0.00 -0.74 0.00 0.00 36.82 36.67 1fqj h ILE 339 CO 0.08 0.00 -0.27 0.40 0.00 0.00 0.00 178.15 178.36 1fqj h ILE 340 N -0.57 0.15 0.00 -0.67 2.04 -1.04 0.35 117.51 117.77 1fqj h ILE 340 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 1fqj h ILE 340 Cb 0.61 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1fqj h ILE 340 CO -0.22 0.00 0.00 0.29 0.00 0.00 0.00 178.15 178.22 1fqj n LYS 341 N -5.50 0.23 0.00 2.37 5.02 -0.92 -5.11 118.16 114.26 1fqj n LYS 341 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1fqj n LYS 341 Cb 0.40 -1.05 0.00 0.00 -0.02 0.00 0.00 35.03 34.36 1fqj n LYS 341 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27