#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 4.72 -0.21 8.89 -1.32 -1.26 -2.71 115.64 123.75 1fqj s THR 29 Ca 0.00 1.12 0.02 0.00 -1.21 0.00 0.00 61.69 61.62 1fqj s THR 29 Cb 0.00 -3.84 0.04 0.00 -1.51 0.00 0.00 72.50 67.18 1fqj s THR 29 CO 0.00 0.36 -0.16 -0.69 -2.21 0.00 0.00 174.62 171.92 1fqj s VAL 30 N -1.34 2.05 -0.36 5.08 1.01 0.64 -4.92 120.40 122.57 1fqj s VAL 30 Ca 0.36 -1.19 -0.21 0.00 0.00 0.00 0.00 61.98 60.95 1fqj s VAL 30 Cb -0.17 -1.99 0.00 0.00 0.00 0.00 0.00 36.38 34.22 1fqj s VAL 30 CO 0.20 0.31 0.64 -0.75 0.00 0.00 0.00 175.10 175.50 1fqj s LYS 31 N 1.24 3.68 -0.11 2.72 2.20 -1.26 -0.76 119.74 127.45 1fqj s LYS 31 Ca -0.00 0.06 0.02 0.00 -0.36 0.00 0.00 55.97 55.68 1fqj s LYS 31 Cb -0.16 -3.81 -0.01 0.00 -1.51 0.00 0.00 37.83 32.34 1fqj s LYS 31 CO -0.10 -0.74 -0.18 -1.17 -0.36 0.00 0.00 175.35 172.80 1fqj s LEU 32 N 2.72 2.43 -0.12 5.43 0.20 -0.23 -0.97 118.68 128.15 1fqj s LEU 32 Ca 0.25 -0.42 -0.02 0.00 0.69 0.00 0.00 54.13 54.63 1fqj s LEU 32 Cb -0.14 -1.51 -0.03 0.00 -0.43 0.00 0.00 46.19 44.07 1fqj s LEU 32 CO 0.15 0.18 -0.04 -0.76 -0.29 0.00 0.00 176.35 175.59 1fqj s LEU 33 N 0.23 3.25 -0.42 -0.68 1.43 -0.42 -0.73 118.68 121.35 1fqj s LEU 33 Ca -0.12 -0.07 -0.13 0.00 -1.03 0.00 0.00 54.13 52.78 1fqj s LEU 33 Cb -0.16 -1.76 0.05 0.00 0.03 0.00 0.00 46.19 44.35 1fqj s LEU 33 CO 0.06 0.25 0.29 -0.76 0.23 0.00 0.00 176.35 176.43 1fqj s LEU 34 N -0.13 5.16 0.27 1.79 1.43 -0.50 -0.82 118.68 125.89 1fqj s LEU 34 Ca 0.02 -1.17 0.11 0.00 -1.03 0.00 0.00 54.13 52.07 1fqj s LEU 34 Cb -0.13 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 43.95 1fqj s LEU 34 CO 0.03 -0.51 -0.12 -0.76 0.23 0.00 0.00 176.35 175.21 1fqj s LEU 35 N 1.58 2.83 0.00 1.79 1.43 -0.58 -3.83 118.68 121.90 1fqj s LEU 35 Ca 0.03 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.26 1fqj s LEU 35 Cb -0.21 -1.34 0.00 0.00 0.03 0.00 0.00 46.19 44.67 1fqj s LEU 35 CO 0.07 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.28 1fqj n GLY 36 N -0.72 2.89 3.63 -3.19 0.00 -1.26 -0.96 105.19 105.58 1fqj n GLY 36 Ca -0.06 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.59 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 0.70 0.54 4.61 0.00 -1.26 -4.26 121.76 120.09 1fqj s ALA 37 Ca 0.00 -0.54 -0.22 0.00 0.00 0.00 0.00 51.96 51.20 1fqj s ALA 37 Cb 0.00 -3.05 -0.06 0.00 0.00 0.00 0.00 23.12 20.01 1fqj s ALA 37 CO 0.00 -3.17 1.25 0.41 0.00 0.00 0.00 175.76 174.26 1fqj n GLY 38 N -0.91 0.48 3.25 0.00 0.00 -1.17 -2.98 105.19 103.86 1fqj n GLY 38 Ca 0.07 0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.84 -4.14 0.03 1.61 1.02 -1.26 -4.88 120.64 112.18 1fqj n GLU 39 Ca 0.11 0.66 0.12 0.00 -0.02 0.00 0.00 57.16 58.02 1fqj n GLU 39 Cb 0.44 -5.44 0.16 0.00 -0.02 0.00 0.00 31.44 26.59 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 -2.41 0.62 0.00 1.62 3.41 -1.16 -4.87 113.62 110.82 1fqj n SER 40 Ca -0.05 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 1fqj n SER 40 Cb 0.57 0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.85 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 1.40 0.97 0.40 5.00 0.00 -1.26 -4.34 105.19 107.35 1fqj n GLY 41 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 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 0.43 -0.47 0.00 1.61 6.56 -1.92 -1.92 116.57 120.86 1fqj h LYS 42 Ca 0.00 0.03 -0.02 0.00 -1.06 0.00 0.00 60.65 59.60 1fqj h LYS 42 Cb 0.00 0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 31.76 1fqj h LYS 42 CO 0.00 -0.31 -0.11 0.77 -2.06 0.00 0.00 179.45 177.73 1fqj h SER 43 N -0.49 0.00 -0.18 0.86 0.02 -1.97 -1.23 113.55 110.56 1fqj h SER 43 Ca 0.08 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.88 1fqj h SER 43 Cb 0.62 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 1fqj h SER 43 CO -0.39 0.11 -0.42 0.74 -1.14 0.00 0.00 176.83 175.73 1fqj h THR 44 N 0.00 1.29 -0.74 -2.27 2.02 -1.73 -1.44 112.91 110.04 1fqj h THR 44 Ca -0.00 -1.60 -0.04 0.00 0.77 0.00 0.00 66.41 65.54 1fqj h THR 44 Cb 0.32 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 1fqj h THR 44 CO 0.01 0.52 0.30 0.40 0.37 0.00 0.00 175.52 177.12 1fqj h ILE 45 N 0.59 1.25 -0.48 3.11 1.08 -0.51 -2.04 117.51 120.51 1fqj h ILE 45 Ca 0.04 -0.76 -0.05 0.00 -0.39 0.00 0.00 64.86 63.70 1fqj h ILE 45 Cb 0.96 0.36 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 1fqj h ILE 45 CO 0.09 0.31 0.07 0.58 -0.69 0.00 0.00 178.15 178.51 1fqj h VAL 46 N 1.07 1.22 -0.61 1.67 2.07 -0.97 -1.97 116.25 118.73 1fqj h VAL 46 Ca 0.25 -0.84 -0.08 0.00 0.82 0.00 0.00 66.70 66.85 1fqj h VAL 46 Cb 0.19 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1fqj h VAL 46 CO -0.02 0.30 0.07 0.11 0.02 0.00 0.00 177.57 178.05 1fqj h LYS 47 N 0.71 1.01 -0.20 1.57 1.57 -0.66 -2.33 116.57 118.25 1fqj h LYS 47 Ca 0.15 -0.27 -0.06 0.00 -1.87 0.00 0.00 60.65 58.60 1fqj h LYS 47 Cb 0.33 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1fqj h LYS 47 CO 0.01 0.95 -0.15 1.96 -0.57 0.00 0.00 179.45 181.64 1fqj h GLN 48 N 0.94 0.33 -0.40 3.15 1.08 -0.79 -0.97 115.11 118.45 1fqj h GLN 48 Ca 0.19 -0.09 -0.10 0.00 -1.45 0.00 0.00 58.65 57.20 1fqj h GLN 48 Cb 0.45 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.82 1fqj h GLN 48 CO 0.02 0.48 -0.15 0.52 -0.95 0.00 0.00 178.83 178.75 1fqj h MET 49 N 0.31 0.73 -0.36 1.46 2.86 -0.94 0.31 114.93 119.29 1fqj h MET 49 Ca 0.06 -0.25 -0.03 0.00 -2.06 0.00 0.00 59.70 57.41 1fqj h MET 49 Cb 0.46 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1fqj h MET 49 CO 0.03 0.84 0.09 -0.22 1.06 0.00 0.00 176.91 178.71 1fqj h LYS 50 N 0.65 0.57 -0.40 1.72 3.64 -0.76 0.43 116.57 122.42 1fqj h LYS 50 Ca 0.11 -0.13 -0.15 0.00 -1.27 0.00 0.00 60.65 59.20 1fqj h LYS 50 Cb 0.62 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1fqj h LYS 50 CO 0.04 0.61 -0.35 0.82 -2.27 0.00 0.00 179.45 178.31 1fqj h ILE 51 N 0.43 1.27 0.00 2.00 2.04 -0.95 -0.47 117.51 121.84 1fqj h ILE 51 Ca 0.11 -1.52 -0.16 0.00 1.00 0.00 0.00 64.86 64.30 1fqj h ILE 51 Cb 0.29 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 1fqj h ILE 51 CO 0.00 0.51 -0.86 0.40 0.00 0.00 0.00 178.15 178.20 1fqj h ILE 52 N 0.76 1.20 -0.37 -0.67 2.04 -0.29 -3.41 117.51 116.77 1fqj h ILE 52 Ca 0.07 -2.24 0.00 0.00 1.00 0.00 0.00 64.86 63.69 1fqj h ILE 52 Cb 0.93 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 39.62 1fqj h ILE 52 CO 0.09 0.42 0.00 1.41 0.00 0.00 0.00 178.15 180.06 1fqj n HIS 53 N -4.48 0.50 -1.68 1.37 8.25 0.15 -5.01 115.22 114.32 1fqj n HIS 53 Ca -0.25 -0.43 0.00 0.00 -0.26 0.00 0.00 57.72 56.78 1fqj n HIS 53 Cb 0.62 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.71 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 0.76 2.02 0.19 -0.41 6.02 -0.97 -4.69 117.38 120.29 1fqj n GLN 54 Ca 0.13 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.26 1fqj n GLN 54 Cb 0.45 0.00 0.36 0.00 1.02 0.00 0.00 30.24 32.07 1fqj n GLN 54 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 177.06 176.43 1fqj h ASP 55 N 0.00 0.00 -2.40 1.08 2.03 -1.89 -3.46 116.42 111.78 1fqj h ASP 55 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1fqj h ASP 55 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1fqj h ASP 55 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.82 1fqj n GLY 56 N 0.86 -1.79 3.42 7.15 0.00 -0.22 -4.83 105.19 109.78 1fqj n GLY 56 Ca 0.04 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 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 2.99 0.80 1.61 1.51 -1.26 -4.84 117.35 118.17 1fqj s TYR 57 Ca 0.00 -0.56 -0.10 0.00 -1.01 0.00 0.00 57.07 55.40 1fqj s TYR 57 Cb 0.00 -2.03 0.10 0.00 -0.11 0.00 0.00 41.96 39.92 1fqj s TYR 57 CO 0.00 -0.26 1.15 -1.54 -1.11 0.00 0.00 175.55 173.78 1fqj s SER 58 N 0.90 4.27 0.08 2.29 1.04 -1.26 -4.84 113.70 116.18 1fqj s SER 58 Ca -0.00 0.48 -0.25 0.00 0.48 0.00 0.00 55.95 56.66 1fqj s SER 58 Cb -0.15 -0.91 -0.16 0.00 0.10 0.00 0.00 66.02 64.90 1fqj s SER 58 CO 0.01 -2.00 1.68 0.25 0.98 0.00 0.00 173.24 174.17 1fqj h LEU 59 N -1.01 -0.13 -1.84 2.42 7.12 -1.99 -0.31 115.31 119.57 1fqj h LEU 59 Ca -0.44 -0.03 -0.02 0.00 0.13 0.00 0.00 57.88 57.52 1fqj h LEU 59 Cb 1.30 0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 41.46 1fqj h LEU 59 CO 0.56 -0.06 -0.09 1.05 -0.13 0.00 0.00 178.44 179.77 1fqj h GLU 60 N -0.20 0.00 -0.22 1.25 4.11 -1.99 -0.58 114.58 116.96 1fqj h GLU 60 Ca -0.02 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.31 1fqj h GLU 60 Cb 0.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 1fqj h GLU 60 CO 0.03 0.09 -0.28 0.93 0.07 0.00 0.00 179.01 179.84 1fqj h GLU 61 N 0.00 0.57 -0.72 1.06 5.08 -1.77 -3.05 114.58 115.75 1fqj h GLU 61 Ca -0.00 -0.33 -0.07 0.00 -1.00 0.00 0.00 59.36 57.97 1fqj h GLU 61 Cb 0.16 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1fqj h GLU 61 CO 0.01 0.93 0.19 0.00 -1.00 0.00 0.00 179.01 179.14 1fqj h LEU 63 N 1.09 0.00 -2.01 0.00 3.38 -1.08 -0.32 115.31 116.36 1fqj h LEU 63 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1fqj h LEU 63 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1fqj h LEU 63 CO -0.00 0.00 0.00 -0.33 0.09 0.00 0.00 178.44 178.20 1fqj h GLU 64 N 0.00 0.00 -0.00 1.13 5.08 -1.32 -2.58 114.58 116.89 1fqj h GLU 64 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1fqj h GLU 64 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1fqj h GLU 64 CO -0.00 0.00 -0.20 1.19 -1.00 0.00 0.00 179.01 179.00 1fqj n PHE 65 N -3.05 0.00 -0.10 4.33 3.72 -0.13 -4.13 117.46 118.10 1fqj n PHE 65 Ca -0.01 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.33 1fqj n PHE 65 Cb 0.21 -0.33 0.01 0.00 -0.94 0.00 0.00 39.48 38.44 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 0.16 0.84 -0.46 4.37 2.04 -1.57 0.82 117.51 123.70 1fqj h ILE 66 Ca 0.00 -0.07 -0.05 0.00 1.00 0.00 0.00 64.86 65.74 1fqj h ILE 66 Cb 0.46 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1fqj h ILE 66 CO 0.00 0.04 0.07 0.00 0.00 0.00 0.00 178.15 178.25 1fqj h ALA 67 N 1.25 1.25 0.01 1.87 0.00 -1.76 0.02 119.26 121.89 1fqj h ALA 67 Ca 0.16 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1fqj h ALA 67 Cb 0.18 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1fqj h ALA 67 CO -0.21 0.51 -0.00 0.82 0.00 0.00 0.00 179.25 180.37 1fqj h ILE 68 N 0.69 1.18 -0.34 0.00 2.04 -1.57 -0.19 117.51 119.31 1fqj h ILE 68 Ca 0.15 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 1fqj h ILE 68 Cb 0.33 1.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 1fqj h ILE 68 CO 0.01 0.14 0.20 0.40 0.00 0.00 0.00 178.15 178.89 1fqj h ILE 69 N -0.24 1.13 -0.57 -0.67 2.04 -0.51 0.29 117.51 118.98 1fqj h ILE 69 Ca -0.00 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 1fqj h ILE 69 Cb 0.23 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1fqj h ILE 69 CO 0.00 0.13 0.26 1.88 0.00 0.00 0.00 178.15 180.42 1fqj h TYR 70 N 0.43 0.80 -0.41 1.37 0.05 -0.98 0.21 116.97 118.44 1fqj h TYR 70 Ca 0.12 -0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.79 1fqj h TYR 70 Cb 0.03 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 1fqj h TYR 70 CO -0.03 0.59 -0.09 0.78 -1.05 0.00 0.00 178.16 178.36 1fqj h GLY 71 N 0.91 0.85 0.95 3.88 0.00 -0.25 -1.82 103.07 107.58 1fqj h GLY 71 Ca 0.20 -0.69 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 1fqj h GLY 71 CO -0.02 0.63 0.18 3.43 0.00 0.00 0.00 176.54 180.76 1fqj h ASN 72 N 0.60 0.58 -0.11 0.19 -0.26 0.25 -1.80 115.58 115.04 1fqj h ASN 72 Ca 0.11 -0.15 0.01 0.00 -0.56 0.00 0.00 56.30 55.70 1fqj h ASN 72 Cb 0.61 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 37.71 1fqj h ASN 72 CO 0.04 0.58 0.05 0.74 -1.06 0.00 0.00 177.43 177.77 1fqj h THR 73 N 0.55 0.99 -0.28 2.81 2.02 -0.50 -0.61 112.91 117.89 1fqj h THR 73 Ca 0.14 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.26 1fqj h THR 73 Cb 0.17 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1fqj h THR 73 CO -0.01 0.02 0.08 0.25 0.37 0.00 0.00 175.52 176.23 1fqj h LEU 74 N 0.11 0.41 -0.83 2.58 5.85 -1.26 -2.34 115.31 119.83 1fqj h LEU 74 Ca 0.04 -0.21 0.06 0.00 0.84 0.00 0.00 57.88 58.61 1fqj h LEU 74 Cb 0.01 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.87 1fqj h LEU 74 CO -0.03 0.51 0.51 -0.61 -0.34 0.00 0.00 178.44 178.48 1fqj h GLN 75 N 0.29 0.91 0.34 1.25 4.15 -1.21 -1.26 115.11 119.58 1fqj h GLN 75 Ca 0.09 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 1fqj h GLN 75 Cb 0.25 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.74 1fqj h GLN 75 CO -0.00 0.61 -0.17 0.77 -1.93 0.00 0.00 178.83 178.10 1fqj h SER 76 N 0.94 -0.42 -0.53 -0.69 0.02 -0.78 -1.48 113.55 110.61 1fqj h SER 76 Ca 0.36 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.29 1fqj h SER 76 Cb 0.15 0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 1fqj h SER 76 CO -0.16 -0.29 0.21 -0.29 -1.14 0.00 0.00 176.83 175.15 1fqj h ILE 77 N -0.47 1.21 -0.79 3.27 6.09 -1.24 -2.20 117.51 123.37 1fqj h ILE 77 Ca -0.04 -0.69 -0.03 0.00 -1.37 0.00 0.00 64.86 62.72 1fqj h ILE 77 Cb 0.37 0.56 -0.04 0.00 0.47 0.00 0.00 36.82 38.18 1fqj h ILE 77 CO 0.06 0.27 0.37 -0.07 -3.07 0.00 0.00 178.15 175.71 1fqj h LEU 78 N 0.82 1.04 -0.67 2.19 3.38 -1.03 0.32 115.31 121.37 1fqj h LEU 78 Ca 0.19 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 1fqj h LEU 78 Cb 0.20 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1fqj h LEU 78 CO -0.01 0.89 0.09 0.00 0.09 0.00 0.00 178.44 179.50 1fqj h ALA 79 N 1.27 0.89 -0.34 1.53 0.00 -0.69 0.37 119.26 122.28 1fqj h ALA 79 Ca 0.27 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1fqj h ALA 79 Cb 0.13 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1fqj h ALA 79 CO -0.03 0.67 -0.03 0.82 0.00 0.00 0.00 179.25 180.68 1fqj h ILE 80 N 1.04 1.27 -0.65 0.00 2.04 -0.99 -0.37 117.51 119.84 1fqj h ILE 80 Ca 0.20 -1.04 0.01 0.00 1.00 0.00 0.00 64.86 65.03 1fqj h ILE 80 Cb 0.46 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 1fqj h ILE 80 CO 0.02 0.34 0.43 0.58 0.00 0.00 0.00 178.15 179.51 1fqj h VAL 81 N 0.43 1.14 -0.58 1.67 2.07 -0.67 -1.78 116.25 118.52 1fqj h VAL 81 Ca 0.09 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 1fqj h VAL 81 Cb 0.51 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 1fqj h VAL 81 CO 0.02 0.16 0.14 0.03 0.02 0.00 0.00 177.57 177.94 1fqj h ARG 82 N 0.86 0.90 0.00 1.57 3.08 -0.70 -2.11 114.38 117.98 1fqj h ARG 82 Ca 0.25 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1fqj h ARG 82 Cb -0.07 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.85 1fqj h ARG 82 CO -0.07 0.81 0.00 0.00 -1.07 0.00 0.00 179.97 179.64 1fqj h ALA 83 N 1.29 1.00 -0.66 0.04 0.00 -0.25 -2.51 119.26 118.18 1fqj h ALA 83 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1fqj h ALA 83 Cb 0.31 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1fqj h ALA 83 CO -0.00 0.00 0.42 0.52 0.00 0.00 0.00 179.25 180.19 1fqj h MET 84 N 0.00 0.81 -0.02 0.00 2.86 -0.67 0.28 114.93 118.19 1fqj h MET 84 Ca 0.00 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.50 1fqj h MET 84 Cb 0.33 -0.18 0.01 0.00 0.06 0.00 0.00 31.60 31.82 1fqj h MET 84 CO 0.00 0.54 -0.35 1.79 1.06 0.00 0.00 176.91 179.94 1fqj h THR 85 N 0.83 1.48 -0.88 2.22 1.35 -1.57 0.14 112.91 116.48 1fqj h THR 85 Ca 0.25 -1.91 0.11 0.00 -0.55 0.00 0.00 66.41 64.32 1fqj h THR 85 Cb -0.03 2.60 -0.08 0.00 -1.73 0.00 0.00 68.15 68.91 1fqj h THR 85 CO -0.08 0.54 0.51 0.74 -0.25 0.00 0.00 175.52 176.97 1fqj h THR 86 N -0.31 0.87 -0.20 6.82 2.02 -1.11 -1.75 112.91 119.25 1fqj h THR 86 Ca -0.04 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1fqj h THR 86 Cb 1.07 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1fqj h THR 86 CO 0.07 0.15 0.00 0.18 0.37 0.00 0.00 175.52 176.29 1fqj n LEU 87 N -4.74 3.05 -3.50 2.58 4.77 0.96 -4.98 117.00 115.15 1fqj n LEU 87 Ca 0.16 -1.18 -0.24 0.00 -0.03 0.00 0.00 56.01 54.72 1fqj n LEU 87 Cb 0.33 -0.12 0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1fqj n LEU 87 CO 0.26 0.59 -0.02 -3.20 -1.33 0.00 0.00 177.39 173.69 1fqj n ASN 88 N 1.29 -5.94 -4.51 -1.43 5.15 -0.63 -5.00 115.26 104.20 1fqj n ASN 88 Ca 0.17 -0.86 -0.33 0.00 -0.60 0.00 0.00 54.58 52.96 1fqj n ASN 88 Cb 0.58 -4.09 -0.12 0.00 -0.53 0.00 0.00 39.78 35.61 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 -3.40 3.53 0.17 -1.44 1.01 0.40 -5.03 121.20 116.45 1fqj s ILE 89 Ca 0.44 -0.52 -0.09 0.00 0.00 0.00 0.00 60.65 60.48 1fqj s ILE 89 Cb -0.12 -2.47 -0.07 0.00 0.01 0.00 0.00 42.46 39.82 1fqj s ILE 89 CO 0.81 0.56 0.48 -1.10 0.00 0.00 0.00 174.94 175.69 1fqj s GLN 90 N -0.30 3.77 0.66 2.79 -0.21 -1.26 -4.67 119.66 120.44 1fqj s GLN 90 Ca 0.04 0.19 -0.15 0.00 0.02 0.00 0.00 55.36 55.46 1fqj s GLN 90 Cb -0.13 -2.79 -0.00 0.00 1.00 0.00 0.00 33.01 31.09 1fqj s GLN 90 CO 0.02 0.41 1.11 0.71 -2.12 0.00 0.00 175.29 175.43 1fqj s TYR 91 N -1.67 2.64 0.18 0.91 2.02 -1.26 -4.28 117.35 115.89 1fqj s TYR 91 Ca 0.42 1.55 -0.07 0.00 -0.37 0.00 0.00 57.07 58.60 1fqj s TYR 91 Cb -0.12 -3.16 0.06 0.00 -0.40 0.00 0.00 41.96 38.34 1fqj s TYR 91 CO 0.21 -1.66 1.53 0.78 -1.57 0.00 0.00 175.55 174.85 1fqj h GLY 92 N 0.02 0.89 -5.65 0.71 0.00 -1.89 -3.43 103.07 93.72 1fqj h GLY 92 Ca -0.47 -0.88 -0.60 0.00 0.00 0.00 0.00 47.33 45.39 1fqj h GLY 92 CO 0.54 0.79 -0.85 -0.35 0.00 0.00 0.00 176.54 176.68 1fqj s ASP 93 N -6.83 2.49 0.57 0.19 -1.08 -1.26 -5.00 116.67 105.76 1fqj s ASP 93 Ca -0.10 -0.44 0.26 0.00 -0.52 0.00 0.00 52.55 51.75 1fqj s ASP 93 Cb 0.12 -1.14 1.68 0.00 -1.46 0.00 0.00 42.92 42.12 1fqj s ASP 93 CO 0.86 0.09 2.22 0.77 0.52 0.00 0.00 175.17 179.63 1fqj h SER 94 N 6.94 0.00 0.05 -0.34 4.64 -2.01 -1.54 113.55 121.29 1fqj h SER 94 Ca -0.26 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1fqj h SER 94 Cb 1.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1fqj h SER 94 CO 0.48 0.00 -0.00 0.00 -0.87 0.00 0.00 176.83 176.44 1fqj h ALA 95 N 1.98 1.01 0.00 5.18 0.00 -1.98 -0.43 119.26 125.02 1fqj h ALA 95 Ca 0.01 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1fqj h ALA 95 Cb 0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1fqj h ALA 95 CO -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 179.25 178.91 1fqj h ARG 96 N 0.00 0.00 -0.80 0.00 2.47 -1.71 -2.96 114.38 111.37 1fqj h ARG 96 Ca -0.00 0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.74 1fqj h ARG 96 Cb 0.02 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.30 1fqj h ARG 96 CO 0.00 0.34 0.53 1.96 0.56 0.00 0.00 179.97 183.36 1fqj h GLN 97 N 0.00 1.01 -0.23 0.04 4.20 -1.24 0.19 115.11 119.09 1fqj h GLN 97 Ca -0.00 -0.06 -0.20 0.00 0.06 0.00 0.00 58.65 58.44 1fqj h GLN 97 Cb 0.96 -0.23 0.01 0.00 0.30 0.00 0.00 27.48 28.52 1fqj h GLN 97 CO 0.04 0.66 -0.66 0.22 -0.67 0.00 0.00 178.83 178.43 1fqj h ASP 98 N 1.04 0.97 -0.90 1.46 3.58 -1.66 -2.52 116.42 118.39 1fqj h ASP 98 Ca 0.31 -0.58 -0.01 0.00 0.42 0.00 0.00 57.03 57.17 1fqj h ASP 98 Cb -0.03 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 40.69 1fqj h ASP 98 CO -0.08 1.38 0.53 0.44 -2.88 0.00 0.00 179.24 178.63 1fqj h ASP 99 N 0.61 1.09 -0.43 2.28 3.32 -1.21 -1.77 116.42 120.32 1fqj h ASP 99 Ca -0.02 -0.08 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 1fqj h ASP 99 Cb 1.28 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.53 1fqj h ASP 99 CO 0.14 0.85 0.19 0.00 -1.72 0.00 0.00 179.24 178.70 1fqj h ALA 100 N 1.29 0.56 -0.36 3.45 0.00 -0.59 -0.35 119.26 123.26 1fqj h ALA 100 Ca 0.32 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.13 1fqj h ALA 100 Cb -0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1fqj h ALA 100 CO -0.06 0.15 0.18 0.00 0.00 0.00 0.00 179.25 179.52 1fqj h ARG 101 N 0.55 0.37 -0.39 0.00 2.47 -1.09 -1.82 114.38 114.46 1fqj h ARG 101 Ca 0.15 -0.02 -0.08 0.00 -1.26 0.00 0.00 59.98 58.77 1fqj h ARG 101 Cb 0.16 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.38 1fqj h ARG 101 CO -0.01 0.24 -0.08 -0.22 0.56 0.00 0.00 179.97 180.46 1fqj h LYS 102 N 0.38 0.67 -0.47 0.04 3.64 -1.12 -2.19 116.57 117.51 1fqj h LYS 102 Ca 0.15 -0.20 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1fqj h LYS 102 Cb 0.06 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 1fqj h LYS 102 CO -0.10 0.74 0.20 1.25 -2.27 0.00 0.00 179.45 179.27 1fqj h LEU 103 N 0.62 0.64 -0.63 5.20 5.85 -0.56 -1.03 115.31 125.40 1fqj h LEU 103 Ca 0.11 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.69 1fqj h LEU 103 Cb 0.50 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1fqj h LEU 103 CO 0.03 0.62 0.41 0.24 -0.34 0.00 0.00 178.44 179.40 1fqj h MET 104 N 0.62 0.81 0.43 1.25 2.86 -1.09 0.12 114.93 119.92 1fqj h MET 104 Ca 0.16 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.73 1fqj h MET 104 Cb 0.17 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.65 1fqj h MET 104 CO -0.02 0.54 -0.22 1.25 1.06 0.00 0.00 176.91 179.52 1fqj h HIS 105 N 0.83 -0.56 -0.80 -0.22 -0.00 -1.12 -2.74 115.15 110.54 1fqj h HIS 105 Ca 0.23 -0.01 0.08 0.00 -0.00 0.00 0.00 60.37 60.67 1fqj h HIS 105 Cb -0.08 0.19 -0.05 0.00 -0.00 0.00 0.00 27.41 27.47 1fqj h HIS 105 CO -0.03 -0.35 0.52 0.52 -0.00 0.00 0.00 177.93 178.59 1fqj h MET 106 N -0.59 0.78 -0.40 5.26 2.07 -0.99 -1.34 114.93 119.71 1fqj h MET 106 Ca -0.06 -0.05 0.12 0.00 -2.07 0.00 0.00 59.70 57.64 1fqj h MET 106 Cb 0.46 -0.18 -0.02 0.00 -1.87 0.00 0.00 31.60 30.00 1fqj h MET 106 CO 0.09 0.52 0.38 0.00 1.07 0.00 0.00 176.91 178.96 1fqj h ALA 107 N 1.58 2.17 0.00 6.32 0.00 -0.66 0.12 119.26 128.80 1fqj h ALA 107 Ca 0.35 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 55.03 1fqj h ALA 107 Cb 0.33 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1fqj h ALA 107 CO -0.13 -0.59 -1.46 -0.44 0.00 0.00 0.00 179.25 176.63 1fqj h ASP 108 N 0.00 0.00 0.18 0.00 3.45 -1.22 -3.40 116.42 115.42 1fqj h ASP 108 Ca 0.19 0.00 -0.35 0.00 0.43 0.00 0.00 57.03 57.30 1fqj h ASP 108 Cb 0.95 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.67 1fqj h ASP 108 CO -0.00 0.80 -2.07 0.35 -1.57 0.00 0.00 179.24 176.75 1fqj n THR 109 N -3.02 1.64 -1.91 0.35 -2.24 -0.38 -4.96 114.28 103.76 1fqj n THR 109 Ca -0.11 -0.70 -0.36 0.00 -2.27 0.00 0.00 64.05 60.61 1fqj n THR 109 Cb 0.94 -1.35 0.04 0.00 -2.10 0.00 0.00 70.33 67.86 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 -2.55 2.61 0.16 2.28 -5.25 -0.11 -4.94 121.20 113.39 1fqj s ILE 110 Ca -0.19 0.36 -0.31 0.00 -0.99 0.00 0.00 60.65 59.52 1fqj s ILE 110 Cb 0.07 -3.09 -0.09 0.00 2.95 0.00 0.00 42.46 42.31 1fqj s ILE 110 CO 0.76 -0.10 1.42 -0.70 -1.79 0.00 0.00 174.94 174.53 1fqj s GLU 111 N -3.46 4.30 0.27 0.37 2.12 -1.26 -4.92 118.70 116.13 1fqj s GLU 111 Ca 0.76 2.16 -0.29 0.00 0.36 0.00 0.00 54.97 57.97 1fqj s GLU 111 Cb -0.30 -3.20 -0.14 0.00 0.26 0.00 0.00 34.13 30.76 1fqj s GLU 111 CO 0.35 -0.43 1.16 -1.91 -0.54 0.00 0.00 175.26 173.89 1fqj n GLU 112 N 3.46 1.61 -0.92 4.30 0.00 -1.26 -2.17 120.64 125.66 1fqj n GLU 112 Ca 0.10 0.57 0.00 0.00 0.00 0.00 0.00 57.16 57.83 1fqj n GLU 112 Cb 0.41 -2.05 0.00 0.00 0.00 0.00 0.00 31.44 29.80 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 1.40 0.54 3.57 8.31 0.00 -1.26 -5.05 105.19 112.70 1fqj n GLY 113 Ca 0.10 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 3.16 -0.48 2.61 -4.23 -0.92 -4.37 115.64 109.40 1fqj s THR 114 Ca 0.00 -1.81 0.04 0.00 -1.18 0.00 0.00 61.69 58.74 1fqj s THR 114 Cb 0.00 -2.60 0.17 0.00 1.34 0.00 0.00 72.50 71.41 1fqj s THR 114 CO 0.00 -0.21 0.38 -0.32 -0.54 0.00 0.00 174.62 173.93 1fqj s MET 115 N -3.10 1.28 0.63 3.99 1.75 -1.26 -4.91 119.30 117.68 1fqj s MET 115 Ca 0.27 -2.41 -0.19 0.00 -1.25 0.00 0.00 55.69 52.12 1fqj s MET 115 Cb -0.08 -1.90 -0.02 0.00 2.84 0.00 0.00 34.83 35.67 1fqj s MET 115 CO 0.16 -1.36 1.31 -2.14 -0.65 0.00 0.00 175.02 172.34 1fqj s PRO 116 N -0.30 2.65 0.24 4.11 0.02 -1.26 -4.72 135.00 135.74 1fqj s PRO 116 Ca 0.31 2.10 -0.06 0.00 0.02 0.00 0.00 61.00 63.37 1fqj s PRO 116 Cb 0.02 -1.92 0.44 0.00 0.02 0.00 0.00 34.50 33.06 1fqj s PRO 116 CO -0.19 -1.53 1.66 -0.22 -0.33 0.00 0.00 177.00 176.39 1fqj h LYS 117 N 0.71 0.17 -0.22 5.54 1.63 -1.99 0.45 116.57 122.86 1fqj h LYS 117 Ca -0.51 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.24 1fqj h LYS 117 Cb 1.33 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.91 1fqj h LYS 117 CO 0.54 0.11 -0.04 1.05 -3.45 0.00 0.00 179.45 177.66 1fqj h GLU 118 N 0.17 0.33 -0.02 1.90 4.11 -2.00 -1.41 114.58 117.67 1fqj h GLU 118 Ca 0.41 -0.06 -0.10 0.00 0.07 0.00 0.00 59.36 59.67 1fqj h GLU 118 Cb 0.71 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.92 1fqj h GLU 118 CO -0.58 0.39 -0.39 1.98 0.07 0.00 0.00 179.01 180.48 1fqj h MET 119 N 0.32 0.29 -0.08 1.06 4.05 -1.31 -3.00 114.93 116.26 1fqj h MET 119 Ca 0.07 -0.30 -0.06 0.00 -0.28 0.00 0.00 59.70 59.14 1fqj h MET 119 Cb 0.28 0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.15 1fqj h MET 119 CO 0.01 0.99 -0.21 0.66 0.23 0.00 0.00 176.91 178.58 1fqj h SER 120 N -0.28 0.12 -0.29 1.39 4.64 -1.08 -0.09 113.55 117.97 1fqj h SER 120 Ca -0.04 -0.03 -0.12 0.00 -0.47 0.00 0.00 61.79 61.12 1fqj h SER 120 Cb 1.11 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.15 1fqj h SER 120 CO 0.08 0.35 -0.26 0.44 -0.87 0.00 0.00 176.83 176.57 1fqj h ASP 121 N 0.12 0.81 -0.17 4.97 3.32 -1.32 -0.11 116.42 124.04 1fqj h ASP 121 Ca 0.02 -0.31 -0.06 0.00 0.02 0.00 0.00 57.03 56.71 1fqj h ASP 121 Cb 0.45 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 1fqj h ASP 121 CO 0.03 1.02 -0.11 0.40 -1.72 0.00 0.00 179.24 178.87 1fqj h ILE 122 N 0.68 1.32 -0.73 0.35 2.04 -1.24 -2.58 117.51 117.34 1fqj h ILE 122 Ca 0.09 -1.20 0.02 0.00 1.00 0.00 0.00 64.86 64.77 1fqj h ILE 122 Cb 0.78 1.74 -0.04 0.00 -0.74 0.00 0.00 36.82 38.56 1fqj h ILE 122 CO 0.06 0.36 0.48 0.40 0.00 0.00 0.00 178.15 179.45 1fqj h ILE 123 N 0.04 1.16 -0.49 -0.67 2.04 -0.89 -1.24 117.51 117.47 1fqj h ILE 123 Ca 0.03 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 1fqj h ILE 123 Cb 0.61 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 1fqj h ILE 123 CO 0.03 0.18 0.21 1.56 0.00 0.00 0.00 178.15 180.13 1fqj h GLN 124 N 0.96 0.68 -0.26 2.37 4.20 -0.95 -0.64 115.11 121.48 1fqj h GLN 124 Ca 0.28 -0.09 -0.19 0.00 0.06 0.00 0.00 58.65 58.71 1fqj h GLN 124 Cb -0.07 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.58 1fqj h GLN 124 CO -0.08 0.55 -0.57 0.00 -0.67 0.00 0.00 178.83 178.06 1fqj h ARG 125 N 0.68 0.81 -0.48 1.46 3.08 -0.99 -2.96 114.38 115.99 1fqj h ARG 125 Ca 0.17 -0.53 -0.06 0.00 0.07 0.00 0.00 59.98 59.63 1fqj h ARG 125 Cb 0.11 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1fqj h ARG 125 CO -0.02 1.16 0.08 -0.07 -1.07 0.00 0.00 179.97 180.05 1fqj h LEU 126 N 0.62 0.75 -1.38 3.04 3.38 -0.74 -2.83 115.31 118.15 1fqj h LEU 126 Ca 0.01 -0.26 0.08 0.00 0.09 0.00 0.00 57.88 57.80 1fqj h LEU 126 Cb 1.17 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.68 1fqj h LEU 126 CO 0.12 0.82 0.49 -0.25 0.09 0.00 0.00 178.44 179.71 1fqj h TRP 127 N 0.66 0.75 0.00 1.13 2.91 -1.11 -0.86 115.95 119.43 1fqj h TRP 127 Ca 0.14 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.18 1fqj h TRP 127 Cb 0.39 -0.25 0.00 0.00 -0.51 0.00 0.00 29.16 28.79 1fqj h TRP 127 CO 0.03 0.38 0.00 1.63 -1.03 0.00 0.00 178.44 179.45 1fqj n LYS 128 N -4.49 0.37 -2.44 2.65 5.02 -1.08 -4.59 118.16 113.61 1fqj n LYS 128 Ca 0.12 0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 56.01 1fqj n LYS 128 Cb 0.27 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.74 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 -2.61 7.16 0.47 4.39 2.15 -0.33 -4.93 116.67 122.97 1fqj s ASP 129 Ca 0.26 2.15 0.20 0.00 0.43 0.00 0.00 52.55 55.60 1fqj s ASP 129 Cb 0.19 -2.60 1.17 0.00 -0.30 0.00 0.00 42.92 41.38 1fqj s ASP 129 CO 0.45 -0.32 2.01 0.77 -0.17 0.00 0.00 175.17 177.90 1fqj h SER 130 N 5.34 0.00 -0.13 -0.34 4.64 -1.88 -1.39 113.55 119.79 1fqj h SER 130 Ca -0.44 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.78 1fqj h SER 130 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1fqj h SER 130 CO 0.74 0.18 -0.32 1.23 -0.87 0.00 0.00 176.83 177.79 1fqj h GLY 131 N 0.77 0.49 1.01 -0.77 0.00 -1.86 -1.54 103.07 101.18 1fqj h GLY 131 Ca -0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 47.33 46.72 1fqj h GLY 131 CO 0.02 0.55 0.46 -2.22 0.00 0.00 0.00 176.54 175.35 1fqj h ILE 132 N 0.05 1.21 -0.76 2.60 1.08 -1.72 -0.30 117.51 119.67 1fqj h ILE 132 Ca -0.00 -0.45 -0.02 0.00 -0.39 0.00 0.00 64.86 64.00 1fqj h ILE 132 Cb 0.93 0.16 -0.04 0.00 -3.07 0.00 0.00 36.82 34.81 1fqj h ILE 132 CO 0.07 0.22 0.40 1.56 -0.69 0.00 0.00 178.15 179.71 1fqj h GLN 133 N 1.02 1.06 -0.79 2.37 1.08 -1.22 0.36 115.11 118.99 1fqj h GLN 133 Ca 0.27 -0.13 -0.02 0.00 -1.45 0.00 0.00 58.65 57.32 1fqj h GLN 133 Cb -0.05 -0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 27.14 1fqj h GLN 133 CO -0.05 0.79 0.40 0.00 -0.95 0.00 0.00 178.83 179.03 1fqj h ALA 134 N 1.21 1.01 -0.33 3.87 0.00 -0.71 -0.76 119.26 123.55 1fqj h ALA 134 Ca 0.26 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1fqj h ALA 134 Cb 0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1fqj h ALA 134 CO -0.04 0.55 -0.05 0.00 0.00 0.00 0.00 179.25 179.72 1fqj h PHE 136 N 0.41 1.04 0.00 0.00 3.57 0.13 -0.43 116.94 121.65 1fqj h PHE 136 Ca 0.09 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1fqj h PHE 136 Cb 0.52 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.93 1fqj h PHE 136 CO 0.05 0.47 0.00 -0.25 -2.23 0.00 0.00 178.31 176.35 1fqj n ASP 137 N -4.63 0.68 -1.60 0.41 8.00 -0.33 -1.92 116.55 117.16 1fqj n ASP 137 Ca 0.15 0.69 0.02 0.00 0.71 0.00 0.00 54.79 56.36 1fqj n ASP 137 Cb 0.26 -0.83 0.31 0.00 -0.02 0.00 0.00 41.12 40.84 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 -2.28 3.68 0.00 -1.24 1.74 -0.18 -4.68 116.66 113.71 1fqj n ARG 138 Ca 0.01 -3.06 0.23 0.00 -0.77 0.00 0.00 57.85 54.27 1fqj n ARG 138 Cb 0.20 -2.10 0.69 0.00 -1.02 0.00 0.00 32.46 30.23 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 2.66 2.35 0.00 7.54 0.00 -1.32 0.14 119.26 130.63 1fqj h ALA 139 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1fqj h ALA 139 Cb 1.95 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.78 1fqj h ALA 139 CO 0.51 -0.91 0.00 -1.13 0.00 0.00 0.00 179.25 177.71 1fqj n SER 140 N -3.68 0.52 -0.16 0.00 3.41 -1.26 -1.98 113.62 110.46 1fqj n SER 140 Ca 0.12 0.65 0.14 0.00 -0.26 0.00 0.00 58.87 59.52 1fqj n SER 140 Cb 0.83 -0.75 0.51 0.00 -0.26 0.00 0.00 64.21 64.54 1fqj n SER 140 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1fqj n GLU 141 N -2.10 0.72 -0.79 4.33 1.02 0.50 -4.62 120.64 119.71 1fqj n GLU 141 Ca 0.01 -0.33 0.00 0.00 -0.02 0.00 0.00 57.16 56.83 1fqj n GLU 141 Cb 0.17 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 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 -0.85 -0.12 -3.66 -0.32 4.11 -0.84 -5.10 117.16 110.38 1fqj n TYR 142 Ca 0.13 0.00 -0.39 0.00 -0.00 0.00 0.00 57.90 57.64 1fqj n TYR 142 Cb 0.31 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.53 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 -0.36 3.15 -0.02 -3.48 -1.52 -1.26 -4.91 119.66 111.26 1fqj s GLN 143 Ca 0.00 -0.84 0.01 0.00 -1.95 0.00 0.00 55.36 52.57 1fqj s GLN 143 Cb 0.00 -3.58 0.02 0.00 -0.22 0.00 0.00 33.01 29.23 1fqj s GLN 143 CO 0.00 -0.50 -0.01 -1.17 -0.25 0.00 0.00 175.29 173.36 1fqj s LEU 144 N 1.58 1.40 0.43 2.90 2.96 -1.26 -4.93 118.68 121.75 1fqj s LEU 144 Ca 0.03 -0.04 -0.23 0.00 -0.22 0.00 0.00 54.13 53.67 1fqj s LEU 144 Cb -0.18 -0.23 -0.11 0.00 0.50 0.00 0.00 46.19 46.17 1fqj s LEU 144 CO 0.06 -0.06 0.76 0.59 -1.32 0.00 0.00 176.35 176.38 1fqj n ASN 145 N 3.83 0.09 -0.31 3.68 3.02 -1.26 -4.88 115.26 119.43 1fqj n ASN 145 Ca -0.23 0.96 -0.04 0.00 -0.03 0.00 0.00 54.58 55.24 1fqj n ASN 145 Cb 0.52 -1.23 0.08 0.00 -0.61 0.00 0.00 39.78 38.55 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 1.08 0.99 -0.32 6.41 3.32 -2.00 -2.86 116.42 123.05 1fqj h ASP 146 Ca -0.42 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1fqj h ASP 146 Cb 1.37 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1fqj h ASP 146 CO 0.54 0.74 0.00 -1.20 -1.72 0.00 0.00 179.24 177.60 1fqj n SER 147 N -4.47 2.37 -0.01 6.45 7.64 -1.26 -4.43 113.62 119.90 1fqj n SER 147 Ca 0.09 -2.16 -0.09 0.00 1.01 0.00 0.00 58.87 57.71 1fqj n SER 147 Cb 0.04 -0.37 -0.03 0.00 -1.01 0.00 0.00 64.21 62.84 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 3.37 -0.20 -0.44 -0.43 0.00 -1.87 -1.50 119.26 118.20 1fqj h ALA 148 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1fqj h ALA 148 Cb 0.74 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1fqj h ALA 148 CO 0.09 -0.69 0.24 0.78 0.00 0.00 0.00 179.25 179.67 1fqj h GLY 149 N -0.29 0.66 0.22 0.00 0.00 -1.84 -0.81 103.07 101.00 1fqj h GLY 149 Ca 0.11 -0.30 0.08 0.00 0.00 0.00 0.00 47.33 47.22 1fqj h GLY 149 CO -0.33 0.29 -0.09 -1.82 0.00 0.00 0.00 176.54 174.59 1fqj h TYR 150 N 0.58 -0.19 -0.01 5.60 3.20 -1.73 -0.15 116.97 124.27 1fqj h TYR 150 Ca 0.16 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 1fqj h TYR 150 Cb 0.05 0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1fqj h TYR 150 CO -0.02 -0.16 -0.12 1.88 -1.64 0.00 0.00 178.16 178.10 1fqj h TYR 151 N 0.01 0.14 -0.92 -3.82 0.05 -1.15 -3.31 116.97 107.96 1fqj h TYR 151 Ca 0.19 -0.07 -0.00 0.00 0.05 0.00 0.00 58.73 58.90 1fqj h TYR 151 Cb 0.29 -0.02 -0.04 0.00 1.01 0.00 0.00 36.73 37.97 1fqj h TYR 151 CO -0.34 0.83 0.56 -0.07 -1.05 0.00 0.00 178.16 178.08 1fqj h LEU 152 N -0.60 1.11 -1.41 3.88 3.38 -1.08 -2.12 115.31 118.46 1fqj h LEU 152 Ca -0.01 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1fqj h LEU 152 Cb 0.86 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1fqj h LEU 152 CO 0.02 0.85 0.00 0.77 0.09 0.00 0.00 178.44 180.17 1fqj h SER 153 N 1.27 0.00 -0.32 -0.43 4.64 -1.15 -2.94 113.55 114.63 1fqj h SER 153 Ca 0.33 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.40 1fqj h SER 153 Cb -0.06 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 61.75 1fqj h SER 153 CO -0.06 0.00 -0.83 0.47 -0.87 0.00 0.00 176.83 175.54 1fqj n ASP 154 N -2.60 2.54 -0.20 4.97 8.00 -0.89 -4.87 116.55 123.49 1fqj n ASP 154 Ca 0.00 -3.11 0.06 0.00 0.71 0.00 0.00 54.79 52.45 1fqj n ASP 154 Cb 0.19 -0.42 0.34 0.00 -0.02 0.00 0.00 41.12 41.21 1fqj n ASP 154 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1fqj h LEU 155 N 1.69 0.70 -0.80 0.64 5.85 -1.22 -2.51 115.31 119.66 1fqj h LEU 155 Ca 0.04 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1fqj h LEU 155 Cb 1.39 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.23 1fqj h LEU 155 CO 0.29 0.45 0.50 -0.08 -0.34 0.00 0.00 178.44 179.26 1fqj h GLU 156 N 0.79 0.93 -0.75 1.25 4.81 -1.89 -1.77 114.58 117.95 1fqj h GLU 156 Ca 0.33 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 1fqj h GLU 156 Cb 0.27 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1fqj h GLU 156 CO -0.11 0.62 0.24 -0.09 -0.73 0.00 0.00 179.01 178.94 1fqj h ARG 157 N 0.96 1.16 0.00 1.92 2.43 -1.86 -2.88 114.38 116.12 1fqj h ARG 157 Ca 0.33 -0.25 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 1fqj h ARG 157 Cb 0.06 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1fqj h ARG 157 CO -0.13 0.98 -0.28 -0.07 -1.51 0.00 0.00 179.97 178.96 1fqj h LEU 158 N 1.11 0.00 -3.55 3.80 3.38 -1.24 -2.96 115.31 115.85 1fqj h LEU 158 Ca 0.24 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.00 1fqj h LEU 158 Cb 0.30 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.93 1fqj h LEU 158 CO -0.01 0.28 0.16 1.33 0.09 0.00 0.00 178.44 180.29 1fqj n VAL 159 N -3.79 2.72 -3.23 1.22 0.24 -0.73 -4.86 118.33 109.89 1fqj n VAL 159 Ca -0.01 -2.11 -0.38 0.00 -2.04 0.00 0.00 64.34 59.79 1fqj n VAL 159 Cb 0.37 -0.34 -0.06 0.00 -1.47 0.00 0.00 33.84 32.34 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 -3.10 5.13 0.10 3.34 2.01 -1.12 -5.00 115.64 117.00 1fqj s THR 160 Ca 0.49 1.12 -0.36 0.00 0.31 0.00 0.00 61.69 63.26 1fqj s THR 160 Cb 0.42 -3.89 -0.17 0.00 0.01 0.00 0.00 72.50 68.86 1fqj s THR 160 CO 0.08 0.31 1.19 -2.65 -0.69 0.00 0.00 174.62 172.85 1fqj n PRO 161 N 3.63 0.86 -0.66 4.92 -0.02 -1.26 -1.15 135.00 141.32 1fqj n PRO 161 Ca -0.05 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1fqj n PRO 161 Cb 0.51 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 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 2.12 0.69 3.69 -1.23 0.00 -1.26 -5.01 105.19 104.19 1fqj n GLY 162 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 1fqj n GLY 162 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1fqj n TYR 163 N -2.58 2.47 -3.94 1.61 9.36 -0.30 -5.00 117.16 118.78 1fqj n TYR 163 Ca 0.00 0.15 -0.28 0.00 3.32 0.00 0.00 57.90 61.09 1fqj n TYR 163 Cb 0.00 -2.61 -0.17 0.00 -0.63 0.00 0.00 39.34 35.94 1fqj n TYR 163 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1fqj s VAL 164 N 1.26 1.23 0.12 2.97 1.01 -1.26 -5.03 120.40 120.70 1fqj s VAL 164 Ca 0.78 -0.46 -0.34 0.00 0.00 0.00 0.00 61.98 61.96 1fqj s VAL 164 Cb -0.61 -1.23 -0.14 0.00 0.00 0.00 0.00 36.38 34.40 1fqj s VAL 164 CO 0.36 0.36 1.60 -2.65 0.00 0.00 0.00 175.10 174.77 1fqj n PRO 165 N 4.87 2.06 -1.85 2.72 -0.02 -1.26 -4.98 135.00 136.54 1fqj n PRO 165 Ca -0.14 0.75 -0.29 0.00 -2.02 0.00 0.00 63.50 61.80 1fqj n PRO 165 Cb 0.50 -2.51 0.13 0.00 -0.02 0.00 0.00 33.50 31.59 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 1.30 1.99 0.28 3.45 -4.23 -1.26 -4.85 115.64 112.32 1fqj s THR 166 Ca 0.81 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 61.30 1fqj s THR 166 Cb -0.71 -2.96 0.21 0.00 1.34 0.00 0.00 72.50 70.38 1fqj s THR 166 CO 0.41 0.00 1.90 -0.33 -0.54 0.00 0.00 174.62 176.05 1fqj h GLU 167 N -1.31 1.00 -0.44 3.99 5.08 -1.99 -1.65 114.58 119.26 1fqj h GLU 167 Ca -0.46 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 57.67 1fqj h GLU 167 Cb 1.30 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 1fqj h GLU 167 CO 0.57 0.75 -0.18 0.37 -1.00 0.00 0.00 179.01 179.52 1fqj h GLN 168 N 1.00 0.86 -0.50 2.33 5.75 -1.93 -0.15 115.11 122.48 1fqj h GLN 168 Ca 0.25 -0.34 -0.02 0.00 -0.15 0.00 0.00 58.65 58.39 1fqj h GLN 168 Cb 0.06 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 1fqj h GLN 168 CO -0.04 0.97 0.21 -0.44 -2.65 0.00 0.00 178.83 176.89 1fqj h ASP 169 N 0.76 0.63 -0.07 -0.69 3.32 -1.75 -0.81 116.42 117.80 1fqj h ASP 169 Ca 0.11 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 57.00 1fqj h ASP 169 Cb 0.71 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1fqj h ASP 169 CO 0.05 0.56 -0.33 0.58 -1.72 0.00 0.00 179.24 178.39 1fqj h VAL 170 N 0.70 1.42 -0.50 -1.35 2.07 -0.87 -2.89 116.25 114.82 1fqj h VAL 170 Ca 0.17 -1.73 -0.00 0.00 0.82 0.00 0.00 66.70 65.96 1fqj h VAL 170 Cb 0.12 2.32 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1fqj h VAL 170 CO -0.02 0.50 0.31 -0.07 0.02 0.00 0.00 177.57 178.31 1fqj h LEU 171 N -0.14 0.59 -0.03 2.57 3.38 -0.82 -1.88 115.31 118.97 1fqj h LEU 171 Ca -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1fqj h LEU 171 Cb 0.98 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1fqj h LEU 171 CO 0.07 0.44 0.00 0.54 0.09 0.00 0.00 178.44 179.58 1fqj n ARG 172 N -4.44 0.09 -1.56 1.13 5.12 -0.33 -4.88 116.66 111.79 1fqj n ARG 172 Ca 0.04 0.11 -0.33 0.00 -1.93 0.00 0.00 57.85 55.74 1fqj n ARG 172 Cb 0.07 -1.61 0.07 0.00 -1.16 0.00 0.00 32.46 29.83 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 -3.51 4.67 -0.15 0.55 1.04 -0.71 -4.68 113.70 110.92 1fqj s SER 173 Ca 0.12 2.09 0.01 0.00 0.48 0.00 0.00 55.95 58.65 1fqj s SER 173 Cb 0.16 -2.56 0.02 0.00 0.10 0.00 0.00 66.02 63.74 1fqj s SER 173 CO 0.52 -1.93 -0.16 -0.60 0.98 0.00 0.00 173.24 172.05 1fqj s ARG 174 N -4.15 2.45 -0.05 4.02 6.06 -1.26 -5.04 118.95 120.98 1fqj s ARG 174 Ca 0.68 -0.62 -0.02 0.00 -2.50 0.00 0.00 55.73 53.27 1fqj s ARG 174 Cb -0.23 -2.17 0.03 0.00 0.06 0.00 0.00 34.95 32.65 1fqj s ARG 174 CO 0.45 -0.19 0.05 0.08 -2.50 0.00 0.00 175.30 173.19 1fqj s VAL 175 N 1.32 -0.00 0.08 7.11 1.01 -1.26 -4.92 120.40 123.75 1fqj s VAL 175 Ca 0.02 0.36 -0.31 0.00 0.00 0.00 0.00 61.98 62.05 1fqj s VAL 175 Cb -0.13 -0.24 -0.07 0.00 0.00 0.00 0.00 36.38 35.94 1fqj s VAL 175 CO -0.09 0.20 1.44 -0.75 0.00 0.00 0.00 175.10 175.89 1fqj s LYS 176 N 2.12 4.29 0.07 2.72 2.20 -1.26 -4.99 119.74 124.90 1fqj s LYS 176 Ca 0.05 2.10 -0.20 0.00 -0.36 0.00 0.00 55.97 57.56 1fqj s LYS 176 Cb -0.12 -3.36 -0.07 0.00 -1.51 0.00 0.00 37.83 32.77 1fqj s LYS 176 CO -0.03 -0.52 0.58 0.99 -0.36 0.00 0.00 175.35 176.00 1fqj s THR 177 N 1.61 4.73 -0.04 3.43 2.01 -1.26 -5.08 115.64 121.05 1fqj s THR 177 Ca 0.66 1.23 0.03 0.00 0.31 0.00 0.00 61.69 63.92 1fqj s THR 177 Cb -0.36 -3.91 0.01 0.00 0.01 0.00 0.00 72.50 68.25 1fqj s THR 177 CO 0.30 0.55 -0.11 0.28 -0.69 0.00 0.00 174.62 174.95 1fqj s THR 178 N -1.10 0.95 0.00 -0.82 -1.32 -1.26 -4.43 115.64 107.66 1fqj s THR 178 Ca 0.29 -0.43 0.00 0.00 -1.21 0.00 0.00 61.69 60.35 1fqj s THR 178 Cb -0.20 -0.85 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 1fqj s THR 178 CO 0.19 0.30 0.00 0.61 -2.21 0.00 0.00 174.62 173.51 1fqj n GLY 179 N 3.45 -1.80 3.11 6.08 0.00 -1.26 -4.89 105.19 109.88 1fqj n GLY 179 Ca -0.20 -1.87 -0.30 0.00 0.00 0.00 0.00 46.02 43.66 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 1.68 -0.09 -0.61 1.01 -1.26 -2.71 121.20 119.22 1fqj s ILE 180 Ca 0.00 -0.77 0.03 0.00 0.00 0.00 0.00 60.65 59.91 1fqj s ILE 180 Cb 0.00 -1.50 0.01 0.00 0.01 0.00 0.00 42.46 40.98 1fqj s ILE 180 CO 0.00 0.48 -0.18 -0.63 0.00 0.00 0.00 174.94 174.61 1fqj s ILE 181 N 0.78 1.62 -0.00 2.92 1.01 0.45 -4.96 121.20 123.01 1fqj s ILE 181 Ca -0.10 -0.74 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 1fqj s ILE 181 Cb -0.16 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 1fqj s ILE 181 CO 0.01 0.46 0.14 -0.70 0.00 0.00 0.00 174.94 174.85 1fqj s GLU 182 N 0.65 3.26 -0.01 2.79 2.12 -1.26 -0.25 118.70 126.00 1fqj s GLU 182 Ca -0.13 -0.41 -0.02 0.00 0.36 0.00 0.00 54.97 54.77 1fqj s GLU 182 Cb -0.16 -2.98 0.00 0.00 0.26 0.00 0.00 34.13 31.24 1fqj s GLU 182 CO 0.04 0.66 0.04 0.95 -0.54 0.00 0.00 175.26 176.41 1fqj s THR 183 N -1.28 0.03 0.04 -1.70 -4.23 -0.38 -4.99 115.64 103.13 1fqj s THR 183 Ca 0.26 -0.22 0.06 0.00 -1.18 0.00 0.00 61.69 60.61 1fqj s THR 183 Cb -0.12 -0.14 -0.02 0.00 1.34 0.00 0.00 72.50 73.55 1fqj s THR 183 CO 0.17 -0.12 -0.18 -1.10 -0.54 0.00 0.00 174.62 172.85 1fqj s GLN 184 N -0.36 1.18 0.07 3.99 -0.21 -1.26 -0.78 119.66 122.29 1fqj s GLN 184 Ca -0.04 -0.86 -0.26 0.00 0.02 0.00 0.00 55.36 54.22 1fqj s GLN 184 Cb -0.03 -1.26 0.08 0.00 1.00 0.00 0.00 33.01 32.81 1fqj s GLN 184 CO 0.00 0.32 0.71 -0.59 -2.12 0.00 0.00 175.29 173.61 1fqj s PHE 185 N -0.82 -0.49 0.03 0.91 -0.71 -1.00 -5.00 117.98 110.89 1fqj s PHE 185 Ca 0.05 0.42 0.02 0.00 -1.04 0.00 0.00 56.93 56.38 1fqj s PHE 185 Cb -0.08 0.53 -0.04 0.00 -1.21 0.00 0.00 43.02 42.22 1fqj s PHE 185 CO 0.02 -0.71 0.03 -1.12 -1.34 0.00 0.00 175.22 172.10 1fqj s SER 186 N -2.39 5.28 -0.28 1.98 0.01 -1.26 -0.05 113.70 116.99 1fqj s SER 186 Ca 0.00 -0.01 -0.20 0.00 1.31 0.00 0.00 55.95 57.05 1fqj s SER 186 Cb -0.01 -1.39 0.11 0.00 0.21 0.00 0.00 66.02 64.94 1fqj s SER 186 CO -0.08 0.24 0.87 0.12 0.41 0.00 0.00 173.24 174.80 1fqj s PHE 187 N -1.21 -0.72 -1.45 2.43 5.36 -0.12 -4.92 117.98 117.35 1fqj s PHE 187 Ca 0.23 1.55 -0.10 0.00 -0.96 0.00 0.00 56.93 57.66 1fqj s PHE 187 Cb -0.12 0.42 0.05 0.00 -0.34 0.00 0.00 43.02 43.03 1fqj s PHE 187 CO 0.15 -0.35 0.74 1.63 -1.46 0.00 0.00 175.22 175.92 1fqj n LYS 188 N 3.33 -4.87 -1.26 10.12 4.76 -1.26 -0.36 118.16 128.62 1fqj n LYS 188 Ca -0.17 0.66 -0.09 0.00 -2.87 0.00 0.00 58.31 55.85 1fqj n LYS 188 Cb 0.57 -5.50 -0.04 0.00 -1.84 0.00 0.00 35.03 28.22 1fqj n LYS 188 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1fqj n ASP 189 N -2.59 -4.82 -4.64 4.39 4.64 -1.26 -4.99 116.55 107.27 1fqj n ASP 189 Ca -0.02 0.22 -0.33 0.00 -1.38 0.00 0.00 54.79 53.28 1fqj n ASP 189 Cb 0.56 -3.11 -0.10 0.00 -1.04 0.00 0.00 41.12 37.44 1fqj n ASP 189 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 1fqj s LEU 190 N -2.02 3.39 -0.48 -2.67 1.43 0.51 -4.26 118.68 114.58 1fqj s LEU 190 Ca 0.00 -0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 52.93 1fqj s LEU 190 Cb 0.00 -1.87 0.08 0.00 0.03 0.00 0.00 46.19 44.43 1fqj s LEU 190 CO 0.00 0.32 0.43 0.20 0.23 0.00 0.00 176.35 177.52 1fqj s ASN 191 N -1.24 6.16 0.04 2.29 0.01 -1.10 -0.94 114.94 120.15 1fqj s ASN 191 Ca 0.16 -1.32 -0.24 0.00 -0.71 0.00 0.00 52.86 50.75 1fqj s ASN 191 Cb -0.11 -2.20 -0.05 0.00 0.41 0.00 0.00 41.25 39.30 1fqj s ASN 191 CO 0.06 -0.69 0.74 -0.36 -1.51 0.00 0.00 177.10 175.34 1fqj s PHE 192 N 1.74 3.73 -0.40 2.20 0.40 0.93 -0.26 117.98 126.31 1fqj s PHE 192 Ca 0.05 1.43 0.04 0.00 -0.60 0.00 0.00 56.93 57.84 1fqj s PHE 192 Cb -0.24 -2.78 0.11 0.00 0.51 0.00 0.00 43.02 40.62 1fqj s PHE 192 CO 0.07 0.29 0.13 1.03 0.70 0.00 0.00 175.22 177.44 1fqj s ARG 193 N -0.08 1.60 -0.21 0.44 0.52 0.06 -2.39 118.95 118.89 1fqj s ARG 193 Ca 0.37 -2.09 -0.12 0.00 -0.52 0.00 0.00 55.73 53.36 1fqj s ARG 193 Cb -0.20 -3.14 -0.05 0.00 0.52 0.00 0.00 34.95 32.08 1fqj s ARG 193 CO 0.22 -1.01 0.24 1.41 0.02 0.00 0.00 175.30 176.18 1fqj s MET 194 N 0.51 4.15 -0.20 3.54 1.75 0.04 -1.06 119.30 128.03 1fqj s MET 194 Ca 0.13 -0.07 -0.05 0.00 -1.25 0.00 0.00 55.69 54.44 1fqj s MET 194 Cb -0.22 -3.50 -0.03 0.00 2.84 0.00 0.00 34.83 33.93 1fqj s MET 194 CO -0.06 0.10 0.01 -0.06 -0.65 0.00 0.00 175.02 174.37 1fqj s PHE 195 N 0.92 3.07 -0.18 4.11 0.08 0.09 -1.24 117.98 124.82 1fqj s PHE 195 Ca 0.12 -0.38 -0.07 0.00 0.12 0.00 0.00 56.93 56.72 1fqj s PHE 195 Cb -0.13 -2.09 -0.04 0.00 -0.57 0.00 0.00 43.02 40.18 1fqj s PHE 195 CO 0.04 -0.20 0.06 0.34 -0.10 0.00 0.00 175.22 175.37 1fqj s ASP 196 N 0.96 5.61 0.29 1.36 2.15 0.65 -1.41 116.67 126.29 1fqj s ASP 196 Ca 0.02 0.08 0.09 0.00 0.43 0.00 0.00 52.55 53.17 1fqj s ASP 196 Cb -0.14 -1.96 -0.06 0.00 -0.30 0.00 0.00 42.92 40.46 1fqj s ASP 196 CO 0.02 0.18 -0.13 0.68 -0.17 0.00 0.00 175.17 175.75 1fqj s VAL 197 N 0.34 2.11 0.31 1.11 -7.23 -1.25 -0.41 120.40 115.37 1fqj s VAL 197 Ca 0.03 -2.25 -0.22 0.00 -1.81 0.00 0.00 61.98 57.73 1fqj s VAL 197 Cb -0.12 -2.41 -0.09 0.00 0.56 0.00 0.00 36.38 34.31 1fqj s VAL 197 CO 0.00 -0.34 0.85 -0.83 -0.31 0.00 0.00 175.10 174.47 1fqj s GLY 198 N -3.50 2.63 0.03 2.32 0.00 -1.10 -4.93 107.32 102.78 1fqj s GLY 198 Ca 0.30 0.34 0.22 0.00 0.00 0.00 0.00 44.72 45.58 1fqj s GLY 198 CO 0.14 0.71 0.85 0.61 0.00 0.00 0.00 173.10 175.40 1fqj n GLY 199 N 0.34 -1.13 3.70 0.20 0.00 -1.26 -4.46 105.19 102.58 1fqj n GLY 199 Ca 0.01 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.25 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 -3.27 1.64 0.28 1.61 1.11 -1.26 -3.03 119.66 116.74 1fqj s GLN 200 Ca 0.01 1.63 0.01 0.00 0.01 0.00 0.00 55.36 57.02 1fqj s GLN 200 Cb 0.14 -1.79 0.64 0.00 -1.01 0.00 0.00 33.01 31.00 1fqj s GLN 200 CO 0.84 -2.19 1.70 0.00 0.01 0.00 0.00 175.29 175.66 1fqj h ARG 201 N -1.06 0.38 0.00 2.91 3.08 -2.00 0.14 114.38 117.83 1fqj h ARG 201 Ca -0.45 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.53 1fqj h ARG 201 Cb 1.28 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 1fqj h ARG 201 CO 0.46 0.25 -0.21 0.66 -1.07 0.00 0.00 179.97 180.06 1fqj h SER 202 N 0.39 0.00 1.41 7.04 4.64 -1.98 -2.75 113.55 122.30 1fqj h SER 202 Ca 0.51 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.75 1fqj h SER 202 Cb 0.93 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1fqj h SER 202 CO -0.51 0.21 -0.40 -0.33 -0.87 0.00 0.00 176.83 174.93 1fqj h GLU 203 N 0.00 0.00 0.00 4.77 4.39 -1.26 -3.28 114.58 119.20 1fqj h GLU 203 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1fqj h GLU 203 Cb 0.44 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1fqj h GLU 203 CO 0.03 0.40 0.00 0.00 -1.16 0.00 0.00 179.01 178.28 1fqj h ARG 204 N 0.00 0.00 0.00 2.33 3.08 -1.24 -1.70 114.38 116.84 1fqj h ARG 204 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1fqj h ARG 204 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1fqj h ARG 204 CO 0.05 0.00 0.00 0.87 -1.07 0.00 0.00 179.97 179.82 1fqj h LYS 205 N 0.00 0.00 0.00 0.04 1.57 -1.71 -2.53 116.57 113.94 1fqj h LYS 205 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1fqj h LYS 205 Cb 0.28 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1fqj h LYS 205 CO 0.00 0.00 -1.34 1.63 -0.57 0.00 0.00 179.45 179.17 1fqj n LYS 206 N -2.89 0.62 -0.31 3.15 5.02 -0.64 -4.43 118.16 118.68 1fqj n LYS 206 Ca -0.01 0.03 0.17 0.00 -2.02 0.00 0.00 58.31 56.48 1fqj n LYS 206 Cb 0.19 -1.73 0.42 0.00 -0.02 0.00 0.00 35.03 33.89 1fqj n LYS 206 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 1fqj h TRP 207 N 0.00 0.81 -0.67 2.13 4.06 -1.53 -1.42 115.95 119.33 1fqj h TRP 207 Ca -0.02 0.03 0.17 0.00 2.06 0.00 0.00 58.89 61.13 1fqj h TRP 207 Cb 1.05 -0.24 -0.03 0.00 -1.00 0.00 0.00 29.16 28.94 1fqj h TRP 207 CO 0.00 0.17 0.47 0.97 -3.56 0.00 0.00 178.44 176.49 1fqj h ILE 208 N 0.57 0.72 0.00 1.49 6.09 -1.77 -2.05 117.51 122.56 1fqj h ILE 208 Ca 0.54 -0.05 0.00 0.00 -1.37 0.00 0.00 64.86 63.98 1fqj h ILE 208 Cb 1.11 0.56 0.00 0.00 0.47 0.00 0.00 36.82 38.96 1fqj h ILE 208 CO -0.29 0.03 0.00 1.41 -3.07 0.00 0.00 178.15 176.22 1fqj n HIS 209 N -4.40 0.72 -1.71 2.19 8.25 -0.54 -2.22 115.22 117.52 1fqj n HIS 209 Ca 0.13 0.37 0.06 0.00 -0.26 0.00 0.00 57.72 58.02 1fqj n HIS 209 Cb 0.64 -1.10 0.14 0.00 1.12 0.00 0.00 29.99 30.79 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 -0.76 0.00 -2.71 0.00 3.01 -0.94 -4.82 117.46 111.24 1fqj n PHE 211 Ca 0.14 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.20 1fqj n PHE 211 Cb 0.78 -0.30 -0.05 0.00 -0.01 0.00 0.00 39.48 39.89 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 -2.82 4.80 -1.55 -1.08 2.02 -1.26 -4.11 118.70 114.70 1fqj s GLU 212 Ca 0.18 1.52 -0.12 0.00 0.02 0.00 0.00 54.97 56.57 1fqj s GLU 212 Cb 0.19 -3.29 0.09 0.00 0.10 0.00 0.00 34.13 31.22 1fqj s GLU 212 CO 0.57 0.41 0.80 0.41 0.02 0.00 0.00 175.26 177.47 1fqj n GLY 213 N 1.64 -0.41 3.65 -1.39 0.00 -1.26 -4.92 105.19 102.50 1fqj n GLY 213 Ca -0.01 0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.44 4.63 0.02 1.61 1.01 -1.26 -4.61 120.40 118.35 1fqj s VAL 214 Ca 0.52 1.93 -0.19 0.00 0.00 0.00 0.00 61.98 64.24 1fqj s VAL 214 Cb -0.27 -4.34 -0.22 0.00 0.00 0.00 0.00 36.38 31.55 1fqj s VAL 214 CO 0.87 -0.27 1.14 0.74 0.00 0.00 0.00 175.10 177.58 1fqj h THR 215 N 5.54 1.40 -2.91 3.92 2.02 -1.41 -3.41 112.91 118.06 1fqj h THR 215 Ca -0.20 -2.01 -0.08 0.00 0.77 0.00 0.00 66.41 64.90 1fqj h THR 215 Cb 1.06 2.47 -0.17 0.00 -1.74 0.00 0.00 68.15 69.77 1fqj h THR 215 CO 0.99 0.59 -0.08 0.00 0.37 0.00 0.00 175.52 177.40 1fqj s ALA 216 N -3.35 -1.09 -0.07 6.16 0.00 -1.05 -2.17 121.76 120.18 1fqj s ALA 216 Ca -0.13 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.29 1fqj s ALA 216 Cb 0.04 0.29 0.01 0.00 0.00 0.00 0.00 23.12 23.47 1fqj s ALA 216 CO 0.83 -0.43 -0.14 0.42 0.00 0.00 0.00 175.76 176.43 1fqj s ILE 217 N -2.23 1.28 -0.28 0.00 1.01 0.45 -1.29 121.20 120.13 1fqj s ILE 217 Ca -0.07 -0.56 -0.07 0.00 0.00 0.00 0.00 60.65 59.96 1fqj s ILE 217 Cb -0.01 -1.15 -0.00 0.00 0.01 0.00 0.00 42.46 41.30 1fqj s ILE 217 CO -0.00 0.39 0.06 -0.63 0.00 0.00 0.00 174.94 174.76 1fqj s ILE 218 N 0.63 3.96 -0.31 2.92 1.01 0.00 -0.33 121.20 129.09 1fqj s ILE 218 Ca -0.15 -0.56 -0.11 0.00 0.00 0.00 0.00 60.65 59.83 1fqj s ILE 218 Cb -0.16 -2.98 -0.02 0.00 0.01 0.00 0.00 42.46 39.31 1fqj s ILE 218 CO 0.04 0.17 0.18 0.12 0.00 0.00 0.00 174.94 175.45 1fqj s PHE 219 N 1.52 3.19 -0.15 3.97 2.19 0.74 -1.52 117.98 127.92 1fqj s PHE 219 Ca 0.04 -0.33 -0.17 0.00 0.33 0.00 0.00 56.93 56.80 1fqj s PHE 219 Cb -0.16 -2.38 -0.04 0.00 -1.31 0.00 0.00 43.02 39.13 1fqj s PHE 219 CO 0.02 -0.36 0.45 0.00 1.83 0.00 0.00 175.22 177.15 1fqj s VAL 221 N 0.91 1.83 -0.45 0.00 1.01 0.25 -4.28 120.40 119.68 1fqj s VAL 221 Ca 0.23 -0.91 -0.24 0.00 0.00 0.00 0.00 61.98 61.07 1fqj s VAL 221 Cb -0.15 -1.58 0.03 0.00 0.00 0.00 0.00 36.38 34.68 1fqj s VAL 221 CO 0.09 0.51 0.84 0.00 0.00 0.00 0.00 175.10 176.54 1fqj s ALA 222 N 0.22 3.28 0.43 5.51 0.00 -1.26 0.97 121.76 130.90 1fqj s ALA 222 Ca -0.12 -0.90 0.12 0.00 0.00 0.00 0.00 51.96 51.06 1fqj s ALA 222 Cb -0.16 -3.53 0.99 0.00 0.00 0.00 0.00 23.12 20.42 1fqj s ALA 222 CO 0.06 -1.94 2.00 -0.07 0.00 0.00 0.00 175.76 175.80 1fqj h LEU 223 N 10.26 0.40 0.00 0.00 3.38 -1.14 -1.52 115.31 126.70 1fqj h LEU 223 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1fqj h LEU 223 Cb 1.08 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1fqj h LEU 223 CO 0.98 0.25 0.00 -1.54 0.09 0.00 0.00 178.44 178.22 1fqj n SER 224 N -4.47 0.00 -0.00 -0.43 3.41 -1.26 -3.43 113.62 107.43 1fqj n SER 224 Ca 0.08 -1.06 0.15 0.00 -0.26 0.00 0.00 58.87 57.78 1fqj n SER 224 Cb 0.30 0.00 0.73 0.00 -0.26 0.00 0.00 64.21 64.98 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 -0.89 0.02 0.30 4.04 10.43 -0.57 -4.19 116.55 125.69 1fqj n ASP 225 Ca 0.16 -0.05 0.19 0.00 2.57 0.00 0.00 54.79 57.66 1fqj n ASP 225 Cb 0.07 -0.31 0.99 0.00 1.84 0.00 0.00 41.12 43.72 1fqj n ASP 225 CO 0.00 0.00 0.00 0.10 -1.07 0.00 0.00 177.20 176.23 1fqj h TYR 226 N 0.02 0.00 -0.02 1.24 -0.00 -1.77 -2.02 116.97 114.42 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 0.33 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.06 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 -3.35 2.43 -4.75 0.10 5.75 -1.26 -3.95 116.55 111.52 1fqj n ASP 227 Ca -0.02 -2.97 -0.23 0.00 -0.01 0.00 0.00 54.79 51.57 1fqj n ASP 227 Cb 0.20 -0.39 -0.06 0.00 -1.03 0.00 0.00 41.12 39.84 1fqj n ASP 227 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1fqj s LEU 228 N -2.67 3.38 0.23 -2.12 1.43 -0.76 -4.80 118.68 113.38 1fqj s LEU 228 Ca 0.29 -0.62 0.11 0.00 -1.03 0.00 0.00 54.13 52.88 1fqj s LEU 228 Cb 0.25 -1.90 -0.05 0.00 0.03 0.00 0.00 46.19 44.53 1fqj s LEU 228 CO 0.03 -0.20 -0.15 0.68 0.23 0.00 0.00 176.35 176.94 1fqj s VAL 229 N -2.34 2.77 0.40 -1.59 -7.23 -1.26 -0.49 120.40 110.65 1fqj s VAL 229 Ca 0.36 -2.06 -0.26 0.00 -1.81 0.00 0.00 61.98 58.20 1fqj s VAL 229 Cb -0.05 -2.41 -0.09 0.00 0.56 0.00 0.00 36.38 34.39 1fqj s VAL 229 CO 0.23 -0.26 1.32 -0.76 -0.31 0.00 0.00 175.10 175.32 1fqj s LEU 230 N -3.17 4.24 0.40 1.32 1.43 0.02 -4.71 118.68 118.22 1fqj s LEU 230 Ca 0.27 2.69 0.17 0.00 -1.03 0.00 0.00 54.13 56.23 1fqj s LEU 230 Cb -0.07 -3.86 0.87 0.00 0.03 0.00 0.00 46.19 43.17 1fqj s LEU 230 CO 0.15 -0.82 1.86 0.00 0.23 0.00 0.00 176.35 177.76 1fqj h ALA 231 N 2.78 1.28 0.02 4.21 0.00 -1.99 -2.80 119.26 122.76 1fqj h ALA 231 Ca -0.50 -0.29 -0.22 0.00 0.00 0.00 0.00 54.91 53.91 1fqj h ALA 231 Cb 1.24 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1fqj h ALA 231 CO 0.63 0.40 -1.03 0.93 0.00 0.00 0.00 179.25 180.17 1fqj h GLU 232 N 0.00 0.05 -2.37 0.00 3.07 -1.98 -3.42 114.58 109.93 1fqj h GLU 232 Ca -0.00 -0.09 -0.48 0.00 -0.50 0.00 0.00 59.36 58.29 1fqj h GLU 232 Cb 0.64 0.03 -0.36 0.00 -0.84 0.00 0.00 28.75 28.22 1fqj h GLU 232 CO 0.04 1.03 -0.77 0.34 -1.40 0.00 0.00 179.01 178.26 1fqj s ASP 233 N -6.80 2.35 0.00 1.42 -1.08 -1.07 -5.01 116.67 106.48 1fqj s ASP 233 Ca -0.00 -1.72 0.00 0.00 -0.52 0.00 0.00 52.55 50.31 1fqj s ASP 233 Cb 0.10 0.01 0.00 0.00 -1.46 0.00 0.00 42.92 41.56 1fqj s ASP 233 CO 0.83 -0.32 0.78 -0.62 0.52 0.00 0.00 175.17 176.36 1fqj n GLU 234 N 4.41 0.00 0.02 4.34 -0.58 -1.13 -0.85 120.64 126.85 1fqj n GLU 234 Ca 0.08 0.30 0.11 0.00 -0.42 0.00 0.00 57.16 57.23 1fqj n GLU 234 Cb 0.41 -1.65 -0.07 0.00 -0.57 0.00 0.00 31.44 29.56 1fqj n GLU 234 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1fqj n GLU 235 N -1.28 0.44 -3.37 3.49 -0.58 -1.26 -4.79 120.64 113.29 1fqj n GLU 235 Ca 0.00 -0.06 -0.39 0.00 -0.42 0.00 0.00 57.16 56.29 1fqj n GLU 235 Cb 0.15 -1.59 -0.08 0.00 -0.57 0.00 0.00 31.44 29.35 1fqj n GLU 235 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 1fqj s MET 236 N -3.32 4.11 0.22 3.49 1.75 -0.03 -5.01 119.30 120.51 1fqj s MET 236 Ca -0.01 0.16 -0.31 0.00 -1.25 0.00 0.00 55.69 54.28 1fqj s MET 236 Cb 0.14 -3.59 -0.10 0.00 2.84 0.00 0.00 34.83 34.12 1fqj s MET 236 CO 0.85 -0.15 1.49 1.21 -0.65 0.00 0.00 175.02 177.77 1fqj s ASN 237 N 1.29 6.61 0.26 1.11 3.84 -1.26 -0.80 114.94 125.99 1fqj s ASN 237 Ca 0.18 2.67 -0.05 0.00 0.21 0.00 0.00 52.86 55.87 1fqj s ASN 237 Cb -0.15 -2.61 0.31 0.00 -0.55 0.00 0.00 41.25 38.24 1fqj s ASN 237 CO 0.09 -0.76 1.93 0.03 -2.79 0.00 0.00 177.10 175.60 1fqj h ARG 238 N 5.62 1.25 -0.13 0.43 3.08 -0.95 -2.61 114.38 121.08 1fqj h ARG 238 Ca -0.45 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 59.39 1fqj h ARG 238 Cb 1.21 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1fqj h ARG 238 CO 0.82 0.84 -0.46 1.98 -1.07 0.00 0.00 179.97 182.08 1fqj h MET 239 N 1.29 0.31 -0.85 0.04 4.05 -1.80 -1.87 114.93 116.09 1fqj h MET 239 Ca 0.35 -0.17 -0.03 0.00 -0.28 0.00 0.00 59.70 59.57 1fqj h MET 239 Cb -0.13 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.64 1fqj h MET 239 CO -0.07 0.72 0.41 0.45 0.23 0.00 0.00 176.91 178.64 1fqj h HIS 240 N 0.25 1.23 -0.26 1.39 3.86 -1.83 -0.67 115.15 119.13 1fqj h HIS 240 Ca 0.02 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1fqj h HIS 240 Cb 0.92 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 1fqj h HIS 240 CO 0.02 0.89 0.11 1.49 0.86 0.00 0.00 177.93 181.31 1fqj h GLU 241 N 1.22 0.38 -0.62 2.45 4.57 -1.14 -2.03 114.58 119.41 1fqj h GLU 241 Ca 0.29 -0.06 0.03 0.00 -1.18 0.00 0.00 59.36 58.44 1fqj h GLU 241 Cb 0.12 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.61 1fqj h GLU 241 CO -0.04 0.39 0.38 0.77 -1.18 0.00 0.00 179.01 179.33 1fqj h SER 242 N 0.27 0.62 -0.71 1.04 0.02 -0.98 -1.48 113.55 112.33 1fqj h SER 242 Ca 0.09 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.09 1fqj h SER 242 Cb 0.15 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 62.51 1fqj h SER 242 CO -0.01 0.43 0.42 0.24 -1.14 0.00 0.00 176.83 176.77 1fqj h MET 243 N 0.74 0.77 -0.75 3.45 2.86 -0.88 0.15 114.93 121.28 1fqj h MET 243 Ca 0.25 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.79 1fqj h MET 243 Cb 0.02 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.48 1fqj h MET 243 CO -0.10 0.51 0.26 0.87 1.06 0.00 0.00 176.91 179.51 1fqj h LYS 244 N 0.80 1.15 -0.26 1.72 1.57 -0.91 -0.25 116.57 120.40 1fqj h LYS 244 Ca 0.30 -0.23 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1fqj h LYS 244 Cb 0.12 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 1fqj h LYS 244 CO -0.15 0.96 0.02 -0.07 -0.57 0.00 0.00 179.45 179.64 1fqj h LEU 245 N 1.11 0.43 -0.80 2.94 3.38 -0.43 -1.63 115.31 120.31 1fqj h LEU 245 Ca 0.25 -0.29 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1fqj h LEU 245 Cb 0.27 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1fqj h LEU 245 CO -0.01 0.61 0.04 0.15 0.09 0.00 0.00 178.44 179.32 1fqj h PHE 246 N 0.23 1.01 -0.19 1.13 3.57 -0.56 -0.34 116.94 121.79 1fqj h PHE 246 Ca 0.08 -0.15 0.02 0.00 3.53 0.00 0.00 57.97 61.45 1fqj h PHE 246 Cb 0.38 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 1fqj h PHE 246 CO 0.03 0.89 0.06 0.22 -2.23 0.00 0.00 178.31 177.28 1fqj h ASP 247 N 0.88 0.06 -0.58 0.41 3.58 -0.94 0.18 116.42 120.01 1fqj h ASP 247 Ca 0.17 0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.56 1fqj h ASP 247 Cb 0.46 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.51 1fqj h ASP 247 CO 0.02 0.06 0.03 -1.28 -2.88 0.00 0.00 179.24 175.19 1fqj h SER 248 N 0.15 0.99 -0.12 2.28 0.87 -1.02 -3.02 113.55 113.68 1fqj h SER 248 Ca 0.08 -0.29 -0.10 0.00 -1.23 0.00 0.00 61.79 60.25 1fqj h SER 248 Cb 0.06 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.76 1fqj h SER 248 CO -0.09 1.04 -0.32 0.40 -0.53 0.00 0.00 176.83 177.33 1fqj h ILE 249 N 0.90 1.38 0.00 2.23 1.08 -0.71 -2.97 117.51 119.42 1fqj h ILE 249 Ca 0.17 -1.61 0.00 0.00 -0.39 0.00 0.00 64.86 63.02 1fqj h ILE 249 Cb 0.51 2.10 0.00 0.00 -3.07 0.00 0.00 36.82 36.36 1fqj h ILE 249 CO 0.02 0.48 0.00 0.00 -0.69 0.00 0.00 178.15 177.96 1fqj n ASN 251 N -2.65 3.04 -4.72 0.00 3.02 -1.14 -4.94 115.26 107.86 1fqj n ASN 251 Ca 0.03 -1.89 -0.42 0.00 -0.03 0.00 0.00 54.58 52.28 1fqj n ASN 251 Cb 0.38 -0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.32 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 -1.26 7.14 0.33 6.41 3.84 -1.12 -4.93 114.94 125.34 1fqj s ASN 252 Ca 0.30 2.06 0.08 0.00 0.21 0.00 0.00 52.86 55.51 1fqj s ASN 252 Cb 0.18 -2.59 0.80 0.00 -0.55 0.00 0.00 41.25 39.09 1fqj s ASN 252 CO 0.25 -0.38 1.80 0.50 -2.79 0.00 0.00 177.10 176.48 1fqj h LYS 253 N 6.11 0.69 0.00 0.43 1.63 -1.91 -1.82 116.57 121.70 1fqj h LYS 253 Ca -0.43 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.33 1fqj h LYS 253 Cb 1.21 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.69 1fqj h LYS 253 CO 0.78 0.45 0.00 -1.49 -3.45 0.00 0.00 179.45 175.74 1fqj h TRP 254 N 0.71 0.00 -0.20 1.91 6.55 -1.95 -2.86 115.95 120.10 1fqj h TRP 254 Ca 0.54 0.00 -0.08 0.00 0.95 0.00 0.00 58.89 60.30 1fqj h TRP 254 Cb 0.92 0.00 -0.05 0.00 -0.86 0.00 0.00 29.16 29.17 1fqj h TRP 254 CO -0.00 0.00 -0.15 1.19 -1.05 0.00 0.00 178.44 178.43 1fqj n PHE 255 N -2.57 0.65 -0.18 0.49 3.72 -0.68 -4.71 117.46 114.19 1fqj n PHE 255 Ca -0.01 -1.36 -0.03 0.00 -0.05 0.00 0.00 57.45 56.00 1fqj n PHE 255 Cb 0.08 -0.36 0.18 0.00 -0.94 0.00 0.00 39.48 38.44 1fqj n PHE 255 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1fqj h THR 256 N 0.99 1.23 -0.38 4.37 2.02 -1.62 -2.46 112.91 117.05 1fqj h THR 256 Ca 0.10 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.57 1fqj h THR 256 Cb 1.38 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 68.26 1fqj h THR 256 CO 0.21 0.29 0.00 0.47 0.37 0.00 0.00 175.52 176.86 1fqj n ASP 257 N -4.31 2.99 -4.81 4.18 9.92 -1.26 -4.93 116.55 118.34 1fqj n ASP 257 Ca 0.05 -1.93 -0.38 0.00 -0.53 0.00 0.00 54.79 52.00 1fqj n ASP 257 Cb 0.18 -0.25 -0.06 0.00 -0.64 0.00 0.00 41.12 40.35 1fqj n ASP 257 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1fqj s THR 258 N -1.50 5.01 -0.08 -3.53 2.01 -0.93 -4.98 115.64 111.64 1fqj s THR 258 Ca 0.37 0.93 -0.30 0.00 0.31 0.00 0.00 61.69 63.00 1fqj s THR 258 Cb 0.21 -3.76 -0.02 0.00 0.01 0.00 0.00 72.50 68.94 1fqj s THR 258 CO 0.29 0.53 1.02 -0.44 -0.69 0.00 0.00 174.62 175.33 1fqj s SER 259 N -0.76 7.26 -0.16 3.53 0.01 -0.92 -4.92 113.70 117.73 1fqj s SER 259 Ca 0.25 1.58 -0.01 0.00 1.31 0.00 0.00 55.95 59.08 1fqj s SER 259 Cb -0.17 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.49 1fqj s SER 259 CO 0.14 -0.42 -0.12 -0.63 0.41 0.00 0.00 173.24 172.62 1fqj s ILE 260 N 1.81 2.99 -0.10 1.44 1.01 -1.26 -0.41 121.20 126.67 1fqj s ILE 260 Ca 0.50 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.52 1fqj s ILE 260 Cb -0.19 -2.29 0.00 0.00 0.01 0.00 0.00 42.46 39.99 1fqj s ILE 260 CO 0.20 0.50 -0.22 -0.63 0.00 0.00 0.00 174.94 174.79 1fqj s ILE 261 N 0.83 1.92 -0.26 2.92 1.09 0.55 -3.15 121.20 125.09 1fqj s ILE 261 Ca -0.04 -0.93 -0.15 0.00 -1.10 0.00 0.00 60.65 58.44 1fqj s ILE 261 Cb -0.15 -1.67 -0.04 0.00 -1.06 0.00 0.00 42.46 39.54 1fqj s ILE 261 CO 0.00 0.53 0.36 -0.22 -0.10 0.00 0.00 174.94 175.51 1fqj s LEU 262 N 0.50 4.06 -0.43 2.97 2.96 1.00 -0.19 118.68 129.56 1fqj s LEU 262 Ca -0.16 0.31 -0.12 0.00 -0.22 0.00 0.00 54.13 53.94 1fqj s LEU 262 Cb -0.17 -2.42 0.06 0.00 0.50 0.00 0.00 46.19 44.16 1fqj s LEU 262 CO 0.06 -0.15 0.30 -0.36 -1.32 0.00 0.00 176.35 174.88 1fqj s PHE 263 N 1.87 3.28 -0.92 5.38 0.40 0.46 -1.07 117.98 127.37 1fqj s PHE 263 Ca 0.15 -1.12 -0.21 0.00 -0.60 0.00 0.00 56.93 55.15 1fqj s PHE 263 Cb -0.15 -2.89 0.08 0.00 0.51 0.00 0.00 43.02 40.57 1fqj s PHE 263 CO 0.09 -0.77 1.25 -0.51 0.70 0.00 0.00 175.22 175.99 1fqj s LEU 264 N 1.55 4.21 0.71 -0.37 1.43 0.29 -0.58 118.68 125.92 1fqj s LEU 264 Ca 0.03 -1.57 -0.09 0.00 -1.03 0.00 0.00 54.13 51.47 1fqj s LEU 264 Cb -0.22 -2.48 0.04 0.00 0.03 0.00 0.00 46.19 43.56 1fqj s LEU 264 CO 0.05 -1.34 1.06 0.21 0.23 0.00 0.00 176.35 176.56 1fqj s ASN 265 N 4.19 5.09 -1.22 2.29 2.47 0.27 -0.19 114.94 127.85 1fqj s ASN 265 Ca 0.37 0.81 -0.07 0.00 0.42 0.00 0.00 52.86 54.39 1fqj s ASN 265 Cb -0.04 -1.54 0.01 0.00 -1.45 0.00 0.00 41.25 38.23 1fqj s ASN 265 CO -0.06 -1.49 1.06 0.29 -3.72 0.00 0.00 177.10 173.18 1fqj n LYS 266 N -2.99 -7.13 0.25 0.43 5.02 -0.63 -0.64 118.16 112.47 1fqj n LYS 266 Ca 0.07 0.75 0.11 0.00 -2.02 0.00 0.00 58.31 57.23 1fqj n LYS 266 Cb 0.59 -5.57 0.66 0.00 -0.02 0.00 0.00 35.03 30.69 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 -2.39 0.00 -0.29 1.97 2.10 -1.51 -0.16 116.57 116.28 1fqj h LYS 267 Ca -0.52 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 57.96 1fqj h LYS 267 Cb 1.33 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.66 1fqj h LYS 267 CO 0.50 0.15 -0.49 0.38 -2.00 0.00 0.00 179.45 177.99 1fqj h ASP 268 N 0.00 0.94 -0.04 7.07 2.03 -1.91 0.31 116.42 124.82 1fqj h ASP 268 Ca -0.00 -0.52 -0.21 0.00 -0.73 0.00 0.00 57.03 55.57 1fqj h ASP 268 Cb 0.40 -0.27 0.00 0.00 -0.83 0.00 0.00 39.33 38.64 1fqj h ASP 268 CO 0.02 1.28 -0.74 -0.07 -1.03 0.00 0.00 179.24 178.70 1fqj h LEU 269 N 0.63 0.81 -0.52 0.15 3.38 -1.82 -3.11 115.31 114.83 1fqj h LEU 269 Ca 0.02 -0.52 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 1fqj h LEU 269 Cb 1.10 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1fqj h LEU 269 CO 0.11 1.30 0.24 0.15 0.09 0.00 0.00 178.44 180.33 1fqj h PHE 270 N 0.47 0.77 -0.88 1.13 3.57 -0.99 -0.42 116.94 120.60 1fqj h PHE 270 Ca -0.04 -0.04 0.15 0.00 3.53 0.00 0.00 57.97 61.56 1fqj h PHE 270 Cb 1.36 -0.24 -0.07 0.00 2.79 0.00 0.00 35.95 39.79 1fqj h PHE 270 CO 0.07 0.61 0.57 1.49 -2.23 0.00 0.00 178.31 178.83 1fqj h GLU 271 N 0.70 0.64 0.15 1.11 4.81 -0.89 -0.22 114.58 120.88 1fqj h GLU 271 Ca 0.18 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.17 1fqj h GLU 271 Cb 0.14 -0.15 0.02 0.00 0.63 0.00 0.00 28.75 29.40 1fqj h GLU 271 CO -0.02 0.43 -0.92 0.93 -0.73 0.00 0.00 179.01 178.70 1fqj h GLU 272 N 0.66 0.31 -0.51 1.92 4.39 -1.38 -3.36 114.58 116.61 1fqj h GLU 272 Ca 0.44 -0.53 -0.06 0.00 0.34 0.00 0.00 59.36 59.56 1fqj h GLU 272 Cb 0.74 0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.57 1fqj h GLU 272 CO -0.20 1.25 0.08 -0.22 -1.16 0.00 0.00 179.01 178.77 1fqj h LYS 273 N -0.33 0.81 0.00 2.33 3.64 -0.65 -2.84 116.57 119.53 1fqj h LYS 273 Ca -0.17 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1fqj h LYS 273 Cb 1.69 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.40 1fqj h LYS 273 CO 0.15 0.76 0.00 0.97 -2.27 0.00 0.00 179.45 179.06 1fqj h ILE 274 N 0.77 0.00 0.00 2.00 6.09 -1.19 -0.36 117.51 124.82 1fqj h ILE 274 Ca 0.16 -0.14 -0.12 0.00 -1.37 0.00 0.00 64.86 63.40 1fqj h ILE 274 Cb 0.34 0.90 -0.02 0.00 0.47 0.00 0.00 36.82 38.51 1fqj h ILE 274 CO 0.01 0.00 -0.57 0.11 -3.07 0.00 0.00 178.15 174.63 1fqj h LYS 275 N 0.00 0.00 0.00 2.19 1.57 -1.67 -3.37 116.57 115.29 1fqj h LYS 275 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fqj h LYS 275 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1fqj h LYS 275 CO 0.00 0.57 -0.83 1.63 -0.57 0.00 0.00 179.45 180.25 1fqj n LYS 276 N -3.68 1.64 -4.13 3.15 5.02 -0.62 -4.99 118.16 114.53 1fqj n LYS 276 Ca -0.01 -0.01 -0.33 0.00 -2.02 0.00 0.00 58.31 55.95 1fqj n LYS 276 Cb 0.61 -0.93 -0.16 0.00 -0.02 0.00 0.00 35.03 34.53 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 -1.94 3.07 0.28 4.39 0.15 -0.24 -5.11 113.70 114.30 1fqj s SER 277 Ca -0.00 -0.62 -0.29 0.00 0.70 0.00 0.00 55.95 55.73 1fqj s SER 277 Cb 0.01 -1.44 -0.10 0.00 -1.71 0.00 0.00 66.02 62.78 1fqj s SER 277 CO 0.07 -0.00 1.38 -2.84 1.20 0.00 0.00 173.24 173.05 1fqj s PRO 278 N 1.29 4.30 0.57 5.44 0.02 -1.26 -4.47 135.00 140.90 1fqj s PRO 278 Ca 0.04 2.27 0.35 0.00 0.02 0.00 0.00 61.00 63.68 1fqj s PRO 278 Cb -0.13 -3.09 1.69 0.00 0.02 0.00 0.00 34.50 32.98 1fqj s PRO 278 CO -0.12 -0.33 2.12 1.25 -0.33 0.00 0.00 177.00 179.59 1fqj h LEU 279 N 4.35 0.00 -1.41 -5.54 5.85 -1.93 -2.44 115.31 114.19 1fqj h LEU 279 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1fqj h LEU 279 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1fqj h LEU 279 CO 0.72 0.05 0.09 0.71 -0.34 0.00 0.00 178.44 179.67 1fqj h THR 280 N 0.00 0.00 0.00 1.05 1.35 -1.89 0.16 112.91 113.59 1fqj h THR 280 Ca -0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.82 1fqj h THR 280 Cb 0.32 0.47 -0.01 0.00 -1.73 0.00 0.00 68.15 67.20 1fqj h THR 280 CO 0.01 0.00 -0.17 0.40 -0.25 0.00 0.00 175.52 175.50 1fqj h ILE 281 N 0.00 0.96 0.00 6.82 2.04 -1.76 -3.04 117.51 122.53 1fqj h ILE 281 Ca 0.00 -0.63 -0.28 0.00 1.00 0.00 0.00 64.86 64.96 1fqj h ILE 281 Cb 0.19 1.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 1fqj h ILE 281 CO 0.00 0.17 -1.89 0.00 0.00 0.00 0.00 178.15 176.43 1fqj s TYR 283 N -2.62 3.48 0.56 0.00 1.51 -0.63 -4.96 117.35 114.69 1fqj s TYR 283 Ca -0.33 -2.51 0.32 0.00 -1.01 0.00 0.00 57.07 53.54 1fqj s TYR 283 Cb 0.10 -3.27 1.46 0.00 -0.11 0.00 0.00 41.96 40.15 1fqj s TYR 283 CO 0.44 -0.90 1.83 -1.35 -1.11 0.00 0.00 175.55 174.46 1fqj h PRO 284 N 7.53 0.00 0.00 -1.71 0.11 -1.80 -1.27 132.00 134.85 1fqj h PRO 284 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1fqj h PRO 284 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1fqj h PRO 284 CO 0.73 0.00 -0.58 0.93 -0.21 0.00 0.00 178.00 178.86 1fqj h GLU 285 N 0.00 0.00 -6.23 1.05 5.08 -1.93 -3.48 114.58 109.08 1fqj h GLU 285 Ca 0.39 0.00 -0.70 0.00 -1.00 0.00 0.00 59.36 58.05 1fqj h GLU 285 Cb 1.75 0.00 0.04 0.00 0.50 0.00 0.00 28.75 31.03 1fqj h GLU 285 CO -0.00 0.00 0.67 0.98 -1.00 0.00 0.00 179.01 179.65 1fqj n TYR 286 N -2.36 1.78 0.17 4.33 9.36 -0.48 -4.83 117.16 125.13 1fqj n TYR 286 Ca 0.03 0.56 0.02 0.00 3.32 0.00 0.00 57.90 61.83 1fqj n TYR 286 Cb 0.47 -2.40 0.02 0.00 -0.63 0.00 0.00 39.34 36.80 1fqj n TYR 286 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1fqj n ALA 287 N 3.85 2.49 -1.47 2.98 0.00 -1.26 -4.84 120.51 122.26 1fqj n ALA 287 Ca 0.22 -0.52 -0.18 0.00 0.00 0.00 0.00 53.44 52.96 1fqj n ALA 287 Cb 0.17 -0.14 0.19 0.00 0.00 0.00 0.00 19.45 19.67 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 0.27 -1.99 3.85 0.00 0.00 -1.26 -5.03 105.19 101.02 1fqj n GLY 288 Ca 0.02 -1.61 -0.32 0.00 0.00 0.00 0.00 46.02 44.11 1fqj n GLY 288 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fqj s SER 289 N -4.66 6.67 -1.27 1.61 1.04 -1.26 -4.95 113.70 110.87 1fqj s SER 289 Ca 0.63 1.41 -0.12 0.00 0.48 0.00 0.00 55.95 58.35 1fqj s SER 289 Cb -0.03 -2.44 0.15 0.00 0.10 0.00 0.00 66.02 63.79 1fqj s SER 289 CO 0.46 -0.43 1.72 0.59 0.98 0.00 0.00 173.24 176.55 1fqj n ASN 290 N -1.15 5.02 -4.25 7.02 5.03 -1.26 -3.99 115.26 121.67 1fqj n ASN 290 Ca 0.05 -3.01 -0.19 0.00 0.87 0.00 0.00 54.58 52.30 1fqj n ASN 290 Cb 0.54 -1.56 -0.11 0.00 -1.02 0.00 0.00 39.78 37.63 1fqj n ASN 290 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1fqj s THR 291 N 1.51 1.39 0.16 3.41 -4.23 -1.26 -4.60 115.64 112.02 1fqj s THR 291 Ca 0.43 -1.71 -0.24 0.00 -1.18 0.00 0.00 61.69 59.00 1fqj s THR 291 Cb 0.04 -1.54 0.04 0.00 1.34 0.00 0.00 72.50 72.39 1fqj s THR 291 CO 0.00 -0.38 1.59 0.22 -0.54 0.00 0.00 174.62 175.52 1fqj h TYR 292 N 3.56 -0.96 0.86 3.99 3.20 -1.90 0.56 116.97 126.28 1fqj h TYR 292 Ca -0.40 0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.48 1fqj h TYR 292 Cb 1.20 0.48 0.01 0.00 1.54 0.00 0.00 36.73 39.95 1fqj h TYR 292 CO 0.65 -0.39 -0.42 0.93 -1.64 0.00 0.00 178.16 177.29 1fqj h GLU 293 N -0.28 -1.12 0.12 1.82 5.08 -1.97 0.99 114.58 119.22 1fqj h GLU 293 Ca 0.16 0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 1fqj h GLU 293 Cb 0.55 0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1fqj h GLU 293 CO -0.53 -0.74 -0.06 1.49 -1.00 0.00 0.00 179.01 178.17 1fqj h GLU 294 N -1.22 -0.15 -0.62 2.33 4.81 -1.84 0.24 114.58 118.12 1fqj h GLU 294 Ca -0.12 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.04 1fqj h GLU 294 Cb 0.90 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 1fqj h GLU 294 CO 0.19 -0.01 0.06 0.00 -0.73 0.00 0.00 179.01 178.53 1fqj h ALA 295 N 0.61 0.83 -0.34 2.92 0.00 -0.98 -0.93 119.26 121.37 1fqj h ALA 295 Ca -0.02 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1fqj h ALA 295 Cb 0.21 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1fqj h ALA 295 CO 0.03 0.62 0.19 0.78 0.00 0.00 0.00 179.25 180.87 1fqj h GLY 296 N 0.96 0.50 1.24 0.00 0.00 -0.72 -1.53 103.07 103.51 1fqj h GLY 296 Ca 0.18 -0.22 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 1fqj h GLY 296 CO 0.02 0.21 0.11 3.43 0.00 0.00 0.00 176.54 180.31 1fqj h ASN 297 N 0.42 0.89 -0.17 0.19 2.35 -0.76 -1.53 115.58 116.98 1fqj h ASN 297 Ca 0.12 -0.19 0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1fqj h ASN 297 Cb 0.04 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 1fqj h ASN 297 CO -0.02 0.89 0.08 0.22 -1.65 0.00 0.00 177.43 176.94 1fqj h TYR 298 N 0.90 0.14 -0.60 1.19 3.20 -0.84 0.07 116.97 121.03 1fqj h TYR 298 Ca 0.19 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.08 1fqj h TYR 298 Cb 0.37 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.56 1fqj h TYR 298 CO 0.02 0.08 0.39 0.82 -1.64 0.00 0.00 178.16 177.83 1fqj h ILE 299 N 0.17 1.12 -0.51 1.81 2.04 -1.01 -0.85 117.51 120.29 1fqj h ILE 299 Ca 0.07 -0.27 0.04 0.00 1.00 0.00 0.00 64.86 65.70 1fqj h ILE 299 Cb 0.02 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.33 1fqj h ILE 299 CO -0.05 0.14 0.26 0.50 0.00 0.00 0.00 178.15 179.01 1fqj h LYS 300 N 0.78 0.50 -0.67 2.37 3.64 -0.75 -2.22 116.57 120.23 1fqj h LYS 300 Ca 0.23 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.56 1fqj h LYS 300 Cb -0.05 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 1fqj h LYS 300 CO -0.07 0.33 0.34 0.28 -2.27 0.00 0.00 179.45 178.07 1fqj h VAL 301 N 0.52 1.22 -0.39 2.00 2.07 -0.47 -0.08 116.25 121.11 1fqj h VAL 301 Ca 0.23 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 1fqj h VAL 301 Cb 0.13 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 1fqj h VAL 301 CO -0.15 0.24 0.22 1.56 0.02 0.00 0.00 177.57 179.46 1fqj h GLN 302 N 0.92 0.53 0.09 1.57 1.08 -0.63 -0.96 115.11 117.71 1fqj h GLN 302 Ca 0.23 -0.05 -0.13 0.00 -1.45 0.00 0.00 58.65 57.26 1fqj h GLN 302 Cb 0.08 -0.11 0.01 0.00 -0.05 0.00 0.00 27.48 27.41 1fqj h GLN 302 CO -0.03 0.39 -0.55 0.74 -0.95 0.00 0.00 178.83 178.43 1fqj h PHE 303 N 0.54 0.38 -0.24 2.96 0.04 -1.03 -3.35 116.94 116.24 1fqj h PHE 303 Ca 0.14 -0.27 -0.03 0.00 2.80 0.00 0.00 57.97 60.61 1fqj h PHE 303 Cb 0.01 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.13 1fqj h PHE 303 CO 0.00 1.20 0.01 -0.07 -0.60 0.00 0.00 178.31 178.85 1fqj h LEU 304 N -0.55 0.32 0.00 1.54 3.38 -0.79 -2.16 115.31 117.05 1fqj h LEU 304 Ca -0.09 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1fqj h LEU 304 Cb 1.42 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1fqj h LEU 304 CO 0.10 0.37 0.00 -0.62 0.09 0.00 0.00 178.44 178.38 1fqj n GLU 305 N -4.35 0.80 0.09 1.13 1.02 -0.38 -2.45 120.64 116.48 1fqj n GLU 305 Ca 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.28 1fqj n GLU 305 Cb 0.19 -1.48 0.43 0.00 -0.02 0.00 0.00 31.44 30.56 1fqj n GLU 305 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1fqj n LEU 306 N -0.98 0.68 -4.55 -4.62 4.77 -0.81 -4.58 117.00 106.91 1fqj n LEU 306 Ca 0.18 0.54 -0.40 0.00 -0.03 0.00 0.00 56.01 56.31 1fqj n LEU 306 Cb 0.08 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 40.80 1fqj n LEU 306 CO 0.14 -0.14 1.30 0.21 -1.33 0.00 0.00 177.39 177.57 1fqj s ASN 307 N -4.27 6.08 -0.12 -1.43 2.47 -1.03 -4.85 114.94 111.80 1fqj s ASN 307 Ca 0.11 -0.60 0.01 0.00 0.42 0.00 0.00 52.86 52.80 1fqj s ASN 307 Cb 0.13 -2.56 0.17 0.00 -1.45 0.00 0.00 41.25 37.55 1fqj s ASN 307 CO 0.59 -1.87 1.24 1.15 -3.72 0.00 0.00 177.10 174.49 1fqj n MET 308 N 9.22 1.32 -0.34 0.43 0.00 -1.26 -2.28 117.12 124.21 1fqj n MET 308 Ca 0.14 -0.78 0.00 0.00 0.00 0.00 0.00 57.70 57.06 1fqj n MET 308 Cb 0.50 -1.30 0.00 0.00 0.00 0.00 0.00 33.22 32.41 1fqj n MET 308 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 1fqj n ARG 309 N 0.07 0.00 -0.29 3.17 0.63 -1.26 -4.87 116.66 114.12 1fqj n ARG 309 Ca 0.15 -0.79 0.34 0.00 -0.92 0.00 0.00 57.85 56.63 1fqj n ARG 309 Cb 0.80 -0.47 0.73 0.00 0.45 0.00 0.00 32.46 33.97 1fqj n ARG 309 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1fqj h ARG 310 N 0.00 0.00 0.91 -0.14 2.43 -1.61 -0.16 114.38 115.81 1fqj h ARG 310 Ca 0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1fqj h ARG 310 Cb 1.26 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1fqj h ARG 310 CO 0.00 0.00 -0.44 -0.44 -1.51 0.00 0.00 179.97 177.58 1fqj h ASP 311 N 0.00 -1.03 0.00 -3.80 3.32 -1.89 -3.38 116.42 109.63 1fqj h ASP 311 Ca 0.53 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.62 1fqj h ASP 311 Cb 2.26 0.27 0.00 0.00 0.22 0.00 0.00 39.33 42.07 1fqj h ASP 311 CO -0.01 -0.71 0.00 0.52 -1.72 0.00 0.00 179.24 177.33 1fqj n VAL 312 N -5.46 0.00 -3.86 -1.35 0.31 -0.10 -4.81 118.33 103.06 1fqj n VAL 312 Ca -0.15 0.86 -0.37 0.00 -0.01 0.00 0.00 64.34 64.67 1fqj n VAL 312 Cb 0.48 -1.82 -0.06 0.00 -0.91 0.00 0.00 33.84 31.53 1fqj n VAL 312 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 1fqj s LYS 313 N -0.76 3.47 0.13 5.55 -2.85 -1.00 -5.10 119.74 119.18 1fqj s LYS 313 Ca 0.00 -0.10 -0.04 0.00 -1.00 0.00 0.00 55.97 54.83 1fqj s LYS 313 Cb 0.00 -3.19 -0.05 0.00 -2.06 0.00 0.00 37.83 32.52 1fqj s LYS 313 CO 0.00 0.77 0.35 -2.00 0.10 0.00 0.00 175.35 174.58 1fqj s GLU 314 N -1.03 3.59 -0.21 1.78 2.12 -1.26 -4.11 118.70 119.58 1fqj s GLU 314 Ca 0.16 -0.14 -0.06 0.00 0.36 0.00 0.00 54.97 55.29 1fqj s GLU 314 Cb -0.12 -2.88 -0.03 0.00 0.26 0.00 0.00 34.13 31.36 1fqj s GLU 314 CO 0.05 0.49 0.02 0.42 -0.54 0.00 0.00 175.26 175.69 1fqj s ILE 315 N -1.63 4.09 0.25 -3.70 -1.09 -1.26 -4.81 121.20 113.05 1fqj s ILE 315 Ca 0.40 -0.26 -0.19 0.00 -2.23 0.00 0.00 60.65 58.37 1fqj s ILE 315 Cb -0.12 -2.86 -0.08 0.00 -1.58 0.00 0.00 42.46 37.81 1fqj s ILE 315 CO 0.25 0.41 0.73 -0.31 -1.23 0.00 0.00 174.94 174.80 1fqj s TYR 316 N 1.08 3.57 0.07 3.97 1.51 -1.19 -4.92 117.35 121.44 1fqj s TYR 316 Ca 0.03 1.35 0.01 0.00 -1.01 0.00 0.00 57.07 57.45 1fqj s TYR 316 Cb -0.14 -2.60 -0.04 0.00 -0.11 0.00 0.00 41.96 39.07 1fqj s TYR 316 CO 0.02 0.27 -0.06 -1.54 -1.11 0.00 0.00 175.55 173.12 1fqj s SER 317 N -1.82 0.93 -0.11 2.29 1.04 -1.26 -0.00 113.70 114.77 1fqj s SER 317 Ca 0.46 -0.84 -0.10 0.00 0.48 0.00 0.00 55.95 55.95 1fqj s SER 317 Cb -0.15 0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.09 1fqj s SER 317 CO 0.20 -0.39 0.30 -1.00 0.98 0.00 0.00 173.24 173.33 1fqj s HIS 318 N -2.85 -0.33 -0.06 5.02 3.76 -0.23 -4.95 115.29 115.65 1fqj s HIS 318 Ca 0.03 0.81 -0.25 0.00 -0.15 0.00 0.00 55.06 55.50 1fqj s HIS 318 Cb 0.00 0.11 -0.03 0.00 1.11 0.00 0.00 32.58 33.77 1fqj s HIS 318 CO -0.04 -0.16 0.78 -1.64 -0.85 0.00 0.00 174.74 172.83 1fqj s MET 319 N 0.20 4.45 0.18 1.40 -1.94 -1.26 -0.55 119.30 121.78 1fqj s MET 319 Ca -0.00 1.02 0.02 0.00 -1.71 0.00 0.00 55.69 55.01 1fqj s MET 319 Cb -0.02 -3.47 -0.05 0.00 2.01 0.00 0.00 34.83 33.30 1fqj s MET 319 CO 0.00 -0.01 0.01 0.95 -0.01 0.00 0.00 175.02 175.96 1fqj s THR 320 N 1.01 0.68 -0.32 2.05 -4.23 0.73 -4.91 115.64 110.66 1fqj s THR 320 Ca 0.41 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.92 1fqj s THR 320 Cb -0.18 -2.15 0.11 0.00 1.34 0.00 0.00 72.50 71.61 1fqj s THR 320 CO 0.20 -0.45 0.12 0.00 -0.54 0.00 0.00 174.62 173.95 1fqj h ALA 322 N 7.97 1.30 -0.31 0.00 0.00 -1.96 -1.24 119.26 125.02 1fqj h ALA 322 Ca -0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1fqj h ALA 322 Cb 1.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1fqj h ALA 322 CO 0.45 0.03 0.00 0.25 0.00 0.00 0.00 179.25 179.98 1fqj n THR 323 N -3.55 0.41 -3.68 0.00 -2.24 -1.26 -4.67 114.28 99.29 1fqj n THR 323 Ca -0.03 -0.46 -0.39 0.00 -2.27 0.00 0.00 64.05 60.91 1fqj n THR 323 Cb 0.12 0.30 -0.11 0.00 -2.10 0.00 0.00 70.33 68.54 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 -1.19 5.45 0.26 3.42 -1.08 -0.47 -4.98 116.67 118.08 1fqj s ASP 324 Ca 0.28 -1.64 -0.02 0.00 -0.52 0.00 0.00 52.55 50.64 1fqj s ASP 324 Cb 0.15 -1.91 0.48 0.00 -1.46 0.00 0.00 42.92 40.17 1fqj s ASP 324 CO 0.20 -0.52 1.79 0.74 0.52 0.00 0.00 175.17 177.90 1fqj h THR 325 N 6.20 0.82 -0.38 1.71 2.02 -1.84 -1.31 112.91 120.13 1fqj h THR 325 Ca -0.20 -0.25 -0.12 0.00 0.77 0.00 0.00 66.41 66.61 1fqj h THR 325 Cb 1.07 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1fqj h THR 325 CO 0.72 0.13 -0.26 1.56 0.37 0.00 0.00 175.52 178.05 1fqj h GLN 326 N 0.72 0.79 -0.32 6.66 1.08 -1.94 -0.50 115.11 121.60 1fqj h GLN 326 Ca 0.44 -0.34 -0.06 0.00 -1.45 0.00 0.00 58.65 57.25 1fqj h GLN 326 Cb 0.52 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 1fqj h GLN 326 CO -0.31 0.96 -0.02 -0.97 -0.95 0.00 0.00 178.83 177.54 1fqj h ASN 327 N 0.68 0.56 -0.35 1.46 -0.00 -1.72 -2.11 115.58 114.11 1fqj h ASN 327 Ca 0.09 -0.32 -0.10 0.00 -0.00 0.00 0.00 56.30 55.96 1fqj h ASN 327 Cb 0.78 -0.15 -0.02 0.00 -0.00 0.00 0.00 38.32 38.93 1fqj h ASN 327 CO 0.06 0.75 -0.15 0.58 -0.00 0.00 0.00 177.43 178.68 1fqj h VAL 328 N 0.36 1.26 -0.35 2.57 2.07 -1.15 -0.62 116.25 120.40 1fqj h VAL 328 Ca 0.09 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.37 1fqj h VAL 328 Cb 0.48 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1fqj h VAL 328 CO 0.02 0.42 0.23 0.50 0.02 0.00 0.00 177.57 178.76 1fqj h LYS 329 N 0.72 0.46 -0.07 1.57 3.64 -1.00 0.68 116.57 122.56 1fqj h LYS 329 Ca 0.11 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 1fqj h LYS 329 Cb 0.65 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1fqj h LYS 329 CO 0.05 0.30 0.03 0.35 -2.27 0.00 0.00 179.45 177.91 1fqj h PHE 330 N 0.47 0.12 -0.57 1.91 3.57 -1.13 -2.24 116.94 119.06 1fqj h PHE 330 Ca 0.13 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.52 1fqj h PHE 330 Cb -0.05 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 1fqj h PHE 330 CO -0.05 0.25 -0.04 0.28 -2.23 0.00 0.00 178.31 176.52 1fqj h VAL 331 N -0.06 1.26 0.00 1.41 2.07 -0.97 -2.44 116.25 117.53 1fqj h VAL 331 Ca 0.02 -1.18 -0.04 0.00 0.82 0.00 0.00 66.70 66.32 1fqj h VAL 331 Cb 0.19 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1fqj h VAL 331 CO -0.00 0.42 -0.20 0.15 0.02 0.00 0.00 177.57 177.96 1fqj h PHE 332 N 0.93 0.00 -0.36 1.57 3.57 -0.83 -1.21 116.94 120.62 1fqj h PHE 332 Ca 0.16 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.56 1fqj h PHE 332 Cb 0.59 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 1fqj h PHE 332 CO 0.04 0.20 -0.17 0.22 -2.23 0.00 0.00 178.31 176.37 1fqj h ASP 333 N 0.00 0.77 0.64 0.41 3.58 -0.95 -1.97 116.42 118.91 1fqj h ASP 333 Ca -0.00 -0.41 -0.05 0.00 0.42 0.00 0.00 57.03 56.99 1fqj h ASP 333 Cb 0.42 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 1fqj h ASP 333 CO 0.03 1.00 -0.26 0.00 -2.88 0.00 0.00 179.24 177.13 1fqj h ALA 334 N 0.79 1.15 -0.10 -0.78 0.00 -0.97 -2.00 119.26 117.35 1fqj h ALA 334 Ca 0.08 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1fqj h ALA 334 Cb 0.71 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1fqj h ALA 334 CO 0.05 0.32 -0.46 0.28 0.00 0.00 0.00 179.25 179.45 1fqj h VAL 335 N 0.00 1.38 -0.62 0.00 2.07 -1.03 -2.64 116.25 115.41 1fqj h VAL 335 Ca -0.00 -1.80 -0.02 0.00 0.82 0.00 0.00 66.70 65.70 1fqj h VAL 335 Cb 0.65 2.21 -0.03 0.00 -1.52 0.00 0.00 31.29 32.60 1fqj h VAL 335 CO 0.03 0.54 0.30 0.74 0.02 0.00 0.00 177.57 179.20 1fqj h THR 336 N 0.07 1.20 -0.16 2.57 2.02 -1.13 -1.35 112.91 116.14 1fqj h THR 336 Ca -0.03 -0.56 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 1fqj h THR 336 Cb 1.10 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 1fqj h THR 336 CO 0.10 0.24 0.09 0.44 0.37 0.00 0.00 175.52 176.75 1fqj h ASP 337 N 0.87 0.19 -0.10 4.18 3.32 -1.31 0.47 116.42 124.05 1fqj h ASP 337 Ca 0.22 -0.07 0.04 0.00 0.02 0.00 0.00 57.03 57.24 1fqj h ASP 337 Cb 0.09 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 39.54 1fqj h ASP 337 CO -0.03 0.20 -0.20 0.40 -1.72 0.00 0.00 179.24 177.89 1fqj h ILE 338 N 0.17 0.50 -0.94 0.35 2.04 -1.04 0.62 117.51 119.21 1fqj h ILE 338 Ca 0.06 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.00 1fqj h ILE 338 Cb 0.05 0.50 -0.07 0.00 -0.74 0.00 0.00 36.82 36.55 1fqj h ILE 338 CO -0.01 0.00 0.59 0.40 0.00 0.00 0.00 178.15 179.13 1fqj h ILE 339 N -0.28 0.99 0.05 -0.67 2.04 -1.02 0.65 117.51 119.27 1fqj h ILE 339 Ca 0.09 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.60 1fqj h ILE 339 Cb 0.41 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.39 1fqj h ILE 339 CO -0.26 0.18 -0.02 0.40 0.00 0.00 0.00 178.15 178.45 1fqj h ILE 340 N 1.01 1.16 -0.98 -0.67 2.04 0.30 -1.76 117.51 118.62 1fqj h ILE 340 Ca 0.43 -0.72 0.03 0.00 1.00 0.00 0.00 64.86 65.60 1fqj h ILE 340 Cb 0.30 1.63 -0.05 0.00 -0.74 0.00 0.00 36.82 37.96 1fqj h ILE 340 CO -0.21 0.18 0.64 0.50 0.00 0.00 0.00 178.15 179.26 1fqj h LYS 341 N -0.39 1.22 0.00 2.37 3.64 0.92 -2.49 116.57 121.85 1fqj h LYS 341 Ca -0.01 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.21 1fqj h LYS 341 Cb 0.35 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1fqj h LYS 341 CO 0.01 0.81 -0.41 1.49 -2.27 0.00 0.00 179.45 179.08 1fqj h GLU 342 N 1.26 0.00 -0.93 1.90 4.57 0.35 -2.63 114.58 119.11 1fqj h GLU 342 Ca 0.38 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.45 1fqj h GLU 342 Cb -0.04 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 28.48 1fqj h GLU 342 CO -0.11 0.41 0.14 0.09 -1.18 0.00 0.00 179.01 178.36 1fqj n ASN 343 N -3.71 3.07 0.00 1.04 5.03 -0.67 -5.07 115.26 114.95 1fqj n ASN 343 Ca -0.01 -2.49 0.00 0.00 0.87 0.00 0.00 54.58 52.95 1fqj n ASN 343 Cb 0.49 -0.60 0.00 0.00 -1.02 0.00 0.00 39.78 38.65 1fqj n ASN 343 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61