#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xtj n GLY 46 N 0.00 0.41 0.04 0.23 0.00 -1.21 -3.42 105.19 101.25 1xtj n GLY 46 Ca 0.00 -0.39 0.13 0.00 0.00 0.00 0.00 46.02 45.76 1xtj n GLY 46 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1xtj n PHE 47 N 0.38 0.38 -0.19 1.61 3.01 -1.26 -3.46 117.46 117.93 1xtj n PHE 47 Ca 0.14 0.11 -0.06 0.00 1.01 0.00 0.00 57.45 58.65 1xtj n PHE 47 Cb 0.31 -0.61 0.11 0.00 -0.01 0.00 0.00 39.48 39.27 1xtj n PHE 47 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1xtj h ARG 48 N 0.00 0.98 0.00 -1.08 3.08 -1.98 -1.39 114.38 113.99 1xtj h ARG 48 Ca 0.00 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.81 1xtj h ARG 48 Cb 0.61 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1xtj h ARG 48 CO 0.00 0.90 0.00 -0.25 -1.07 0.00 0.00 179.97 179.55 1xtj n ASP 49 N -4.23 0.00 -0.00 7.04 9.92 -1.22 0.77 116.55 128.82 1xtj n ASP 49 Ca 0.04 -0.39 0.06 0.00 -0.53 0.00 0.00 54.79 53.98 1xtj n ASP 49 Cb 0.27 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 40.65 1xtj n ASP 49 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1xtj n PHE 50 N -0.81 0.00 -3.38 1.24 0.99 -0.53 -5.05 117.46 109.93 1xtj n PHE 50 Ca 0.04 0.00 -0.17 0.00 -0.00 0.00 0.00 57.45 57.32 1xtj n PHE 50 Cb 0.02 -0.20 0.01 0.00 -1.00 0.00 0.00 39.48 38.31 1xtj n PHE 50 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1xtj n LEU 51 N -1.74 -4.42 -4.96 4.37 4.77 0.23 -4.98 117.00 110.26 1xtj n LEU 51 Ca -0.01 -0.32 -0.22 0.00 -0.03 0.00 0.00 56.01 55.43 1xtj n LEU 51 Cb 0.30 -2.41 -0.02 0.00 -2.33 0.00 0.00 43.42 38.96 1xtj n LEU 51 CO 0.27 -0.57 0.03 -0.76 -1.33 0.00 0.00 177.39 175.03 1xtj s LEU 52 N -3.85 4.22 0.36 2.23 1.43 -1.26 -5.04 118.68 116.77 1xtj s LEU 52 Ca 0.11 0.20 -0.26 0.00 -1.03 0.00 0.00 54.13 53.15 1xtj s LEU 52 Cb -0.02 -3.01 -0.12 0.00 0.03 0.00 0.00 46.19 43.07 1xtj s LEU 52 CO 0.83 -0.14 1.04 0.29 0.23 0.00 0.00 176.35 178.60 1xtj n LYS 53 N -1.53 1.46 -0.15 1.70 5.02 -1.26 -4.67 118.16 118.73 1xtj n LYS 53 Ca -0.08 0.52 0.07 0.00 -2.02 0.00 0.00 58.31 56.80 1xtj n LYS 53 Cb 0.57 -2.00 0.38 0.00 -0.02 0.00 0.00 35.03 33.96 1xtj n LYS 53 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1xtj h PRO 54 N 1.85 0.66 0.00 1.97 0.13 -1.99 0.15 132.00 134.77 1xtj h PRO 54 Ca -0.43 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1xtj h PRO 54 Cb 1.33 -0.15 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1xtj h PRO 54 CO 0.59 0.44 -0.01 0.93 -0.23 0.00 0.00 178.00 179.71 1xtj h GLU 55 N 0.68 0.00 0.00 0.86 3.07 -1.89 -2.18 114.58 115.12 1xtj h GLU 55 Ca 0.29 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.99 1xtj h GLU 55 Cb 0.26 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.15 1xtj h GLU 55 CO -0.09 0.01 -0.84 1.25 -1.40 0.00 0.00 179.01 177.94 1xtj h LEU 56 N 0.00 0.00 -2.00 1.33 5.85 -1.05 -3.31 115.31 116.13 1xtj h LEU 56 Ca -0.00 -0.67 0.15 0.00 0.84 0.00 0.00 57.88 58.19 1xtj h LEU 56 Cb 0.07 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1xtj h LEU 56 CO 0.00 1.33 0.37 -0.07 -0.34 0.00 0.00 178.44 179.73 1xtj h LEU 57 N -1.00 0.00 -0.09 2.25 3.38 -1.01 -0.79 115.31 118.05 1xtj h LEU 57 Ca -0.23 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 1xtj h LEU 57 Cb 1.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1xtj h LEU 57 CO -0.14 0.00 0.03 0.03 0.09 0.00 0.00 178.44 178.45 1xtj h ARG 58 N 0.00 0.15 -0.46 1.13 3.08 -1.53 -2.43 114.38 114.31 1xtj h ARG 58 Ca 0.24 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.31 1xtj h ARG 58 Cb 0.97 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.97 1xtj h ARG 58 CO -0.00 0.31 0.31 0.00 -1.07 0.00 0.00 179.97 179.52 1xtj h ALA 59 N 0.83 1.93 -0.01 0.04 0.00 -1.25 -1.82 119.26 118.98 1xtj h ALA 59 Ca 0.03 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1xtj h ALA 59 Cb 0.23 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1xtj h ALA 59 CO -0.00 -0.01 -0.20 0.82 0.00 0.00 0.00 179.25 179.86 1xtj h ILE 60 N 0.40 1.15 0.16 0.00 1.08 -0.93 -1.76 117.51 117.60 1xtj h ILE 60 Ca 0.20 -0.73 -0.30 0.00 -0.39 0.00 0.00 64.86 63.64 1xtj h ILE 60 Cb 0.29 1.37 0.01 0.00 -3.07 0.00 0.00 36.82 35.42 1xtj h ILE 60 CO -0.05 0.21 -1.42 0.58 -0.69 0.00 0.00 178.15 176.78 1xtj h VAL 61 N 0.02 1.30 0.00 1.67 2.07 -1.15 -2.55 116.25 117.61 1xtj h VAL 61 Ca 0.00 -2.86 -0.01 0.00 0.82 0.00 0.00 66.70 64.64 1xtj h VAL 61 Cb 0.37 2.89 -0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1xtj h VAL 61 CO 0.03 0.85 -0.07 0.44 0.02 0.00 0.00 177.57 178.84 1xtj h ASP 62 N 0.09 0.00 -0.02 0.57 3.45 -1.18 -1.46 116.42 117.87 1xtj h ASP 62 Ca -0.21 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.25 1xtj h ASP 62 Cb 2.04 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.81 1xtj h ASP 62 CO 0.20 0.07 0.00 0.00 -1.57 0.00 0.00 179.24 177.94 1xtj n GLY 64 N 1.13 0.51 3.69 0.00 0.00 -0.55 -4.99 105.19 104.98 1xtj n GLY 64 Ca 0.20 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1xtj n GLY 64 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xtj s PHE 65 N -1.90 3.54 -0.23 1.61 2.99 -0.96 -4.90 117.98 118.13 1xtj s PHE 65 Ca 0.00 1.49 -0.05 0.00 0.00 0.00 0.00 56.93 58.36 1xtj s PHE 65 Cb 0.00 -3.06 -0.12 0.00 0.00 0.00 0.00 43.02 39.84 1xtj s PHE 65 CO 0.00 -0.12 -0.25 0.39 -0.00 0.00 0.00 175.22 175.24 1xtj n GLU 66 N 4.55 0.52 -4.13 0.44 1.02 -1.26 -4.51 120.64 117.26 1xtj n GLU 66 Ca 0.05 0.17 -0.15 0.00 -0.02 0.00 0.00 57.16 57.22 1xtj n GLU 66 Cb 0.50 -1.38 -0.12 0.00 -0.02 0.00 0.00 31.44 30.42 1xtj n GLU 66 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1xtj s HIS 67 N -2.43 0.75 0.51 -0.32 3.76 -1.26 -3.29 115.29 113.01 1xtj s HIS 67 Ca -0.31 -0.39 -0.20 0.00 -0.15 0.00 0.00 55.06 54.01 1xtj s HIS 67 Cb 0.10 -0.45 -0.07 0.00 1.11 0.00 0.00 32.58 33.27 1xtj s HIS 67 CO 0.45 -0.04 1.10 -2.14 -0.85 0.00 0.00 174.74 173.27 1xtj s PRO 68 N -1.21 3.55 0.59 8.40 0.02 -1.26 -4.98 135.00 140.11 1xtj s PRO 68 Ca -0.05 1.55 -0.05 0.00 0.02 0.00 0.00 61.00 62.47 1xtj s PRO 68 Cb -0.08 -2.09 0.02 0.00 0.02 0.00 0.00 34.50 32.37 1xtj s PRO 68 CO 0.01 -0.67 0.89 -1.54 -0.33 0.00 0.00 177.00 175.36 1xtj s SER 69 N -1.78 5.49 0.26 2.53 1.04 -1.26 -4.86 113.70 115.11 1xtj s SER 69 Ca 0.70 0.61 -0.02 0.00 0.48 0.00 0.00 55.95 57.71 1xtj s SER 69 Cb -0.22 -1.57 0.53 0.00 0.10 0.00 0.00 66.02 64.86 1xtj s SER 69 CO 0.26 -1.11 1.71 -0.33 0.98 0.00 0.00 173.24 174.74 1xtj h GLU 70 N -0.18 0.37 0.00 4.02 4.39 -1.97 0.40 114.58 121.62 1xtj h GLU 70 Ca -0.45 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1xtj h GLU 70 Cb 1.27 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 1xtj h GLU 70 CO 0.60 0.25 0.00 -0.39 -1.16 0.00 0.00 179.01 178.31 1xtj h VAL 71 N 0.39 0.00 0.05 3.13 -1.51 -1.92 0.65 116.25 117.03 1xtj h VAL 71 Ca 0.45 -0.39 -0.24 0.00 -1.23 0.00 0.00 66.70 65.29 1xtj h VAL 71 Cb 0.76 1.29 -0.02 0.00 -2.13 0.00 0.00 31.29 31.20 1xtj h VAL 71 CO -0.47 0.00 -1.17 1.56 -1.23 0.00 0.00 177.57 176.27 1xtj h GLN 72 N 0.00 0.10 0.02 5.19 4.20 -0.52 -0.52 115.11 123.58 1xtj h GLN 72 Ca 0.00 -0.17 -0.22 0.00 0.06 0.00 0.00 58.65 58.32 1xtj h GLN 72 Cb 0.44 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 1xtj h GLN 72 CO 0.00 1.04 -1.04 0.45 -0.67 0.00 0.00 178.83 178.61 1xtj h HIS 73 N 0.03 0.08 0.11 2.96 3.86 -0.77 -2.82 115.15 118.60 1xtj h HIS 73 Ca -0.09 -0.06 -0.27 0.00 -1.16 0.00 0.00 60.37 58.80 1xtj h HIS 73 Cb 1.87 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 30.33 1xtj h HIS 73 CO 0.02 1.04 -1.28 0.93 0.86 0.00 0.00 177.93 179.51 1xtj h GLU 74 N 0.01 0.23 0.00 2.45 4.39 -0.90 -3.41 114.58 117.35 1xtj h GLU 74 Ca -0.03 -0.40 -0.05 0.00 0.34 0.00 0.00 59.36 59.23 1xtj h GLU 74 Cb 1.80 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 30.59 1xtj h GLU 74 CO 0.14 1.16 -1.40 0.00 -1.16 0.00 0.00 179.01 177.75 1xtj h ILE 76 N 0.00 1.23 -0.98 0.00 2.04 -1.64 -2.15 117.51 116.01 1xtj h ILE 76 Ca -0.07 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.06 1xtj h ILE 76 Cb 0.75 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 37.59 1xtj h ILE 76 CO 0.00 0.27 0.65 -0.65 0.00 0.00 0.00 178.15 178.42 1xtj h PRO 77 N 0.64 1.26 -0.17 2.37 0.11 -1.79 -2.39 132.00 132.03 1xtj h PRO 77 Ca 0.16 -0.08 -0.18 0.00 0.11 0.00 0.00 66.00 66.01 1xtj h PRO 77 Cb 0.26 -0.28 -0.00 0.00 0.11 0.00 0.00 31.00 31.09 1xtj h PRO 77 CO -0.01 0.83 -0.64 1.96 -0.21 0.00 0.00 178.00 179.93 1xtj h GLN 78 N 1.30 0.62 -0.72 1.05 7.50 -1.86 -3.12 115.11 119.87 1xtj h GLN 78 Ca 0.37 -0.44 -0.02 0.00 0.50 0.00 0.00 58.65 59.06 1xtj h GLN 78 Cb -0.09 0.07 -0.03 0.00 0.05 0.00 0.00 27.48 27.48 1xtj h GLN 78 CO -0.09 1.06 0.37 0.00 -1.50 0.00 0.00 178.83 178.67 1xtj h ALA 79 N 0.83 1.30 0.00 3.87 0.00 -1.11 -2.55 119.26 121.60 1xtj h ALA 79 Ca -0.01 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1xtj h ALA 79 Cb 1.23 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1xtj h ALA 79 CO 0.12 0.56 -0.47 0.82 0.00 0.00 0.00 179.25 180.29 1xtj h ILE 80 N 1.01 1.06 -0.01 0.00 2.04 -1.46 -2.87 117.51 117.29 1xtj h ILE 80 Ca 0.25 -1.77 0.00 0.00 1.00 0.00 0.00 64.86 64.34 1xtj h ILE 80 Cb 0.06 2.04 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 1xtj h ILE 80 CO -0.04 0.46 -0.01 -0.11 0.00 0.00 0.00 178.15 178.45 1xtj n LEU 81 N -3.59 0.56 0.00 1.44 7.94 -0.99 -4.86 117.00 117.51 1xtj n LEU 81 Ca -0.00 -0.18 0.00 0.00 -1.11 0.00 0.00 56.01 54.72 1xtj n LEU 81 Cb 0.56 -0.01 0.00 0.00 0.53 0.00 0.00 43.42 44.50 1xtj n LEU 81 CO 0.39 0.09 0.00 0.61 -1.11 0.00 0.00 177.39 177.37 1xtj n GLY 82 N 1.08 0.69 3.85 -3.96 0.00 -1.08 -5.07 105.19 100.70 1xtj n GLY 82 Ca 0.22 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 1xtj n GLY 82 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xtj s MET 83 N -0.64 3.49 0.07 1.61 -1.94 -1.05 -4.66 119.30 116.18 1xtj s MET 83 Ca 0.00 0.88 -0.28 0.00 -1.71 0.00 0.00 55.69 54.58 1xtj s MET 83 Cb 0.00 -2.07 -0.05 0.00 2.01 0.00 0.00 34.83 34.72 1xtj s MET 83 CO 0.00 -0.65 0.89 -0.51 -0.01 0.00 0.00 175.02 174.74 1xtj s ASP 84 N -3.75 7.37 0.04 3.03 1.01 -1.26 -4.63 116.67 118.49 1xtj s ASP 84 Ca 0.57 1.64 0.04 0.00 0.71 0.00 0.00 52.55 55.52 1xtj s ASP 84 Cb -0.12 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 1xtj s ASP 84 CO 0.48 -0.07 -0.12 -0.69 0.21 0.00 0.00 175.17 174.99 1xtj s VAL 85 N 0.13 0.93 -0.44 -1.27 1.01 -0.95 -2.20 120.40 117.61 1xtj s VAL 85 Ca 0.44 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.42 1xtj s VAL 85 Cb -0.22 -0.88 0.13 0.00 0.00 0.00 0.00 36.38 35.40 1xtj s VAL 85 CO 0.27 -0.13 0.21 -0.22 0.00 0.00 0.00 175.10 175.23 1xtj s LEU 86 N -1.30 3.34 -0.35 3.92 2.96 -0.37 -1.18 118.68 125.69 1xtj s LEU 86 Ca -0.02 -2.61 -0.15 0.00 -0.22 0.00 0.00 54.13 51.13 1xtj s LEU 86 Cb -0.08 -1.26 -0.01 0.00 0.50 0.00 0.00 46.19 45.34 1xtj s LEU 86 CO 0.01 -0.28 0.35 0.00 -1.32 0.00 0.00 176.35 175.11 1xtj s GLN 88 N 1.97 2.85 -0.25 0.00 -0.21 -0.57 -2.36 119.66 121.09 1xtj s GLN 88 Ca 0.11 -0.79 -0.27 0.00 0.02 0.00 0.00 55.36 54.43 1xtj s GLN 88 Cb -0.17 -2.36 0.14 0.00 1.00 0.00 0.00 33.01 31.61 1xtj s GLN 88 CO 0.12 0.36 1.10 0.00 -2.12 0.00 0.00 175.29 174.74 1xtj s ALA 89 N -0.07 -2.01 0.64 6.09 0.00 -0.48 -2.78 121.76 123.16 1xtj s ALA 89 Ca -0.05 1.77 -0.17 0.00 0.00 0.00 0.00 51.96 53.51 1xtj s ALA 89 Cb -0.14 -1.29 -0.09 0.00 0.00 0.00 0.00 23.12 21.59 1xtj s ALA 89 CO 0.04 -0.24 0.25 1.17 0.00 0.00 0.00 175.76 176.98 1xtj n LYS 90 N 1.63 0.26 -1.32 0.00 4.81 -1.26 -4.15 118.16 118.14 1xtj n LYS 90 Ca -0.11 0.11 -0.36 0.00 -0.87 0.00 0.00 58.31 57.08 1xtj n LYS 90 Cb 0.57 -1.50 0.07 0.00 0.02 0.00 0.00 35.03 34.19 1xtj n LYS 90 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1xtj n SER 91 N 1.00 -0.58 0.00 3.14 2.88 -1.26 -2.54 113.62 116.26 1xtj n SER 91 Ca 0.09 0.63 0.00 0.00 -1.33 0.00 0.00 58.87 58.26 1xtj n SER 91 Cb 0.49 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.67 1xtj n SER 91 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xtj n GLY 92 N 1.47 0.33 0.18 0.46 0.00 -1.26 -4.84 105.19 101.53 1xtj n GLY 92 Ca 0.11 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.27 1xtj n GLY 92 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1xtj h MET 93 N 0.96 0.00 0.00 1.61 4.05 -1.81 -3.46 114.93 116.27 1xtj h MET 93 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1xtj h MET 93 Cb 0.12 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.92 1xtj h MET 93 CO 0.00 0.00 0.00 0.41 0.23 0.00 0.00 176.91 177.55 1xtj n GLY 94 N -0.15 1.69 0.11 1.39 0.00 -1.26 -4.57 105.19 102.40 1xtj n GLY 94 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 1xtj n GLY 94 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xtj h LYS 95 N 0.00 0.25 -0.80 1.61 1.57 -1.93 -3.35 116.57 113.92 1xtj h LYS 95 Ca 0.00 -0.26 0.13 0.00 -1.87 0.00 0.00 60.65 58.64 1xtj h LYS 95 Cb 0.00 0.07 -0.09 0.00 0.08 0.00 0.00 32.23 32.30 1xtj h LYS 95 CO 0.00 0.97 0.40 1.79 -0.57 0.00 0.00 179.45 182.04 1xtj h THR 96 N -0.36 0.76 -0.94 -0.16 1.35 -2.01 0.10 112.91 111.65 1xtj h THR 96 Ca -0.04 -0.21 0.19 0.00 -0.55 0.00 0.00 66.41 65.80 1xtj h THR 96 Cb 1.09 0.11 -0.11 0.00 -1.73 0.00 0.00 68.15 67.51 1xtj h THR 96 CO 0.07 0.11 0.53 0.00 -0.25 0.00 0.00 175.52 175.98 1xtj h ALA 97 N 1.52 1.53 -0.06 6.62 0.00 -2.00 -1.30 119.26 125.57 1xtj h ALA 97 Ca 0.42 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.46 1xtj h ALA 97 Cb 0.56 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1xtj h ALA 97 CO -0.34 -0.12 -0.15 0.28 0.00 0.00 0.00 179.25 178.92 1xtj h VAL 98 N 0.66 0.61 0.00 0.00 2.07 -0.92 -0.51 116.25 118.15 1xtj h VAL 98 Ca 0.55 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 68.01 1xtj h VAL 98 Cb 0.87 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1xtj h VAL 98 CO -0.41 0.00 -0.28 2.19 0.02 0.00 0.00 177.57 179.10 1xtj h PHE 99 N -0.23 0.00 -0.15 1.57 -5.15 -1.42 -2.48 116.94 109.08 1xtj h PHE 99 Ca 0.07 0.00 -0.10 0.00 -0.20 0.00 0.00 57.97 57.74 1xtj h PHE 99 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.49 1xtj h PHE 99 CO -0.23 0.28 -0.29 0.28 -2.00 0.00 0.00 178.31 176.34 1xtj h VAL 100 N 0.00 1.36 0.03 0.88 2.07 -0.87 -2.18 116.25 117.54 1xtj h VAL 100 Ca -0.00 -1.54 -0.00 0.00 0.82 0.00 0.00 66.70 65.97 1xtj h VAL 100 Cb 1.09 1.97 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1xtj h VAL 100 CO 0.04 0.46 -0.01 -0.07 0.02 0.00 0.00 177.57 178.01 1xtj h LEU 101 N 0.09 -0.03 -0.92 2.57 3.38 -1.17 -2.25 115.31 116.98 1xtj h LEU 101 Ca 0.01 -0.58 0.17 0.00 0.09 0.00 0.00 57.88 57.57 1xtj h LEU 101 Cb 0.88 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.54 1xtj h LEU 101 CO 0.07 0.58 0.51 0.00 0.09 0.00 0.00 178.44 179.69 1xtj h ALA 102 N 0.28 1.46 0.11 1.53 0.00 -1.53 0.18 119.26 121.28 1xtj h ALA 102 Ca -0.00 0.09 -0.28 0.00 0.00 0.00 0.00 54.91 54.72 1xtj h ALA 102 Cb 0.61 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.39 1xtj h ALA 102 CO 0.01 -0.08 -1.15 1.79 0.00 0.00 0.00 179.25 179.81 1xtj h THR 103 N 0.68 1.31 0.00 0.00 1.35 -1.45 -2.40 112.91 112.40 1xtj h THR 103 Ca 0.52 -2.43 -0.00 0.00 -0.55 0.00 0.00 66.41 63.95 1xtj h THR 103 Cb 0.78 2.72 -0.00 0.00 -1.73 0.00 0.00 68.15 69.92 1xtj h THR 103 CO -0.38 0.73 -0.01 0.25 -0.25 0.00 0.00 175.52 175.87 1xtj h LEU 104 N 0.19 0.00 0.10 3.87 5.85 -0.87 0.37 115.31 124.82 1xtj h LEU 104 Ca -0.18 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.25 1xtj h LEU 104 Cb 1.84 0.00 0.03 0.00 0.37 0.00 0.00 40.66 42.90 1xtj h LEU 104 CO 0.22 0.01 -1.22 -0.61 -0.34 0.00 0.00 178.44 176.49 1xtj h GLN 105 N 0.00 0.64 0.07 1.25 5.75 -0.56 -3.34 115.11 118.91 1xtj h GLN 105 Ca -0.00 -0.82 -0.30 0.00 -0.15 0.00 0.00 58.65 57.38 1xtj h GLN 105 Cb 0.01 0.27 -0.03 0.00 1.07 0.00 0.00 27.48 28.80 1xtj h GLN 105 CO 0.00 1.37 -1.60 1.96 -2.65 0.00 0.00 178.83 177.91 1xtj h GLN 106 N 0.29 0.14 -5.11 1.69 4.20 -0.93 -3.48 115.11 111.91 1xtj h GLN 106 Ca -0.18 -0.24 -0.70 0.00 0.06 0.00 0.00 58.65 57.58 1xtj h GLN 106 Cb 1.89 0.09 0.03 0.00 0.30 0.00 0.00 27.48 29.79 1xtj h GLN 106 CO 0.23 0.91 0.27 -0.11 -0.67 0.00 0.00 178.83 179.47 1xtj n LEU 107 N -3.31 0.42 -3.80 1.46 7.94 0.13 -4.94 117.00 114.89 1xtj n LEU 107 Ca -0.17 1.00 -0.30 0.00 -1.11 0.00 0.00 56.01 55.43 1xtj n LEU 107 Cb 1.04 -0.77 -0.14 0.00 0.53 0.00 0.00 43.42 44.08 1xtj n LEU 107 CO 0.47 -1.26 -0.26 -1.61 -1.11 0.00 0.00 177.39 173.63 1xtj s GLU 108 N 1.05 1.37 0.25 1.96 2.02 -1.26 -5.01 118.70 119.08 1xtj s GLU 108 Ca 0.82 -1.98 -0.30 0.00 0.02 0.00 0.00 54.97 53.54 1xtj s GLU 108 Cb -1.16 -2.59 -0.14 0.00 0.10 0.00 0.00 34.13 30.33 1xtj s GLU 108 CO 0.57 -1.10 1.15 -2.30 0.02 0.00 0.00 175.26 173.61 1xtj n PRO 109 N 3.74 1.50 -3.56 0.39 -0.02 -1.26 -5.03 135.00 130.76 1xtj n PRO 109 Ca 0.06 0.53 -0.22 0.00 -2.02 0.00 0.00 63.50 61.84 1xtj n PRO 109 Cb 0.36 -2.01 -0.15 0.00 -0.02 0.00 0.00 33.50 31.68 1xtj n PRO 109 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xtj s VAL 110 N -0.65 -0.20 0.12 -1.45 1.01 -1.26 -5.12 120.40 112.86 1xtj s VAL 110 Ca 0.64 -0.12 -0.35 0.00 0.00 0.00 0.00 61.98 62.15 1xtj s VAL 110 Cb -0.72 -0.60 -0.16 0.00 0.00 0.00 0.00 36.38 34.90 1xtj s VAL 110 CO 0.56 -0.23 1.43 0.41 0.00 0.00 0.00 175.10 177.27 1xtj n THR 111 N 5.30 0.04 -0.79 3.92 -1.04 -1.26 -0.91 114.28 119.54 1xtj n THR 111 Ca -0.06 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 1xtj n THR 111 Cb 0.49 -1.10 0.00 0.00 -1.82 0.00 0.00 70.33 67.90 1xtj n THR 111 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xtj n GLY 112 N 2.83 0.64 3.09 3.41 0.00 -1.26 -5.05 105.19 108.85 1xtj n GLY 112 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 1xtj n GLY 112 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xtj s GLN 113 N -0.21 1.38 -0.34 1.61 -0.21 -0.08 -5.07 119.66 116.73 1xtj s GLN 113 Ca 0.00 -0.49 -0.12 0.00 0.02 0.00 0.00 55.36 54.76 1xtj s GLN 113 Cb 0.00 -1.25 -0.01 0.00 1.00 0.00 0.00 33.01 32.75 1xtj s GLN 113 CO 0.00 0.22 0.23 0.08 -2.12 0.00 0.00 175.29 173.70 1xtj s VAL 114 N 0.00 5.19 -0.11 1.09 1.01 -1.26 -4.26 120.40 122.07 1xtj s VAL 114 Ca -0.01 -0.27 0.22 0.00 0.00 0.00 0.00 61.98 61.91 1xtj s VAL 114 Cb -0.09 -3.67 -0.33 0.00 0.00 0.00 0.00 36.38 32.29 1xtj s VAL 114 CO 0.01 -0.02 0.52 -1.20 0.00 0.00 0.00 175.10 174.41 1xtj n SER 115 N 5.09 0.09 -4.14 3.32 7.64 -0.26 -3.08 113.62 122.28 1xtj n SER 115 Ca -0.13 -0.07 -0.27 0.00 1.01 0.00 0.00 58.87 59.41 1xtj n SER 115 Cb 0.49 1.90 -0.16 0.00 -1.01 0.00 0.00 64.21 65.43 1xtj n SER 115 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1xtj s VAL 116 N -3.48 1.52 -0.19 0.44 1.01 -0.81 -1.11 120.40 117.78 1xtj s VAL 116 Ca -0.07 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1xtj s VAL 116 Cb 0.14 -1.32 0.04 0.00 0.00 0.00 0.00 36.38 35.24 1xtj s VAL 116 CO 0.91 0.44 -0.10 -0.22 0.00 0.00 0.00 175.10 176.12 1xtj s LEU 117 N 0.21 2.17 -0.11 3.92 2.96 0.16 -1.06 118.68 126.92 1xtj s LEU 117 Ca -0.09 -0.83 0.02 0.00 -0.22 0.00 0.00 54.13 53.01 1xtj s LEU 117 Cb -0.14 -1.20 -0.01 0.00 0.50 0.00 0.00 46.19 45.34 1xtj s LEU 117 CO 0.04 -0.14 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.07 1xtj s VAL 118 N 1.43 2.69 0.02 1.68 1.01 0.38 -1.02 120.40 126.59 1xtj s VAL 118 Ca -0.00 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.25 1xtj s VAL 118 Cb -0.16 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 1xtj s VAL 118 CO -0.08 0.54 -0.21 -0.04 0.00 0.00 0.00 175.10 175.31 1xtj s MET 119 N 0.25 1.51 0.15 2.72 -1.94 -0.61 -2.13 119.30 119.25 1xtj s MET 119 Ca -0.12 -0.87 0.06 0.00 -1.71 0.00 0.00 55.69 53.05 1xtj s MET 119 Cb -0.16 -1.56 -0.04 0.00 2.01 0.00 0.00 34.83 35.08 1xtj s MET 119 CO 0.06 0.41 -0.13 0.00 -0.01 0.00 0.00 175.02 175.35 1xtj h HIS 121 N 3.14 0.00 -4.09 0.00 2.07 -1.89 -3.38 115.15 110.99 1xtj h HIS 121 Ca -0.39 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 56.61 1xtj h HIS 121 Cb 1.20 0.00 -0.25 0.00 2.57 0.00 0.00 27.41 30.93 1xtj h HIS 121 CO 0.66 0.05 -0.82 0.95 -3.07 0.00 0.00 177.93 175.70 1xtj s THR 122 N -3.22 1.43 0.44 6.12 -4.23 -1.26 -4.99 115.64 109.93 1xtj s THR 122 Ca 0.05 -1.15 0.29 0.00 -1.18 0.00 0.00 61.69 59.70 1xtj s THR 122 Cb 0.06 -1.27 0.32 0.00 1.34 0.00 0.00 72.50 72.95 1xtj s THR 122 CO 0.71 0.10 2.11 0.08 -0.54 0.00 0.00 174.62 177.07 1xtj h ARG 123 N 4.82 0.00 -0.06 3.99 0.11 -1.95 -0.44 114.38 120.85 1xtj h ARG 123 Ca -0.41 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.60 1xtj h ARG 123 Cb 1.17 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.24 1xtj h ARG 123 CO 0.43 0.09 -0.31 0.93 0.10 0.00 0.00 179.97 181.22 1xtj h GLU 124 N 0.00 0.10 0.02 0.08 3.07 -1.99 -2.00 114.58 113.86 1xtj h GLU 124 Ca -0.00 -0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 58.75 1xtj h GLU 124 Cb 0.28 -0.01 0.01 0.00 -0.84 0.00 0.00 28.75 28.19 1xtj h GLU 124 CO 0.01 0.40 -0.32 1.25 -1.40 0.00 0.00 179.01 178.96 1xtj h LEU 125 N 0.09 0.25 -0.51 1.33 5.85 -1.51 -3.18 115.31 117.64 1xtj h LEU 125 Ca 0.01 -0.83 0.06 0.00 0.84 0.00 0.00 57.88 57.97 1xtj h LEU 125 Cb 0.59 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 1xtj h LEU 125 CO 0.04 1.05 0.20 0.00 -0.34 0.00 0.00 178.44 179.39 1xtj h ALA 126 N 0.20 0.63 -1.00 1.25 0.00 -1.33 -1.32 119.26 117.69 1xtj h ALA 126 Ca -0.04 0.05 0.11 0.00 0.00 0.00 0.00 54.91 55.03 1xtj h ALA 126 Cb 1.11 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.83 1xtj h ALA 126 CO 0.06 -0.18 0.63 0.35 0.00 0.00 0.00 179.25 180.11 1xtj h PHE 127 N 0.40 1.15 -0.15 0.00 3.57 -1.45 0.19 116.94 120.65 1xtj h PHE 127 Ca 0.24 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.57 1xtj h PHE 127 Cb 0.23 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.60 1xtj h PHE 127 CO -0.14 0.48 -0.72 1.96 -2.23 0.00 0.00 178.31 177.66 1xtj h GLN 128 N 1.03 0.65 -0.00 1.11 1.08 -1.32 -2.57 115.11 115.08 1xtj h GLN 128 Ca 0.48 -0.50 -0.09 0.00 -1.45 0.00 0.00 58.65 57.09 1xtj h GLN 128 Cb 0.43 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 1xtj h GLN 128 CO -0.25 1.12 -0.45 0.82 -0.95 0.00 0.00 178.83 179.13 1xtj h ILE 129 N 0.46 1.32 -0.26 2.54 2.04 -0.60 0.12 117.51 123.12 1xtj h ILE 129 Ca -0.03 -1.54 -0.08 0.00 1.00 0.00 0.00 64.86 64.21 1xtj h ILE 129 Cb 1.32 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 39.21 1xtj h ILE 129 CO 0.14 0.44 -0.18 -1.28 0.00 0.00 0.00 178.15 177.27 1xtj h SER 130 N 0.01 0.45 0.81 1.72 0.87 -0.89 0.22 113.55 116.74 1xtj h SER 130 Ca -0.00 -0.13 -0.20 0.00 -1.23 0.00 0.00 61.79 60.22 1xtj h SER 130 Cb 0.79 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.61 1xtj h SER 130 CO 0.06 0.65 -0.95 0.11 -0.53 0.00 0.00 176.83 176.16 1xtj h LYS 131 N 0.42 0.08 -0.26 2.24 1.79 -0.93 -2.49 116.57 117.41 1xtj h LYS 131 Ca 0.07 -0.11 -0.02 0.00 -2.18 0.00 0.00 60.65 58.42 1xtj h LYS 131 Cb 0.55 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.23 1xtj h LYS 131 CO 0.04 0.97 0.09 0.93 -1.08 0.00 0.00 179.45 180.40 1xtj h GLU 132 N 0.03 0.40 -0.94 3.15 4.39 0.00 -0.43 114.58 121.18 1xtj h GLU 132 Ca -0.03 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 1xtj h GLU 132 Cb 1.65 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 30.19 1xtj h GLU 132 CO 0.13 0.45 0.57 1.88 -1.16 0.00 0.00 179.01 180.88 1xtj h TYR 133 N 0.27 1.24 -0.21 4.33 -1.99 -0.96 -2.43 116.97 117.20 1xtj h TYR 133 Ca 0.09 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.81 1xtj h TYR 133 Cb 0.21 -0.41 -0.01 0.00 2.00 0.00 0.00 36.73 38.52 1xtj h TYR 133 CO -0.00 0.82 0.13 0.93 -0.00 0.00 0.00 178.16 180.04 1xtj h GLU 134 N 1.29 0.29 -0.31 4.88 5.08 -0.96 -1.37 114.58 123.48 1xtj h GLU 134 Ca 0.34 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.64 1xtj h GLU 134 Cb -0.06 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1xtj h GLU 134 CO -0.06 0.22 0.04 0.00 -1.00 0.00 0.00 179.01 178.21 1xtj h ARG 135 N 0.27 0.46 0.00 2.33 3.08 -0.79 -2.57 114.38 117.16 1xtj h ARG 135 Ca 0.08 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xtj h ARG 135 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1xtj h ARG 135 CO -0.02 0.46 -0.62 1.19 -1.07 0.00 0.00 179.97 179.92 1xtj n PHE 136 N -4.33 0.37 0.46 3.04 3.72 -0.94 -3.65 117.46 116.12 1xtj n PHE 136 Ca 0.01 0.11 0.12 0.00 -0.05 0.00 0.00 57.45 57.64 1xtj n PHE 136 Cb 0.20 -0.52 0.21 0.00 -0.94 0.00 0.00 39.48 38.42 1xtj n PHE 136 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1xtj n SER 137 N -1.92 3.33 -0.50 4.37 3.41 -0.53 -4.57 113.62 117.21 1xtj n SER 137 Ca 0.04 -1.98 0.41 0.00 -0.26 0.00 0.00 58.87 57.07 1xtj n SER 137 Cb 0.41 -0.20 0.71 0.00 -0.26 0.00 0.00 64.21 64.87 1xtj n SER 137 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1xtj h LYS 138 N 4.45 0.06 -0.32 4.33 3.64 -1.54 0.82 116.57 128.00 1xtj h LYS 138 Ca 0.00 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1xtj h LYS 138 Cb 0.97 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 1xtj h LYS 138 CO 0.00 0.04 0.01 0.66 -2.27 0.00 0.00 179.45 177.89 1xtj n TYR 139 N -4.38 1.15 -3.22 1.91 0.53 -1.26 -4.56 117.16 107.33 1xtj n TYR 139 Ca 0.37 -0.94 -0.24 0.00 -1.02 0.00 0.00 57.90 56.07 1xtj n TYR 139 Cb 1.56 -0.37 -0.06 0.00 -1.03 0.00 0.00 39.34 39.43 1xtj n TYR 139 CO 0.00 0.00 0.00 -1.33 -1.02 0.00 0.00 176.86 174.51 1xtj n MET 140 N -0.44 1.64 0.22 -0.72 2.81 0.28 -4.88 117.12 116.04 1xtj n MET 140 Ca 0.24 -3.90 0.18 0.00 -1.81 0.00 0.00 57.70 52.41 1xtj n MET 140 Cb 0.96 -1.75 0.84 0.00 -0.71 0.00 0.00 33.22 32.57 1xtj n MET 140 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1xtj h PRO 141 N 3.74 0.00 0.00 0.03 0.11 -1.80 -1.19 132.00 132.88 1xtj h PRO 141 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1xtj h PRO 141 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1xtj h PRO 141 CO 0.63 0.00 0.00 -2.95 -0.21 0.00 0.00 178.00 175.47 1xtj h ASN 142 N 0.00 0.00 -3.36 -2.05 -1.07 -1.92 -3.43 115.58 103.74 1xtj h ASN 142 Ca 0.09 0.00 -0.56 0.00 0.07 0.00 0.00 56.30 55.90 1xtj h ASN 142 Cb 0.64 0.00 -0.05 0.00 -2.07 0.00 0.00 38.32 36.84 1xtj h ASN 142 CO -0.00 0.00 0.09 -0.69 0.07 0.00 0.00 177.43 176.90 1xtj s VAL 143 N -3.35 5.05 0.08 6.14 1.01 -0.45 -5.02 120.40 123.85 1xtj s VAL 143 Ca 0.05 1.44 0.07 0.00 0.00 0.00 0.00 61.98 63.54 1xtj s VAL 143 Cb 0.09 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1xtj s VAL 143 CO 0.55 0.25 -0.14 -0.54 0.00 0.00 0.00 175.10 175.22 1xtj s LYS 144 N 0.81 2.08 0.16 2.72 1.02 -1.26 -5.01 119.74 120.26 1xtj s LYS 144 Ca 0.37 -1.01 0.03 0.00 0.02 0.00 0.00 55.97 55.38 1xtj s LYS 144 Cb -0.18 -2.25 -0.05 0.00 -0.52 0.00 0.00 37.83 34.84 1xtj s LYS 144 CO 0.18 0.52 -0.04 0.08 -0.92 0.00 0.00 175.35 175.17 1xtj s VAL 145 N -1.08 0.88 -0.18 3.17 1.01 -1.26 -2.46 120.40 120.47 1xtj s VAL 145 Ca 0.18 -2.00 -0.28 0.00 0.00 0.00 0.00 61.98 59.87 1xtj s VAL 145 Cb -0.11 -2.00 0.11 0.00 0.00 0.00 0.00 36.38 34.39 1xtj s VAL 145 CO 0.10 -0.60 0.92 0.00 0.00 0.00 0.00 175.10 175.51 1xtj s ALA 146 N -3.52 -1.90 0.08 5.51 0.00 -1.14 -4.92 121.76 115.87 1xtj s ALA 146 Ca 0.20 1.65 0.09 0.00 0.00 0.00 0.00 51.96 53.90 1xtj s ALA 146 Cb 0.05 -0.81 -0.03 0.00 0.00 0.00 0.00 23.12 22.32 1xtj s ALA 146 CO 0.02 -0.30 -0.22 0.14 0.00 0.00 0.00 175.76 175.39 1xtj s VAL 147 N -0.63 2.51 -0.05 0.00 -7.23 -1.26 -1.40 120.40 112.35 1xtj s VAL 147 Ca -0.02 -1.43 -0.01 0.00 -1.81 0.00 0.00 61.98 58.71 1xtj s VAL 147 Cb -0.02 -2.07 0.03 0.00 0.56 0.00 0.00 36.38 34.88 1xtj s VAL 147 CO 0.01 0.25 0.02 -0.36 -0.31 0.00 0.00 175.10 174.71 1xtj s PHE 148 N -0.96 0.33 0.13 2.82 2.99 -0.12 -4.96 117.98 118.21 1xtj s PHE 148 Ca 0.14 0.04 -0.09 0.00 0.00 0.00 0.00 56.93 57.02 1xtj s PHE 148 Cb -0.10 -0.55 -0.00 0.00 0.00 0.00 0.00 43.02 42.36 1xtj s PHE 148 CO 0.05 -0.21 0.24 -0.59 -0.00 0.00 0.00 175.22 174.71 1xtj s PHE 149 N 1.71 0.27 0.74 0.36 -0.12 -1.26 -2.25 117.98 117.43 1xtj s PHE 149 Ca -0.00 -0.66 -0.11 0.00 -0.05 0.00 0.00 56.93 56.11 1xtj s PHE 149 Cb -0.13 -0.05 0.04 0.00 -0.63 0.00 0.00 43.02 42.25 1xtj s PHE 149 CO -0.03 -0.63 1.08 0.20 -0.05 0.00 0.00 175.22 175.78 1xtj s GLY 150 N -2.91 1.67 0.00 1.99 0.00 -1.26 -3.90 107.32 102.91 1xtj s GLY 150 Ca 0.11 0.18 0.00 0.00 0.00 0.00 0.00 44.72 45.01 1xtj s GLY 150 CO -0.06 0.52 0.00 0.61 0.00 0.00 0.00 173.10 174.17 1xtj n GLY 151 N -1.53 1.28 3.48 0.20 0.00 -1.26 -5.02 105.19 102.35 1xtj n GLY 151 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 1xtj n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xtj s LEU 152 N 0.00 2.58 0.34 0.99 1.43 -1.25 -5.11 118.68 117.66 1xtj s LEU 152 Ca 0.00 -1.20 -0.28 0.00 -1.03 0.00 0.00 54.13 51.62 1xtj s LEU 152 Cb 0.00 -0.79 -0.10 0.00 0.03 0.00 0.00 46.19 45.33 1xtj s LEU 152 CO 0.00 -0.29 1.28 -0.55 0.23 0.00 0.00 176.35 177.02 1xtj s SER 153 N -3.52 6.74 0.05 2.29 0.15 -1.26 -4.89 113.70 113.26 1xtj s SER 153 Ca 0.31 2.63 0.26 0.00 0.70 0.00 0.00 55.95 59.85 1xtj s SER 153 Cb 0.03 -2.64 1.06 0.00 -1.71 0.00 0.00 66.02 62.76 1xtj s SER 153 CO 0.14 -0.55 1.82 0.00 1.20 0.00 0.00 173.24 175.85 1xtj n ILE 154 N 0.70 0.29 0.21 6.45 3.06 -1.26 -2.92 119.36 125.90 1xtj n ILE 154 Ca 0.01 -0.01 0.10 0.00 -2.50 0.00 0.00 62.75 60.35 1xtj n ILE 154 Cb 0.42 -0.62 0.26 0.00 0.54 0.00 0.00 39.64 40.25 1xtj n ILE 154 CO 0.00 0.00 0.00 0.11 -2.50 0.00 0.00 176.55 174.16 1xtj h LYS 155 N 0.00 0.00 0.09 9.51 1.79 -2.00 -3.01 116.57 122.96 1xtj h LYS 155 Ca 0.00 0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 58.21 1xtj h LYS 155 Cb 0.50 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 1xtj h LYS 155 CO 0.00 0.14 -1.15 0.87 -1.08 0.00 0.00 179.45 178.24 1xtj h LYS 156 N 0.00 0.27 -0.20 3.15 1.57 -1.93 -2.75 116.57 116.68 1xtj h LYS 156 Ca -0.00 -0.41 -0.02 0.00 -1.87 0.00 0.00 60.65 58.36 1xtj h LYS 156 Cb 0.97 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 1xtj h LYS 156 CO 0.02 1.16 0.06 -0.44 -0.57 0.00 0.00 179.45 179.68 1xtj h ASP 157 N 0.10 0.30 0.04 0.86 3.32 -1.66 -2.37 116.42 117.00 1xtj h ASP 157 Ca -0.11 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.72 1xtj h ASP 157 Cb 1.85 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 41.32 1xtj h ASP 157 CO 0.19 0.43 -0.04 -0.33 -1.72 0.00 0.00 179.24 177.78 1xtj h GLU 158 N 0.15 0.00 -0.30 3.56 5.08 -1.57 -0.96 114.58 120.54 1xtj h GLU 158 Ca 0.07 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1xtj h GLU 158 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1xtj h GLU 158 CO -0.00 0.04 -0.09 0.93 -1.00 0.00 0.00 179.01 178.89 1xtj h GLU 159 N 0.00 0.58 -0.28 2.33 5.08 -1.15 -1.29 114.58 119.85 1xtj h GLU 159 Ca -0.00 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.11 1xtj h GLU 159 Cb 0.06 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1xtj h GLU 159 CO 0.00 0.79 0.09 0.28 -1.00 0.00 0.00 179.01 179.18 1xtj h VAL 160 N 0.34 1.19 -0.28 3.13 2.07 -0.84 -0.46 116.25 121.41 1xtj h VAL 160 Ca 0.07 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 1xtj h VAL 160 Cb 0.58 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1xtj h VAL 160 CO 0.03 0.21 0.13 -0.07 0.02 0.00 0.00 177.57 177.89 1xtj h LEU 161 N 0.30 0.34 0.12 2.57 3.38 -1.12 -0.93 115.31 119.97 1xtj h LEU 161 Ca 0.09 -0.02 -0.31 0.00 0.09 0.00 0.00 57.88 57.73 1xtj h LEU 161 Cb 0.23 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1xtj h LEU 161 CO -0.00 0.30 -1.63 0.50 0.09 0.00 0.00 178.44 177.69 1xtj h LYS 162 N 0.38 0.26 0.03 1.13 3.64 -1.04 -3.23 116.57 117.74 1xtj h LYS 162 Ca 0.10 -0.45 -0.21 0.00 -1.27 0.00 0.00 60.65 58.82 1xtj h LYS 162 Cb 0.05 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1xtj h LYS 162 CO -0.01 1.21 -0.97 0.87 -2.27 0.00 0.00 179.45 178.29 1xtj h LYS 163 N -0.17 0.18 -0.79 1.90 1.57 -1.08 -3.42 116.57 114.76 1xtj h LYS 163 Ca -0.35 -0.23 -0.24 0.00 -1.87 0.00 0.00 60.65 57.97 1xtj h LYS 163 Cb 1.87 0.07 -0.18 0.00 0.08 0.00 0.00 32.23 34.07 1xtj h LYS 163 CO 0.07 1.01 -0.57 0.27 -0.57 0.00 0.00 179.45 179.67 1xtj n ASN 164 N -3.59 -2.80 -4.66 0.86 6.94 -0.36 -5.08 115.26 106.58 1xtj n ASN 164 Ca -0.04 -3.01 -0.49 0.00 -0.02 0.00 0.00 54.58 51.02 1xtj n ASN 164 Cb 0.87 1.46 -0.05 0.00 -2.36 0.00 0.00 39.78 39.70 1xtj n ASN 164 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1xtj s PRO 166 N 1.74 2.14 -0.03 0.00 0.04 -1.26 -4.62 135.00 133.01 1xtj s PRO 166 Ca 0.85 -0.44 0.22 0.00 0.04 0.00 0.00 61.00 61.67 1xtj s PRO 166 Cb -0.79 -2.23 -0.32 0.00 0.04 0.00 0.00 34.50 31.20 1xtj s PRO 166 CO 0.46 -1.22 0.49 0.72 0.04 0.00 0.00 177.00 177.49 1xtj n HIS 167 N -2.85 0.04 -4.81 0.56 8.25 -1.03 -4.15 115.22 111.24 1xtj n HIS 167 Ca 0.09 0.01 -0.27 0.00 -0.26 0.00 0.00 57.72 57.29 1xtj n HIS 167 Cb 0.60 -0.54 -0.17 0.00 1.12 0.00 0.00 29.99 31.01 1xtj n HIS 167 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1xtj s ILE 168 N -3.48 1.44 -0.08 1.59 1.01 -1.05 -1.11 121.20 119.53 1xtj s ILE 168 Ca -0.08 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 59.94 1xtj s ILE 168 Cb 0.14 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.33 1xtj s ILE 168 CO 0.90 0.42 -0.20 -0.69 0.00 0.00 0.00 174.94 175.38 1xtj s VAL 169 N 0.47 1.71 0.07 2.92 1.01 -0.23 -2.91 120.40 123.45 1xtj s VAL 169 Ca -0.14 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.10 1xtj s VAL 169 Cb -0.16 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 1xtj s VAL 169 CO 0.05 0.48 -0.22 -0.69 0.00 0.00 0.00 175.10 174.72 1xtj s VAL 170 N 0.40 1.81 -4.11 2.92 1.01 -0.49 -0.47 120.40 121.47 1xtj s VAL 170 Ca -0.16 -1.39 0.00 0.00 0.00 0.00 0.00 61.98 60.43 1xtj s VAL 170 Cb -0.17 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.62 1xtj s VAL 170 CO 0.07 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.91 1xtj n GLY 171 N 1.50 -2.22 3.85 4.51 0.00 -0.90 -0.94 105.19 111.00 1xtj n GLY 171 Ca -0.18 -1.23 -0.34 0.00 0.00 0.00 0.00 46.02 44.27 1xtj n GLY 171 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xtj s THR 172 N -2.32 4.82 0.29 2.61 -4.23 -0.96 -2.19 115.64 113.66 1xtj s THR 172 Ca 0.00 0.77 0.04 0.00 -1.18 0.00 0.00 61.69 61.32 1xtj s THR 172 Cb 0.00 -3.68 0.29 0.00 1.34 0.00 0.00 72.50 70.45 1xtj s THR 172 CO 0.00 0.05 1.70 -0.65 -0.54 0.00 0.00 174.62 175.17 1xtj h PRO 173 N 2.93 0.41 -0.19 3.99 0.11 -1.93 -2.49 132.00 134.83 1xtj h PRO 173 Ca -0.48 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 65.41 1xtj h PRO 173 Cb 1.18 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1xtj h PRO 173 CO 0.67 0.27 -0.66 0.78 -0.21 0.00 0.00 178.00 178.84 1xtj h GLY 174 N 0.42 0.81 0.90 -0.55 0.00 -1.94 -2.02 103.07 100.69 1xtj h GLY 174 Ca 0.56 -1.04 -0.14 0.00 0.00 0.00 0.00 47.33 46.71 1xtj h GLY 174 CO -0.52 0.93 -0.47 -0.09 0.00 0.00 0.00 176.54 176.39 1xtj h ARG 175 N 0.53 0.56 -0.24 4.80 9.65 -1.85 -1.80 114.38 126.03 1xtj h ARG 175 Ca -0.02 -0.42 0.05 0.00 -1.10 0.00 0.00 59.98 58.49 1xtj h ARG 175 Cb 1.27 0.08 -0.05 0.00 -1.39 0.00 0.00 29.97 29.88 1xtj h ARG 175 CO 0.14 1.04 -0.06 0.82 2.80 0.00 0.00 179.97 184.70 1xtj h ILE 176 N 0.18 0.75 -0.62 1.20 1.08 -1.52 -0.48 117.51 118.11 1xtj h ILE 176 Ca -0.02 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.56 1xtj h ILE 176 Cb 1.10 0.75 -0.08 0.00 -3.07 0.00 0.00 36.82 35.52 1xtj h ILE 176 CO 0.10 0.00 0.17 0.25 -0.69 0.00 0.00 178.15 177.98 1xtj h LEU 177 N -0.01 0.08 0.02 1.44 5.85 -1.30 0.15 115.31 121.55 1xtj h LEU 177 Ca 0.12 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 1xtj h LEU 177 Cb 0.18 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.34 1xtj h LEU 177 CO -0.25 0.05 -0.01 0.00 -0.34 0.00 0.00 178.44 177.89 1xtj h ALA 178 N 1.47 -0.02 -0.75 1.25 0.00 -0.30 -0.87 119.26 120.03 1xtj h ALA 178 Ca 0.32 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1xtj h ALA 178 Cb 0.46 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1xtj h ALA 178 CO -0.38 -0.50 0.47 -0.07 0.00 0.00 0.00 179.25 178.77 1xtj h LEU 179 N -0.06 0.89 -0.52 0.00 3.38 -0.31 0.51 115.31 119.21 1xtj h LEU 179 Ca -0.00 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1xtj h LEU 179 Cb 0.05 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1xtj h LEU 179 CO 0.00 0.68 0.31 0.00 0.09 0.00 0.00 178.44 179.53 1xtj h ALA 180 N 1.25 0.66 -0.05 1.53 0.00 -0.55 -0.93 119.26 121.17 1xtj h ALA 180 Ca 0.27 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 1xtj h ALA 180 Cb -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1xtj h ALA 180 CO -0.05 0.14 -0.69 0.00 0.00 0.00 0.00 179.25 178.64 1xtj h ARG 181 N 0.69 0.23 -0.78 0.00 3.08 -0.60 -2.70 114.38 114.31 1xtj h ARG 181 Ca 0.19 -0.18 0.08 0.00 0.07 0.00 0.00 59.98 60.14 1xtj h ARG 181 Cb -0.02 0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.00 1xtj h ARG 181 CO -0.04 0.83 0.44 -0.91 -1.07 0.00 0.00 179.97 179.23 1xtj h ASN 182 N 0.16 0.63 0.00 7.04 2.35 0.39 -3.45 115.58 122.69 1xtj h ASN 182 Ca -0.02 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1xtj h ASN 182 Cb 1.24 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.53 1xtj h ASN 182 CO 0.11 0.37 0.00 0.29 -1.65 0.00 0.00 177.43 176.55 1xtj n LYS 183 N -4.76 0.00 0.06 0.81 4.76 -0.42 -4.96 118.16 113.65 1xtj n LYS 183 Ca 0.12 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.52 1xtj n LYS 183 Cb 0.25 0.00 0.17 0.00 -1.84 0.00 0.00 35.03 33.61 1xtj n LYS 183 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1xtj h SER 184 N 0.00 0.38 -3.62 4.39 0.02 -1.62 -3.40 113.55 109.70 1xtj h SER 184 Ca 0.00 -0.16 -0.67 0.00 -0.84 0.00 0.00 61.79 60.12 1xtj h SER 184 Cb 0.00 -0.11 -0.24 0.00 0.14 0.00 0.00 62.40 62.19 1xtj h SER 184 CO 0.00 0.76 -0.61 -0.22 -1.14 0.00 0.00 176.83 175.62 1xtj s LEU 185 N -8.33 3.77 -0.38 5.07 2.96 -0.85 -4.93 118.68 116.00 1xtj s LEU 185 Ca -0.06 -0.51 -0.14 0.00 -0.22 0.00 0.00 54.13 53.21 1xtj s LEU 185 Cb 0.13 -1.92 0.00 0.00 0.50 0.00 0.00 46.19 44.90 1xtj s LEU 185 CO 0.79 -0.14 0.27 0.21 -1.32 0.00 0.00 176.35 176.16 1xtj s ASN 186 N 1.56 6.08 -0.04 3.68 2.47 -1.26 -4.17 114.94 123.25 1xtj s ASN 186 Ca 0.04 -0.68 0.19 0.00 0.42 0.00 0.00 52.86 52.84 1xtj s ASN 186 Cb -0.16 -2.15 0.63 0.00 -1.45 0.00 0.00 41.25 38.12 1xtj s ASN 186 CO 0.04 -0.35 1.53 0.18 -3.72 0.00 0.00 177.10 174.77 1xtj n LEU 187 N 5.13 3.96 -0.23 3.21 4.77 -1.26 -4.40 117.00 128.17 1xtj n LEU 187 Ca -0.12 -1.99 0.01 0.00 -0.03 0.00 0.00 56.01 53.89 1xtj n LEU 187 Cb 0.48 -0.50 0.04 0.00 -2.33 0.00 0.00 43.42 41.11 1xtj n LEU 187 CO 0.39 0.84 0.50 0.29 -1.33 0.00 0.00 177.39 178.08 1xtj n LYS 188 N 1.30 1.23 0.00 3.23 4.76 -1.26 -3.28 118.16 124.15 1xtj n LYS 188 Ca 0.23 -0.30 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 1xtj n LYS 188 Cb 0.68 -1.15 0.00 0.00 -1.84 0.00 0.00 35.03 32.72 1xtj n LYS 188 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1xtj n HIS 189 N -0.21 0.00 -2.12 2.13 8.25 -1.26 -4.67 115.22 117.34 1xtj n HIS 189 Ca 0.03 -0.24 -0.42 0.00 -0.26 0.00 0.00 57.72 56.83 1xtj n HIS 189 Cb 0.12 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.17 1xtj n HIS 189 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1xtj s ILE 190 N -0.47 3.07 -0.04 1.59 -1.09 -1.18 -4.23 121.20 118.85 1xtj s ILE 190 Ca 0.00 0.81 0.02 0.00 -2.23 0.00 0.00 60.65 59.25 1xtj s ILE 190 Cb 0.00 -3.52 -0.03 0.00 -1.58 0.00 0.00 42.46 37.33 1xtj s ILE 190 CO 0.00 0.09 0.06 0.29 -1.23 0.00 0.00 174.94 174.15 1xtj n LYS 191 N 3.39 2.57 -3.81 2.79 5.02 -0.26 -4.45 118.16 123.41 1xtj n LYS 191 Ca 0.10 -0.01 -0.27 0.00 -2.02 0.00 0.00 58.31 56.11 1xtj n LYS 191 Cb 0.41 -0.87 -0.17 0.00 -0.02 0.00 0.00 35.03 34.39 1xtj n LYS 191 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1xtj s HIS 192 N -1.77 1.20 -0.27 2.13 3.76 -0.78 -0.49 115.29 119.07 1xtj s HIS 192 Ca -0.00 -0.76 -0.00 0.00 -0.15 0.00 0.00 55.06 54.14 1xtj s HIS 192 Cb 0.01 -1.08 0.05 0.00 1.11 0.00 0.00 32.58 32.67 1xtj s HIS 192 CO 0.09 -0.54 -0.05 0.12 -0.85 0.00 0.00 174.74 173.52 1xtj s PHE 193 N 1.80 3.21 -0.07 1.40 5.36 0.16 0.38 117.98 130.21 1xtj s PHE 193 Ca 0.01 -1.91 0.05 0.00 -0.96 0.00 0.00 56.93 54.12 1xtj s PHE 193 Cb -0.15 -2.05 -0.00 0.00 -0.34 0.00 0.00 43.02 40.48 1xtj s PHE 193 CO -0.07 -0.81 -0.22 0.42 -1.46 0.00 0.00 175.22 173.08 1xtj s ILE 194 N 1.23 1.89 -0.17 3.12 1.09 -0.19 -1.00 121.20 127.17 1xtj s ILE 194 Ca -0.05 -0.95 -0.01 0.00 -1.10 0.00 0.00 60.65 58.54 1xtj s ILE 194 Cb -0.19 -1.62 -0.00 0.00 -1.06 0.00 0.00 42.46 39.59 1xtj s ILE 194 CO -0.03 0.53 -0.12 -0.76 -0.10 0.00 0.00 174.94 174.45 1xtj s LEU 195 N 0.12 2.61 -0.07 2.97 1.43 0.07 -1.58 118.68 124.23 1xtj s LEU 195 Ca -0.10 -0.43 -0.04 0.00 -1.03 0.00 0.00 54.13 52.52 1xtj s LEU 195 Cb -0.15 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.42 1xtj s LEU 195 CO 0.05 0.06 0.10 -0.62 0.23 0.00 0.00 176.35 176.18 1xtj s ASP 196 N 0.94 5.98 -1.53 2.29 3.68 -0.49 -1.89 116.67 125.66 1xtj s ASP 196 Ca -0.02 0.31 -0.10 0.00 2.13 0.00 0.00 52.55 54.87 1xtj s ASP 196 Cb -0.15 -1.83 0.08 0.00 -1.45 0.00 0.00 42.92 39.56 1xtj s ASP 196 CO -0.01 0.35 0.74 -0.62 0.13 0.00 0.00 175.17 175.76 1xtj n GLU 197 N 1.71 -4.16 -0.34 4.34 -0.58 0.50 -4.44 120.64 117.66 1xtj n GLU 197 Ca -0.17 0.48 0.21 0.00 -0.42 0.00 0.00 57.16 57.26 1xtj n GLU 197 Cb 0.54 -5.08 0.44 0.00 -0.57 0.00 0.00 31.44 26.77 1xtj n GLU 197 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xtj h ASP 199 N 0.45 -0.05 -0.48 0.00 3.04 -1.88 0.94 116.42 118.46 1xtj h ASP 199 Ca 0.67 0.00 0.10 0.00 -3.24 0.00 0.00 57.03 54.56 1xtj h ASP 199 Cb 1.47 0.02 -0.10 0.00 -1.04 0.00 0.00 39.33 39.68 1xtj h ASP 199 CO -0.48 -0.02 -0.21 0.11 -2.04 0.00 0.00 179.24 176.60 1xtj h LYS 200 N -0.02 -0.10 -0.52 4.15 1.57 -1.67 0.41 116.57 120.39 1xtj h LYS 200 Ca -0.00 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1xtj h LYS 200 Cb 0.02 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 1xtj h LYS 200 CO -0.01 -0.07 0.27 1.98 -0.57 0.00 0.00 179.45 181.06 1xtj h MET 201 N -0.11 0.52 0.00 3.15 4.05 -0.99 -2.84 114.93 118.71 1xtj h MET 201 Ca 0.22 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.61 1xtj h MET 201 Cb 0.46 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 1xtj h MET 201 CO -0.55 0.34 -0.05 -0.07 0.23 0.00 0.00 176.91 176.82 1xtj h LEU 202 N 0.53 0.00 -1.88 3.39 3.38 0.18 -3.27 115.31 117.65 1xtj h LEU 202 Ca 0.22 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.15 1xtj h LEU 202 Cb 0.11 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1xtj h LEU 202 CO -0.14 0.00 0.05 -0.62 0.09 0.00 0.00 178.44 177.82 1xtj n GLU 203 N -2.87 1.48 -3.67 1.13 1.02 0.14 -4.47 120.64 113.39 1xtj n GLU 203 Ca 0.04 -0.55 -0.30 0.00 -0.02 0.00 0.00 57.16 56.33 1xtj n GLU 203 Cb 0.51 -1.44 -0.14 0.00 -0.02 0.00 0.00 31.44 30.34 1xtj n GLU 203 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1xtj s GLN 204 N -0.98 0.77 0.15 3.49 0.74 -1.23 -5.01 119.66 117.58 1xtj s GLN 204 Ca 0.10 -1.27 -0.10 0.00 0.05 0.00 0.00 55.36 54.14 1xtj s GLN 204 Cb 0.08 -1.89 0.18 0.00 1.10 0.00 0.00 33.01 32.48 1xtj s GLN 204 CO 0.02 -1.06 0.96 1.28 -0.55 0.00 0.00 175.29 175.94 1xtj n LEU 205 N 4.47 -0.36 -0.04 3.68 4.77 -1.26 0.29 117.00 128.54 1xtj n LEU 205 Ca 0.02 1.07 -0.12 0.00 -0.03 0.00 0.00 56.01 56.95 1xtj n LEU 205 Cb 0.40 -0.26 -0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1xtj n LEU 205 CO 0.14 -0.98 0.71 -2.24 -1.33 0.00 0.00 177.39 173.69 1xtj h ASP 206 N 0.00 0.25 -0.54 -1.43 2.03 -1.96 -1.93 116.42 112.84 1xtj h ASP 206 Ca 0.23 -0.36 -0.08 0.00 -0.73 0.00 0.00 57.03 56.10 1xtj h ASP 206 Cb 0.39 -0.07 -0.02 0.00 -0.83 0.00 0.00 39.33 38.79 1xtj h ASP 206 CO -0.62 0.55 0.04 -0.03 -1.03 0.00 0.00 179.24 178.16 1xtj h MET 207 N -0.05 0.96 -0.60 4.15 4.05 -1.45 -1.81 114.93 120.18 1xtj h MET 207 Ca 0.03 -0.26 0.02 0.00 -0.28 0.00 0.00 59.70 59.21 1xtj h MET 207 Cb 0.44 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.10 1xtj h MET 207 CO 0.01 0.92 0.39 -0.09 0.23 0.00 0.00 176.91 178.38 1xtj h ARG 208 N 0.89 0.73 -0.05 0.39 2.43 -0.10 -0.36 114.38 118.32 1xtj h ARG 208 Ca 0.17 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.16 1xtj h ARG 208 Cb 0.46 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1xtj h ARG 208 CO 0.02 0.49 -0.61 -0.09 -1.51 0.00 0.00 179.97 178.26 1xtj h ARG 209 N 0.76 0.16 -0.13 0.20 2.43 -0.55 -2.90 114.38 114.36 1xtj h ARG 209 Ca 0.23 -0.11 -0.19 0.00 -0.81 0.00 0.00 59.98 59.10 1xtj h ARG 209 Cb -0.01 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1xtj h ARG 209 CO -0.06 0.72 -0.70 -0.44 -1.51 0.00 0.00 179.97 177.99 1xtj h ASP 210 N 0.12 0.64 -0.33 -3.80 3.32 -0.44 -2.90 116.42 113.03 1xtj h ASP 210 Ca -0.01 -0.40 -0.03 0.00 0.02 0.00 0.00 57.03 56.61 1xtj h ASP 210 Cb 1.11 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 1xtj h ASP 210 CO 0.09 1.15 0.11 0.58 -1.72 0.00 0.00 179.24 179.45 1xtj h VAL 211 N 0.38 1.18 -0.10 -1.35 2.07 -1.05 -0.91 116.25 116.47 1xtj h VAL 211 Ca -0.03 -0.61 -0.08 0.00 0.82 0.00 0.00 66.70 66.80 1xtj h VAL 211 Cb 1.28 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1xtj h VAL 211 CO 0.13 0.23 -0.25 1.56 0.02 0.00 0.00 177.57 179.26 1xtj h GLN 212 N 0.58 0.34 0.14 1.57 4.20 -1.48 -1.17 115.11 119.30 1xtj h GLN 212 Ca 0.14 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1xtj h GLN 212 Cb 0.20 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 1xtj h GLN 212 CO -0.01 0.85 -0.09 1.49 -0.67 0.00 0.00 178.83 180.40 1xtj h GLU 213 N -0.10 -0.22 -0.16 1.46 4.81 -1.31 -2.04 114.58 117.02 1xtj h GLU 213 Ca -0.00 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1xtj h GLU 213 Cb 0.85 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.21 1xtj h GLU 213 CO 0.05 -0.14 -0.36 0.82 -0.73 0.00 0.00 179.01 178.65 1xtj h ILE 214 N -0.23 0.23 -1.16 2.32 2.04 -1.20 -0.75 117.51 118.77 1xtj h ILE 214 Ca -0.01 0.00 0.37 0.00 1.00 0.00 0.00 64.86 66.22 1xtj h ILE 214 Cb 0.19 0.23 -0.13 0.00 -0.74 0.00 0.00 36.82 36.37 1xtj h ILE 214 CO 0.01 0.00 0.73 0.15 0.00 0.00 0.00 178.15 179.04 1xtj h PHE 215 N -0.42 0.67 0.00 1.37 3.57 -0.69 -0.09 116.94 121.35 1xtj h PHE 215 Ca 0.10 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1xtj h PHE 215 Cb 0.58 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.14 1xtj h PHE 215 CO -0.45 -0.16 0.00 0.00 -2.23 0.00 0.00 178.31 175.47 1xtj h ARG 216 N 0.20 0.00 -0.01 1.11 3.08 -0.44 -2.96 114.38 115.36 1xtj h ARG 216 Ca 0.75 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.80 1xtj h ARG 216 Cb 2.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.16 1xtj h ARG 216 CO -0.46 0.00 -0.29 -1.33 -1.07 0.00 0.00 179.97 176.82 1xtj n MET 217 N -2.80 0.62 -3.42 0.04 2.81 -0.05 -4.88 117.12 109.44 1xtj n MET 217 Ca 0.03 -0.35 -0.27 0.00 -1.81 0.00 0.00 57.70 55.29 1xtj n MET 217 Cb 0.37 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.36 1xtj n MET 217 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1xtj s THR 218 N -2.62 5.08 0.99 2.03 2.01 -1.12 -3.99 115.64 118.02 1xtj s THR 218 Ca 0.22 -0.14 -0.12 0.00 0.31 0.00 0.00 61.69 61.96 1xtj s THR 218 Cb 0.19 -3.76 0.13 0.00 0.01 0.00 0.00 72.50 69.07 1xtj s THR 218 CO 0.55 -0.34 0.79 -2.65 -0.69 0.00 0.00 174.62 172.29 1xtj n PRO 219 N -1.05 -0.84 0.02 4.92 -0.02 -1.26 -4.96 135.00 131.81 1xtj n PRO 219 Ca -0.03 -0.20 -0.20 0.00 -2.02 0.00 0.00 63.50 61.05 1xtj n PRO 219 Cb 0.54 -2.12 -0.14 0.00 -0.02 0.00 0.00 33.50 31.76 1xtj n PRO 219 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1xtj h HIS 220 N -1.94 0.47 -2.57 6.00 3.86 -1.94 -3.42 115.15 115.60 1xtj h HIS 220 Ca -0.47 -0.34 -0.60 0.00 -1.16 0.00 0.00 60.37 57.79 1xtj h HIS 220 Cb 1.29 -0.02 -0.13 0.00 1.06 0.00 0.00 27.41 29.62 1xtj h HIS 220 CO 0.40 1.39 0.69 -1.21 0.86 0.00 0.00 177.93 180.05 1xtj s GLU 221 N -2.43 3.13 0.18 2.45 0.41 -1.26 -4.96 118.70 116.22 1xtj s GLU 221 Ca -0.17 -0.67 -0.24 0.00 -0.41 0.00 0.00 54.97 53.49 1xtj s GLU 221 Cb 0.02 -4.21 0.06 0.00 -1.78 0.00 0.00 34.13 28.21 1xtj s GLU 221 CO 0.79 -1.91 0.79 -1.59 -0.49 0.00 0.00 175.26 172.85 1xtj s LYS 222 N 4.54 1.37 0.05 1.61 -2.85 -1.26 -4.95 119.74 118.24 1xtj s LYS 222 Ca 0.26 -0.69 -0.23 0.00 -1.00 0.00 0.00 55.97 54.31 1xtj s LYS 222 Cb -0.14 0.51 -0.06 0.00 -2.06 0.00 0.00 37.83 36.08 1xtj s LYS 222 CO 0.12 -0.62 0.69 -1.14 0.10 0.00 0.00 175.35 174.49 1xtj s GLN 223 N -3.58 4.41 -0.03 1.78 0.74 0.35 -4.94 119.66 118.40 1xtj s GLN 223 Ca 0.08 0.93 0.03 0.00 0.05 0.00 0.00 55.36 56.45 1xtj s GLN 223 Cb -0.03 -3.33 0.00 0.00 1.10 0.00 0.00 33.01 30.75 1xtj s GLN 223 CO -0.01 0.38 -0.12 0.08 -0.55 0.00 0.00 175.29 175.08 1xtj s VAL 224 N -0.34 1.01 -0.00 1.34 1.01 -1.25 -0.67 120.40 121.49 1xtj s VAL 224 Ca 0.35 -0.49 -0.00 0.00 0.00 0.00 0.00 61.98 61.83 1xtj s VAL 224 Cb -0.20 -0.88 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 1xtj s VAL 224 CO 0.21 0.30 0.01 -0.04 0.00 0.00 0.00 175.10 175.58 1xtj s MET 225 N 0.11 0.03 0.05 2.72 -1.94 -0.17 -2.25 119.30 117.86 1xtj s MET 225 Ca -0.03 -0.04 0.06 0.00 -1.71 0.00 0.00 55.69 53.97 1xtj s MET 225 Cb -0.09 0.01 -0.02 0.00 2.01 0.00 0.00 34.83 36.74 1xtj s MET 225 CO 0.01 -0.01 -0.16 -1.64 -0.01 0.00 0.00 175.02 173.21 1xtj s MET 226 N -0.11 1.03 -0.04 2.03 -1.94 -0.32 -0.75 119.30 119.19 1xtj s MET 226 Ca -0.01 -0.85 0.01 0.00 -1.71 0.00 0.00 55.69 53.13 1xtj s MET 226 Cb -0.01 -1.08 0.02 0.00 2.01 0.00 0.00 34.83 35.77 1xtj s MET 226 CO -0.00 0.26 -0.05 -0.06 -0.01 0.00 0.00 175.02 175.16 1xtj s PHE 227 N -0.92 0.76 0.03 -0.03 0.40 -0.79 -1.48 117.98 115.94 1xtj s PHE 227 Ca 0.03 -0.20 -0.06 0.00 -0.60 0.00 0.00 56.93 56.09 1xtj s PHE 227 Cb -0.08 -0.64 -0.01 0.00 0.51 0.00 0.00 43.02 42.80 1xtj s PHE 227 CO 0.02 -0.17 0.11 -1.12 0.70 0.00 0.00 175.22 174.76 1xtj s SER 228 N 0.74 0.12 0.13 1.36 0.01 -1.00 -0.37 113.70 114.70 1xtj s SER 228 Ca -0.10 -0.42 -0.01 0.00 1.31 0.00 0.00 55.95 56.73 1xtj s SER 228 Cb -0.13 0.22 -0.10 0.00 0.21 0.00 0.00 66.02 66.22 1xtj s SER 228 CO 0.00 -0.46 1.31 0.00 0.41 0.00 0.00 173.24 174.50 1xtj h ALA 229 N 3.90 0.38 -0.64 1.44 0.00 -1.91 -1.26 119.26 121.17 1xtj h ALA 229 Ca -0.32 -0.76 -0.64 0.00 0.00 0.00 0.00 54.91 53.19 1xtj h ALA 229 Cb 1.19 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.82 1xtj h ALA 229 CO 0.47 0.92 -0.47 0.95 0.00 0.00 0.00 179.25 181.11 1xtj s THR 230 N -3.09 1.45 -2.48 0.00 -4.23 -1.26 -3.99 115.64 102.04 1xtj s THR 230 Ca -0.04 -1.86 0.27 0.00 -1.18 0.00 0.00 61.69 58.88 1xtj s THR 230 Cb 0.09 -2.31 0.40 0.00 1.34 0.00 0.00 72.50 72.02 1xtj s THR 230 CO 0.85 0.00 1.57 0.18 -0.54 0.00 0.00 174.62 176.68 1xtj n LEU 231 N -1.34 1.80 -1.29 4.79 4.77 -1.26 -4.85 117.00 119.61 1xtj n LEU 231 Ca -0.12 -0.59 0.07 0.00 -0.03 0.00 0.00 56.01 55.33 1xtj n LEU 231 Cb 0.66 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.70 1xtj n LEU 231 CO 0.40 0.31 -0.48 -0.24 -1.33 0.00 0.00 177.39 176.05 1xtj n SER 232 N 0.31 -6.99 -3.37 -1.43 2.88 -1.26 -4.49 113.62 99.27 1xtj n SER 232 Ca 0.16 1.45 -0.31 0.00 -1.33 0.00 0.00 58.87 58.84 1xtj n SER 232 Cb 0.42 -4.22 -0.03 0.00 -0.75 0.00 0.00 64.21 59.63 1xtj n SER 232 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1xtj n LYS 233 N -3.15 2.02 -2.34 -1.46 4.81 -1.26 -4.21 118.16 112.57 1xtj n LYS 233 Ca -0.04 -1.70 -0.01 0.00 -0.87 0.00 0.00 58.31 55.69 1xtj n LYS 233 Cb 0.49 -2.68 0.00 0.00 0.02 0.00 0.00 35.03 32.86 1xtj n LYS 233 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1xtj n GLU 234 N 5.24 -0.76 0.00 1.64 -0.58 -1.26 -4.99 120.64 119.94 1xtj n GLU 234 Ca 0.49 0.97 0.01 0.00 -0.42 0.00 0.00 57.16 58.20 1xtj n GLU 234 Cb 0.25 -3.77 -0.00 0.00 -0.57 0.00 0.00 31.44 27.34 1xtj n GLU 234 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1xtj n ILE 235 N -1.52 0.00 -0.25 -3.67 -0.00 -1.26 -4.70 119.36 107.96 1xtj n ILE 235 Ca -0.00 -0.47 0.08 0.00 -0.00 0.00 0.00 62.75 62.36 1xtj n ILE 235 Cb 0.51 1.02 0.33 0.00 -0.00 0.00 0.00 39.64 41.49 1xtj n ILE 235 CO 0.00 0.00 0.00 0.03 -0.00 0.00 0.00 176.55 176.58 1xtj h ARG 236 N 0.15 0.79 -0.29 0.38 3.08 -1.90 -1.76 114.38 114.83 1xtj h ARG 236 Ca 0.00 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1xtj h ARG 236 Cb 0.07 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1xtj h ARG 236 CO 0.00 0.52 0.10 -1.00 -1.07 0.00 0.00 179.97 178.52 1xtj h PRO 237 N 0.82 0.45 -0.25 0.04 0.13 -1.98 0.39 132.00 131.60 1xtj h PRO 237 Ca 0.38 -0.09 0.01 0.00 -0.87 0.00 0.00 66.00 65.43 1xtj h PRO 237 Cb 0.40 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.45 1xtj h PRO 237 CO -0.15 0.50 0.17 0.28 -0.23 0.00 0.00 178.00 178.56 1xtj h VAL 238 N 0.32 1.04 -0.26 1.56 2.07 -1.77 -1.25 116.25 117.95 1xtj h VAL 238 Ca 0.10 -0.10 -0.19 0.00 0.82 0.00 0.00 66.70 67.32 1xtj h VAL 238 Cb 0.23 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1xtj h VAL 238 CO -0.00 0.05 -0.58 0.00 0.02 0.00 0.00 177.57 177.06 1xtj n ARG 240 N -3.99 0.44 -0.02 0.00 0.63 0.13 -2.08 116.66 111.77 1xtj n ARG 240 Ca -0.05 0.00 -0.21 0.00 -0.92 0.00 0.00 57.85 56.67 1xtj n ARG 240 Cb 0.65 -1.41 -0.14 0.00 0.45 0.00 0.00 32.46 32.01 1xtj n ARG 240 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1xtj n LYS 241 N -0.91 0.74 0.02 -0.14 3.00 -1.03 -4.47 118.16 115.37 1xtj n LYS 241 Ca 0.09 0.25 -0.09 0.00 -0.00 0.00 0.00 58.31 58.56 1xtj n LYS 241 Cb 0.04 -1.68 -0.13 0.00 0.00 0.00 0.00 35.03 33.26 1xtj n LYS 241 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.40 178.14 1xtj h PHE 242 N 0.02 0.05 -3.32 5.64 -1.00 -1.47 -3.47 116.94 113.39 1xtj h PHE 242 Ca -0.45 -0.04 -0.65 0.00 2.81 0.00 0.00 57.97 59.64 1xtj h PHE 242 Cb 1.99 -0.00 -0.25 0.00 3.61 0.00 0.00 35.95 41.30 1xtj h PHE 242 CO 0.07 1.05 -0.72 -1.64 -1.61 0.00 0.00 178.31 175.45 1xtj s MET 243 N -2.65 3.49 -0.32 1.51 -1.94 -1.04 -4.96 119.30 113.40 1xtj s MET 243 Ca -0.03 -0.62 -0.26 0.00 -1.71 0.00 0.00 55.69 53.07 1xtj s MET 243 Cb 0.09 -2.79 0.01 0.00 2.01 0.00 0.00 34.83 34.15 1xtj s MET 243 CO 0.83 0.17 0.94 -0.65 -0.01 0.00 0.00 175.02 176.29 1xtj s GLN 244 N 0.51 3.99 -0.24 2.03 -0.21 -1.26 -4.37 119.66 120.12 1xtj s GLN 244 Ca -0.06 0.81 -0.04 0.00 0.02 0.00 0.00 55.36 56.09 1xtj s GLN 244 Cb -0.15 -3.74 0.01 0.00 1.00 0.00 0.00 33.01 30.12 1xtj s GLN 244 CO 0.03 -0.82 0.20 -0.40 -2.12 0.00 0.00 175.29 172.19 1xtj n ASP 245 N 6.58 -1.64 -4.89 5.90 5.68 -1.26 -4.89 116.55 122.03 1xtj n ASP 245 Ca 0.08 -0.25 -0.29 0.00 -0.50 0.00 0.00 54.79 53.82 1xtj n ASP 245 Cb 0.48 -0.52 0.07 0.00 -1.14 0.00 0.00 41.12 40.01 1xtj n ASP 245 CO 0.00 0.00 0.00 -2.16 -1.33 0.00 0.00 177.20 173.71 1xtj s PRO 246 N -2.40 2.29 -0.35 0.11 0.04 -1.26 -4.89 135.00 128.53 1xtj s PRO 246 Ca 0.03 0.24 -0.11 0.00 0.04 0.00 0.00 61.00 61.20 1xtj s PRO 246 Cb -0.00 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.57 1xtj s PRO 246 CO 0.30 -1.39 0.20 1.41 0.04 0.00 0.00 177.00 177.55 1xtj s MET 247 N -5.50 3.15 0.09 4.56 1.75 -0.93 -4.97 119.30 117.46 1xtj s MET 247 Ca 0.61 -0.86 -0.30 0.00 -1.25 0.00 0.00 55.69 53.89 1xtj s MET 247 Cb -0.11 -3.71 -0.05 0.00 2.84 0.00 0.00 34.83 33.80 1xtj s MET 247 CO 0.50 -0.55 1.00 -1.21 -0.65 0.00 0.00 175.02 174.11 1xtj s GLU 248 N 1.62 4.64 -0.02 4.11 2.02 -1.26 -1.24 118.70 128.56 1xtj s GLU 248 Ca 0.04 1.50 0.01 0.00 0.02 0.00 0.00 54.97 56.54 1xtj s GLU 248 Cb -0.18 -3.38 0.02 0.00 0.10 0.00 0.00 34.13 30.69 1xtj s GLU 248 CO 0.08 0.11 -0.01 0.42 0.02 0.00 0.00 175.26 175.87 1xtj s ILE 249 N 0.26 0.20 -0.08 -1.63 1.01 0.28 -4.95 121.20 116.29 1xtj s ILE 249 Ca 0.49 0.01 -0.01 0.00 0.00 0.00 0.00 60.65 61.15 1xtj s ILE 249 Cb -0.24 -0.25 0.03 0.00 0.01 0.00 0.00 42.46 42.00 1xtj s ILE 249 CO 0.30 0.12 -0.03 0.12 0.00 0.00 0.00 174.94 175.45 1xtj s PHE 250 N 0.66 0.93 -0.29 3.97 5.36 -1.26 -1.51 117.98 125.84 1xtj s PHE 250 Ca -0.07 -0.34 -0.07 0.00 -0.96 0.00 0.00 56.93 55.49 1xtj s PHE 250 Cb -0.10 -0.91 0.01 0.00 -0.34 0.00 0.00 43.02 41.68 1xtj s PHE 250 CO -0.01 -0.36 0.07 0.08 -1.46 0.00 0.00 175.22 173.55 1xtj s VAL 251 N 1.70 3.96 0.78 3.12 1.01 -1.12 -5.04 120.40 124.81 1xtj s VAL 251 Ca 0.02 -0.65 -0.13 0.00 0.00 0.00 0.00 61.98 61.22 1xtj s VAL 251 Cb -0.13 -3.02 0.07 0.00 0.00 0.00 0.00 36.38 33.30 1xtj s VAL 251 CO -0.05 0.11 1.16 -1.81 0.00 0.00 0.00 175.10 174.51 1xtj s ASP 252 N 1.51 4.00 -0.14 3.32 1.01 -1.26 -4.46 116.67 120.65 1xtj s ASP 252 Ca 0.03 2.18 -0.37 0.00 0.71 0.00 0.00 52.55 55.10 1xtj s ASP 252 Cb -0.17 -2.57 -0.14 0.00 1.01 0.00 0.00 42.92 41.06 1xtj s ASP 252 CO 0.02 -2.38 1.77 0.47 0.21 0.00 0.00 175.17 175.26 1xtj n ASP 253 N -3.24 2.87 -4.59 0.27 8.00 -1.26 -4.92 116.55 113.68 1xtj n ASP 253 Ca 0.12 1.03 -0.41 0.00 0.71 0.00 0.00 54.79 56.24 1xtj n ASP 253 Cb 0.51 -1.27 -0.07 0.00 -0.02 0.00 0.00 41.12 40.28 1xtj n ASP 253 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1xtj s GLU 254 N 3.42 3.85 -0.12 -1.24 0.41 -1.26 -4.72 118.70 119.04 1xtj s GLU 254 Ca 0.94 0.22 -0.04 0.00 -0.41 0.00 0.00 54.97 55.68 1xtj s GLU 254 Cb -0.87 -3.74 0.02 0.00 -1.78 0.00 0.00 34.13 27.76 1xtj s GLU 254 CO 0.56 -0.59 0.09 0.25 -0.49 0.00 0.00 175.26 175.08 1xtj n THR 255 N 5.41 -7.86 -2.42 3.63 -2.24 -1.26 -4.94 114.28 104.61 1xtj n THR 255 Ca -0.02 1.29 -0.41 0.00 -2.27 0.00 0.00 64.05 62.65 1xtj n THR 255 Cb 0.49 -5.24 -0.03 0.00 -2.10 0.00 0.00 70.33 63.45 1xtj n THR 255 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1xtj s LYS 256 N -0.83 3.20 0.21 -0.78 -0.14 -1.26 -4.98 119.74 115.15 1xtj s LYS 256 Ca -0.10 0.23 -0.32 0.00 -1.36 0.00 0.00 55.97 54.41 1xtj s LYS 256 Cb 0.01 -4.17 -0.12 0.00 -1.68 0.00 0.00 37.83 31.87 1xtj s LYS 256 CO 0.41 -2.09 1.68 1.28 -0.76 0.00 0.00 175.35 175.87 1xtj n LEU 257 N 9.82 3.86 -4.33 3.17 4.77 -1.26 -5.01 117.00 128.02 1xtj n LEU 257 Ca 0.10 1.08 -0.27 0.00 -0.03 0.00 0.00 56.01 56.88 1xtj n LEU 257 Cb 0.49 -1.55 -0.13 0.00 -2.33 0.00 0.00 43.42 39.90 1xtj n LEU 257 CO 0.71 0.08 -0.55 -0.89 -1.33 0.00 0.00 177.39 175.41 1xtj s THR 258 N 0.95 1.99 -0.28 -5.08 2.01 -1.26 -5.04 115.64 108.93 1xtj s THR 258 Ca 0.74 -1.54 0.02 0.00 0.31 0.00 0.00 61.69 61.22 1xtj s THR 258 Cb -0.54 -1.76 0.39 0.00 0.01 0.00 0.00 72.50 70.60 1xtj s THR 258 CO 0.36 0.12 1.59 -0.11 -0.69 0.00 0.00 174.62 175.89 1xtj n LEU 259 N 1.27 5.38 -4.77 4.42 7.94 -1.26 -4.63 117.00 125.36 1xtj n LEU 259 Ca -0.18 -2.83 -0.37 0.00 -1.11 0.00 0.00 56.01 51.52 1xtj n LEU 259 Cb 0.53 -0.73 -0.07 0.00 0.53 0.00 0.00 43.42 43.68 1xtj n LEU 259 CO 0.23 0.87 -0.04 -2.28 -1.11 0.00 0.00 177.39 175.05 1xtj s HIS 260 N -2.01 3.52 0.00 1.96 2.46 -1.26 -4.17 115.29 115.79 1xtj s HIS 260 Ca 0.35 0.61 0.00 0.00 0.47 0.00 0.00 55.06 56.49 1xtj s HIS 260 Cb 0.29 -2.25 0.00 0.00 -0.13 0.00 0.00 32.58 30.49 1xtj s HIS 260 CO 0.06 0.38 0.00 0.41 -2.47 0.00 0.00 174.74 173.12 1xtj n GLY 261 N 2.95 0.52 3.17 1.59 0.00 -1.26 -5.01 105.19 107.15 1xtj n GLY 261 Ca -0.14 -0.84 -0.30 0.00 0.00 0.00 0.00 46.02 44.75 1xtj n GLY 261 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xtj s LEU 262 N 0.00 1.96 -0.19 0.99 2.96 -1.26 -3.43 118.68 119.72 1xtj s LEU 262 Ca 0.00 -0.47 -0.23 0.00 -0.22 0.00 0.00 54.13 53.20 1xtj s LEU 262 Cb 0.00 -1.23 -0.02 0.00 0.50 0.00 0.00 46.19 45.44 1xtj s LEU 262 CO 0.00 0.14 0.74 -1.10 -1.32 0.00 0.00 176.35 174.81 1xtj s GLN 263 N 0.34 4.25 -0.11 1.98 -1.52 -1.00 -4.97 119.66 118.63 1xtj s GLN 263 Ca -0.15 0.83 0.03 0.00 -1.95 0.00 0.00 55.36 54.12 1xtj s GLN 263 Cb -0.16 -3.58 0.01 0.00 -0.22 0.00 0.00 33.01 29.05 1xtj s GLN 263 CO 0.07 -0.30 -0.19 -0.65 -0.25 0.00 0.00 175.29 173.96 1xtj s GLN 264 N 2.08 2.60 0.03 2.91 -0.21 -1.26 -0.17 119.66 125.65 1xtj s GLN 264 Ca 0.34 -0.71 -0.01 0.00 0.02 0.00 0.00 55.36 54.99 1xtj s GLN 264 Cb -0.16 -2.07 -0.03 0.00 1.00 0.00 0.00 33.01 31.75 1xtj s GLN 264 CO 0.11 0.05 -0.01 0.71 -2.12 0.00 0.00 175.29 174.03 1xtj s TYR 265 N 0.67 0.35 0.28 0.91 1.51 0.01 -3.84 117.35 117.25 1xtj s TYR 265 Ca -0.12 -0.74 0.11 0.00 -1.01 0.00 0.00 57.07 55.30 1xtj s TYR 265 Cb -0.16 -0.26 -0.05 0.00 -0.11 0.00 0.00 41.96 41.38 1xtj s TYR 265 CO 0.03 -0.29 -0.09 1.52 -1.11 0.00 0.00 175.55 175.61 1xtj s TYR 266 N -2.61 2.49 -0.18 2.71 -0.85 -0.12 -0.75 117.35 118.06 1xtj s TYR 266 Ca -0.05 -0.31 -0.03 0.00 -0.52 0.00 0.00 57.07 56.16 1xtj s TYR 266 Cb -0.02 -1.15 0.06 0.00 0.38 0.00 0.00 41.96 41.23 1xtj s TYR 266 CO -0.05 0.64 0.05 0.08 -1.52 0.00 0.00 175.55 174.75 1xtj s VAL 267 N -2.44 0.30 0.10 -3.49 1.01 -0.33 0.22 120.40 115.78 1xtj s VAL 267 Ca 0.31 -0.38 -0.31 0.00 0.00 0.00 0.00 61.98 61.61 1xtj s VAL 267 Cb -0.05 -0.84 -0.07 0.00 0.00 0.00 0.00 36.38 35.42 1xtj s VAL 267 CO 0.18 -0.21 1.28 -0.54 0.00 0.00 0.00 175.10 175.81 1xtj s LYS 268 N 1.96 4.39 0.31 2.72 1.02 -1.26 -3.12 119.74 125.76 1xtj s LYS 268 Ca 0.00 1.92 -0.18 0.00 0.02 0.00 0.00 55.97 57.73 1xtj s LYS 268 Cb -0.16 -3.29 0.03 0.00 -0.52 0.00 0.00 37.83 33.88 1xtj s LYS 268 CO -0.08 -0.32 0.71 -0.51 -0.92 0.00 0.00 175.35 174.23 1xtj s LEU 269 N 0.90 -0.10 0.37 3.17 1.43 -0.84 -4.97 118.68 118.63 1xtj s LEU 269 Ca 0.61 -0.81 0.05 0.00 -1.03 0.00 0.00 54.13 52.95 1xtj s LEU 269 Cb -0.33 2.64 -0.01 0.00 0.03 0.00 0.00 46.19 48.52 1xtj s LEU 269 CO 0.31 -1.42 0.53 -0.54 0.23 0.00 0.00 176.35 175.45 1xtj s LYS 270 N -3.47 3.09 0.25 1.70 -0.14 -1.26 -4.02 119.74 115.89 1xtj s LYS 270 Ca 0.14 -0.89 0.08 0.00 -1.36 0.00 0.00 55.97 53.94 1xtj s LYS 270 Cb -0.05 -2.75 0.29 0.00 -1.68 0.00 0.00 37.83 33.64 1xtj s LYS 270 CO 0.09 -0.04 1.58 0.22 -0.76 0.00 0.00 175.35 176.43 1xtj h ASP 271 N 0.75 0.12 0.23 2.83 -0.00 -1.94 -2.71 116.42 115.71 1xtj h ASP 271 Ca -0.46 -0.07 0.00 0.00 -0.00 0.00 0.00 57.03 56.50 1xtj h ASP 271 Cb 1.26 -0.04 0.00 0.00 -0.00 0.00 0.00 39.33 40.55 1xtj h ASP 271 CO 0.54 0.72 0.00 -0.46 -0.00 0.00 0.00 179.24 180.03 1xtj n ASN 272 N -3.82 0.00 -0.06 2.28 6.94 -1.26 -3.24 115.26 116.10 1xtj n ASN 272 Ca -0.02 -0.58 -0.03 0.00 -0.02 0.00 0.00 54.58 53.93 1xtj n ASN 272 Cb 0.63 -0.12 -0.13 0.00 -2.36 0.00 0.00 39.78 37.79 1xtj n ASN 272 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1xtj n GLU 273 N -1.12 1.07 -0.27 -3.83 1.02 -1.04 -4.71 120.64 111.76 1xtj n GLU 273 Ca 0.18 -0.05 -0.03 0.00 -0.02 0.00 0.00 57.16 57.24 1xtj n GLU 273 Cb 0.16 -1.42 0.03 0.00 -0.02 0.00 0.00 31.44 30.18 1xtj n GLU 273 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1xtj h LYS 274 N 0.00 -0.09 -0.50 3.49 1.57 -1.47 -2.68 116.57 116.88 1xtj h LYS 274 Ca -0.32 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.56 1xtj h LYS 274 Cb 1.66 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 33.92 1xtj h LYS 274 CO 0.02 -0.06 0.09 -0.91 -0.57 0.00 0.00 179.45 178.02 1xtj h ASN 275 N -0.10 -0.02 -0.68 0.86 2.35 -1.84 0.23 115.58 116.39 1xtj h ASN 275 Ca 0.28 0.09 -0.04 0.00 -0.55 0.00 0.00 56.30 56.08 1xtj h ASN 275 Cb 0.57 0.13 -0.03 0.00 0.05 0.00 0.00 38.32 39.04 1xtj h ASN 275 CO -0.79 0.02 0.25 -0.09 -1.65 0.00 0.00 177.43 175.17 1xtj h ARG 276 N 0.23 1.03 -0.35 0.81 2.43 -1.81 -0.59 114.38 116.14 1xtj h ARG 276 Ca 0.25 -0.20 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1xtj h ARG 276 Cb 0.34 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1xtj h ARG 276 CO -0.34 0.87 0.10 0.87 -1.51 0.00 0.00 179.97 179.97 1xtj h LYS 277 N 0.97 0.54 0.51 0.20 1.79 -1.16 0.74 116.57 120.17 1xtj h LYS 277 Ca 0.22 -0.12 -0.01 0.00 -2.18 0.00 0.00 60.65 58.56 1xtj h LYS 277 Cb 0.24 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.79 1xtj h LYS 277 CO -0.01 0.57 -0.48 1.25 -1.08 0.00 0.00 179.45 179.70 1xtj h LEU 278 N 0.41 -1.30 -1.44 2.94 5.85 -0.30 -0.79 115.31 120.67 1xtj h LEU 278 Ca 0.11 0.10 0.07 0.00 0.84 0.00 0.00 57.88 59.00 1xtj h LEU 278 Cb 0.26 0.42 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 1xtj h LEU 278 CO -0.00 -0.65 0.45 -0.26 -0.34 0.00 0.00 178.44 177.64 1xtj h PHE 279 N -0.99 0.69 -0.27 1.25 -1.00 -1.00 -0.63 116.94 114.98 1xtj h PHE 279 Ca -0.06 0.02 -0.12 0.00 2.81 0.00 0.00 57.97 60.62 1xtj h PHE 279 Cb 0.85 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 40.17 1xtj h PHE 279 CO -0.23 0.36 -0.32 -0.44 -1.61 0.00 0.00 178.31 176.07 1xtj h ASP 280 N 0.67 0.60 1.07 2.17 3.32 -0.55 -2.55 116.42 121.16 1xtj h ASP 280 Ca 0.30 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1xtj h ASP 280 Cb 0.30 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1xtj h ASP 280 CO -0.10 0.89 -0.03 -0.07 -1.72 0.00 0.00 179.24 178.21 1xtj h LEU 281 N 0.49 0.00 0.00 1.55 3.38 0.36 -2.51 115.31 118.58 1xtj h LEU 281 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1xtj h LEU 281 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1xtj h LEU 281 CO 0.07 0.03 -0.07 -0.07 0.09 0.00 0.00 178.44 178.49 1xtj h LEU 282 N 0.00 0.00 0.00 1.67 3.38 -0.90 -2.41 115.31 117.05 1xtj h LEU 282 Ca -0.00 -0.01 -0.29 0.00 0.09 0.00 0.00 57.88 57.67 1xtj h LEU 282 Cb 0.58 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 1xtj h LEU 282 CO 0.00 0.01 -1.79 0.47 0.09 0.00 0.00 178.44 177.22 1xtj n ASP 283 N -2.65 0.73 -0.09 -0.43 10.43 -0.98 -4.59 116.55 118.98 1xtj n ASP 283 Ca 0.05 0.35 -0.14 0.00 2.57 0.00 0.00 54.79 57.61 1xtj n ASP 283 Cb 0.48 0.13 -0.08 0.00 1.84 0.00 0.00 41.12 43.50 1xtj n ASP 283 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 1xtj h VAL 284 N 0.00 0.67 -4.16 2.53 2.07 -1.53 -3.48 116.25 112.35 1xtj h VAL 284 Ca -0.31 -1.75 -0.50 0.00 0.82 0.00 0.00 66.70 64.96 1xtj h VAL 284 Cb 2.01 1.51 0.09 0.00 -1.52 0.00 0.00 31.29 33.38 1xtj h VAL 284 CO 0.07 0.23 0.39 -0.76 0.02 0.00 0.00 177.57 177.52 1xtj s LEU 285 N -8.08 3.51 -0.06 2.57 1.43 -0.91 -5.05 118.68 112.10 1xtj s LEU 285 Ca -0.21 2.04 -0.02 0.00 -1.03 0.00 0.00 54.13 54.91 1xtj s LEU 285 Cb 0.03 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.66 1xtj s LEU 285 CO 0.44 -1.46 0.06 -1.83 0.23 0.00 0.00 176.35 173.79 1xtj s GLU 286 N -3.83 3.09 0.33 1.70 -1.05 -1.26 -4.87 118.70 112.81 1xtj s GLU 286 Ca 0.69 -0.39 -0.16 0.00 -0.15 0.00 0.00 54.97 54.96 1xtj s GLU 286 Cb -0.21 -2.89 0.06 0.00 -0.44 0.00 0.00 34.13 30.65 1xtj s GLU 286 CO 0.36 0.70 0.83 1.97 0.95 0.00 0.00 175.26 180.07 1xtj n PHE 287 N 1.74 -2.09 0.00 4.83 -1.74 -1.26 -4.93 117.46 114.01 1xtj n PHE 287 Ca -0.17 -1.67 0.00 0.00 -0.56 0.00 0.00 57.45 55.06 1xtj n PHE 287 Cb 0.54 0.83 0.00 0.00 1.52 0.00 0.00 39.48 42.36 1xtj n PHE 287 CO 0.00 0.00 0.00 0.09 -0.56 0.00 0.00 176.76 176.29 1xtj n ASN 288 N -1.46 2.89 -3.74 5.98 4.13 -1.26 -5.07 115.26 116.73 1xtj n ASN 288 Ca -0.07 0.00 -0.14 0.00 1.68 0.00 0.00 54.58 56.05 1xtj n ASN 288 Cb 0.57 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.73 1xtj n ASN 288 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1xtj s GLN 289 N -1.89 0.66 0.02 3.52 -0.21 -1.26 -4.75 119.66 115.75 1xtj s GLN 289 Ca 0.00 -0.05 0.02 0.00 0.02 0.00 0.00 55.36 55.35 1xtj s GLN 289 Cb 0.00 0.30 -0.01 0.00 1.00 0.00 0.00 33.01 34.29 1xtj s GLN 289 CO 0.00 -0.17 -0.05 0.08 -2.12 0.00 0.00 175.29 173.02 1xtj s VAL 290 N -1.07 0.39 0.12 1.09 1.01 -0.31 -1.75 120.40 119.87 1xtj s VAL 290 Ca -0.11 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 61.36 1xtj s VAL 290 Cb -0.04 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 1xtj s VAL 290 CO 0.04 -0.14 -0.13 -0.69 0.00 0.00 0.00 175.10 174.17 1xtj s VAL 291 N -0.72 3.13 -0.01 2.92 1.01 -1.09 0.76 120.40 126.41 1xtj s VAL 291 Ca -0.04 -1.43 0.02 0.00 0.00 0.00 0.00 61.98 60.52 1xtj s VAL 291 Cb -0.06 -2.47 0.00 0.00 0.00 0.00 0.00 36.38 33.86 1xtj s VAL 291 CO -0.00 0.07 -0.05 -0.63 0.00 0.00 0.00 175.10 174.49 1xtj s ILE 292 N -1.27 0.47 -0.19 2.22 1.01 0.28 -1.04 121.20 122.69 1xtj s ILE 292 Ca 0.21 -0.22 -0.02 0.00 0.00 0.00 0.00 60.65 60.62 1xtj s ILE 292 Cb -0.10 -0.42 -0.01 0.00 0.01 0.00 0.00 42.46 41.94 1xtj s ILE 292 CO 0.13 0.15 -0.08 -0.36 0.00 0.00 0.00 174.94 174.78 1xtj s PHE 293 N 0.10 2.91 0.10 3.97 0.40 0.98 -1.76 117.98 124.68 1xtj s PHE 293 Ca -0.01 -0.84 0.10 0.00 -0.60 0.00 0.00 56.93 55.58 1xtj s PHE 293 Cb -0.05 -2.00 -0.04 0.00 0.51 0.00 0.00 43.02 41.44 1xtj s PHE 293 CO -0.00 -0.42 -0.25 0.14 0.70 0.00 0.00 175.22 175.38 1xtj s VAL 294 N 1.03 2.09 0.00 -0.44 -7.23 -1.12 0.90 120.40 115.63 1xtj s VAL 294 Ca -0.00 -1.62 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 1xtj s VAL 294 Cb -0.15 -1.84 0.00 0.00 0.56 0.00 0.00 36.38 34.95 1xtj s VAL 294 CO -0.01 0.11 0.25 0.29 -0.31 0.00 0.00 175.10 175.44 1xtj n LYS 295 N 1.15 0.00 -1.81 4.82 5.02 -1.26 -4.51 118.16 121.57 1xtj n LYS 295 Ca -0.18 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.79 1xtj n LYS 295 Cb 0.53 -0.73 0.03 0.00 -0.02 0.00 0.00 35.03 34.84 1xtj n LYS 295 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1xtj s SER 296 N -1.91 5.43 0.44 4.39 1.04 -1.26 -4.89 113.70 116.93 1xtj s SER 296 Ca 0.00 1.82 0.09 0.00 0.48 0.00 0.00 55.95 58.34 1xtj s SER 296 Cb 0.00 -2.53 0.97 0.00 0.10 0.00 0.00 66.02 64.56 1xtj s SER 296 CO 0.00 -1.41 2.08 0.58 0.98 0.00 0.00 173.24 175.47 1xtj h VAL 297 N -0.03 1.08 0.34 5.02 2.07 -1.99 -1.64 116.25 121.09 1xtj h VAL 297 Ca -0.46 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 1xtj h VAL 297 Cb 1.23 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1xtj h VAL 297 CO 0.56 0.08 -0.16 -0.61 0.02 0.00 0.00 177.57 177.45 1xtj h GLN 298 N 0.41 -0.44 -0.77 1.57 4.15 -2.00 -2.30 115.11 115.74 1xtj h GLN 298 Ca 0.11 0.03 0.10 0.00 0.77 0.00 0.00 58.65 59.67 1xtj h GLN 298 Cb -0.04 0.10 -0.08 0.00 0.21 0.00 0.00 27.48 27.67 1xtj h GLN 298 CO -0.02 -0.12 0.41 0.00 -1.93 0.00 0.00 178.83 177.16 1xtj h ARG 299 N -0.79 0.65 -0.74 1.69 2.47 -1.87 -1.01 114.38 114.78 1xtj h ARG 299 Ca -0.05 -0.04 0.07 0.00 -1.26 0.00 0.00 59.98 58.71 1xtj h ARG 299 Cb 0.52 -0.15 -0.06 0.00 -1.65 0.00 0.00 29.97 28.63 1xtj h ARG 299 CO 0.08 0.43 0.42 0.00 0.56 0.00 0.00 179.97 181.45 1xtj h ILE 301 N 0.75 1.41 0.00 0.00 2.04 -0.73 -3.23 117.51 117.75 1xtj h ILE 301 Ca 0.34 -2.53 -0.07 0.00 1.00 0.00 0.00 64.86 63.60 1xtj h ILE 301 Cb 0.25 2.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.81 1xtj h ILE 301 CO -0.21 0.75 -0.33 0.00 0.00 0.00 0.00 178.15 178.36 1xtj h ALA 302 N 0.72 1.06 0.00 1.87 0.00 -0.96 -2.83 119.26 119.12 1xtj h ALA 302 Ca -0.09 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1xtj h ALA 302 Cb 1.63 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1xtj h ALA 302 CO 0.17 0.42 -0.00 1.25 0.00 0.00 0.00 179.25 181.08 1xtj h LEU 303 N 0.00 -0.00 -1.73 0.00 5.85 -1.36 -2.33 115.31 115.73 1xtj h LEU 303 Ca -0.00 -0.86 -0.00 0.00 0.84 0.00 0.00 57.88 57.86 1xtj h LEU 303 Cb 0.80 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1xtj h LEU 303 CO 0.04 0.87 0.12 0.00 -0.34 0.00 0.00 178.44 179.13 1xtj h ALA 304 N 0.09 1.80 0.68 1.25 0.00 -1.64 0.27 119.26 121.70 1xtj h ALA 304 Ca -0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1xtj h ALA 304 Cb 0.86 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1xtj h ALA 304 CO 0.00 0.17 -0.32 0.37 0.00 0.00 0.00 179.25 179.47 1xtj h GLN 305 N 0.30 -0.87 -0.89 0.00 4.15 -1.56 -0.31 115.11 115.93 1xtj h GLN 305 Ca 0.08 0.06 0.11 0.00 0.77 0.00 0.00 58.65 59.67 1xtj h GLN 305 Cb 0.01 0.20 -0.07 0.00 0.21 0.00 0.00 27.48 27.83 1xtj h GLN 305 CO -0.01 -0.55 0.57 1.25 -1.93 0.00 0.00 178.83 178.16 1xtj h LEU 306 N -1.08 0.75 -1.14 -2.39 5.85 -0.77 0.14 115.31 116.67 1xtj h LEU 306 Ca -0.09 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.59 1xtj h LEU 306 Cb 0.73 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 1xtj h LEU 306 CO 0.15 0.42 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.53 1xtj h LEU 307 N 0.82 0.49 -0.44 2.25 3.38 -0.32 -2.55 115.31 118.94 1xtj h LEU 307 Ca 0.43 -0.11 -0.17 0.00 0.09 0.00 0.00 57.88 58.11 1xtj h LEU 307 Cb 0.52 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1xtj h LEU 307 CO -0.19 0.61 -0.61 0.58 0.09 0.00 0.00 178.44 178.92 1xtj h VAL 308 N 0.48 1.33 0.00 1.22 2.07 0.11 0.83 116.25 122.28 1xtj h VAL 308 Ca 0.09 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.73 1xtj h VAL 308 Cb 0.43 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1xtj h VAL 308 CO 0.02 0.59 0.00 -0.33 0.02 0.00 0.00 177.57 177.87 1xtj h GLU 309 N 0.43 0.00 -0.36 1.57 5.08 -0.82 -1.30 114.58 119.18 1xtj h GLU 309 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1xtj h GLU 309 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1xtj h GLU 309 CO 0.12 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.17 1xtj n GLN 310 N -2.39 3.39 -2.21 2.33 1.13 -1.04 -4.97 117.38 113.62 1xtj n GLN 310 Ca 0.01 -2.83 -0.16 0.00 -1.94 0.00 0.00 57.00 52.08 1xtj n GLN 310 Cb 0.20 -1.88 -0.01 0.00 0.11 0.00 0.00 30.24 28.66 1xtj n GLN 310 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1xtj n ASN 311 N -0.05 -4.69 -4.71 1.08 3.02 -0.49 -5.02 115.26 104.39 1xtj n ASN 311 Ca 0.22 0.03 -0.37 0.00 -0.03 0.00 0.00 54.58 54.43 1xtj n ASN 311 Cb 0.91 -3.80 -0.07 0.00 -0.61 0.00 0.00 39.78 36.21 1xtj n ASN 311 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1xtj s PHE 312 N -2.76 3.45 -0.71 3.10 0.40 0.27 -4.99 117.98 116.75 1xtj s PHE 312 Ca 0.00 0.66 -0.18 0.00 -0.60 0.00 0.00 56.93 56.80 1xtj s PHE 312 Cb 0.00 -2.42 -0.15 0.00 0.51 0.00 0.00 43.02 40.96 1xtj s PHE 312 CO 0.00 0.17 1.90 -0.35 0.70 0.00 0.00 175.22 177.64 1xtj n PRO 313 N 3.78 1.44 -4.54 0.24 -0.04 -1.26 -4.00 135.00 130.63 1xtj n PRO 313 Ca -0.10 -1.63 -0.34 0.00 -0.04 0.00 0.00 63.50 61.39 1xtj n PRO 313 Cb 0.52 -2.74 -0.12 0.00 -0.04 0.00 0.00 33.50 31.12 1xtj n PRO 313 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xtj s ALA 314 N 4.81 2.99 0.11 0.55 0.00 -1.26 -1.26 121.76 127.70 1xtj s ALA 314 Ca 0.52 -0.86 0.08 0.00 0.00 0.00 0.00 51.96 51.70 1xtj s ALA 314 Cb 0.13 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 1xtj s ALA 314 CO 0.10 0.43 -0.20 -1.50 0.00 0.00 0.00 175.76 174.58 1xtj s ILE 315 N -0.32 1.72 0.26 0.00 2.07 -0.93 -4.77 121.20 119.22 1xtj s ILE 315 Ca 0.05 -1.61 0.10 0.00 -1.41 0.00 0.00 60.65 57.78 1xtj s ILE 315 Cb -0.12 -1.60 -0.04 0.00 0.13 0.00 0.00 42.46 40.82 1xtj s ILE 315 CO 0.02 -0.11 -0.03 0.00 -1.91 0.00 0.00 174.94 172.91 1xtj s ALA 316 N -1.33 3.10 -0.25 1.50 0.00 -1.26 -1.66 121.76 121.87 1xtj s ALA 316 Ca 0.08 -1.67 -0.03 0.00 0.00 0.00 0.00 51.96 50.34 1xtj s ALA 316 Cb -0.09 -0.71 0.14 0.00 0.00 0.00 0.00 23.12 22.45 1xtj s ALA 316 CO 0.05 0.28 0.43 0.42 0.00 0.00 0.00 175.76 176.94 1xtj s ILE 317 N -2.31 -0.69 0.45 0.00 1.01 -0.58 -4.93 121.20 114.14 1xtj s ILE 317 Ca 0.31 -0.02 0.06 0.00 0.00 0.00 0.00 60.65 60.99 1xtj s ILE 317 Cb -0.06 -0.83 -0.05 0.00 0.01 0.00 0.00 42.46 41.53 1xtj s ILE 317 CO 0.19 -0.07 0.10 -1.38 0.00 0.00 0.00 174.94 173.78 1xtj s HIS 318 N 2.62 2.32 0.47 3.97 -3.43 -1.26 -1.78 115.29 118.20 1xtj s HIS 318 Ca 0.12 -0.72 0.26 0.00 -0.80 0.00 0.00 55.06 53.92 1xtj s HIS 318 Cb -0.15 -1.81 1.50 0.00 -1.43 0.00 0.00 32.58 30.69 1xtj s HIS 318 CO -0.16 0.23 2.11 -0.09 -2.00 0.00 0.00 174.74 174.84 1xtj h ARG 319 N 1.47 0.00 -0.02 -0.38 2.43 -1.96 -2.96 114.38 112.97 1xtj h ARG 319 Ca -0.43 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.53 1xtj h ARG 319 Cb 1.27 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.82 1xtj h ARG 319 CO 0.74 0.09 -0.88 0.78 -1.51 0.00 0.00 179.97 179.19 1xtj h GLY 320 N 0.57 0.44 -4.52 2.80 0.00 -1.98 -3.46 103.07 96.92 1xtj h GLY 320 Ca -0.00 -0.73 -0.58 0.00 0.00 0.00 0.00 47.33 46.02 1xtj h GLY 320 CO 0.01 0.65 0.61 1.03 0.00 0.00 0.00 176.54 178.84 1xtj n MET 321 N -3.76 2.11 -2.06 4.80 2.81 -1.12 -4.95 117.12 114.95 1xtj n MET 321 Ca -0.06 0.75 -0.35 0.00 -1.81 0.00 0.00 57.70 56.23 1xtj n MET 321 Cb 0.80 -2.40 0.02 0.00 -0.71 0.00 0.00 33.22 30.93 1xtj n MET 321 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1xtj s PRO 322 N -0.71 3.07 0.17 0.03 0.04 -1.26 -4.78 135.00 131.56 1xtj s PRO 322 Ca 0.65 1.70 -0.21 0.00 0.04 0.00 0.00 61.00 63.18 1xtj s PRO 322 Cb -0.62 -1.96 0.09 0.00 0.04 0.00 0.00 34.50 32.05 1xtj s PRO 322 CO 0.52 -1.09 1.61 0.37 0.04 0.00 0.00 177.00 178.45 1xtj h GLN 323 N 0.88 -0.19 -0.75 4.56 4.15 -1.97 -1.30 115.11 120.49 1xtj h GLN 323 Ca -0.50 0.01 0.22 0.00 0.77 0.00 0.00 58.65 59.15 1xtj h GLN 323 Cb 1.28 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.98 1xtj h GLN 323 CO 0.55 -0.12 0.68 0.93 -1.93 0.00 0.00 178.83 178.94 1xtj h GLU 324 N -0.19 0.00 0.06 1.69 3.07 -1.98 0.11 114.58 117.34 1xtj h GLU 324 Ca 0.19 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 58.74 1xtj h GLU 324 Cb 0.49 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.37 1xtj h GLU 324 CO -0.52 0.00 -1.69 1.49 -1.40 0.00 0.00 179.01 176.89 1xtj h GLU 325 N 0.00 0.13 -0.14 2.33 4.81 -1.62 -3.22 114.58 116.87 1xtj h GLU 325 Ca 0.36 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 59.33 1xtj h GLU 325 Cb 1.71 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 31.17 1xtj h GLU 325 CO -0.00 0.86 -0.07 0.00 -0.73 0.00 0.00 179.01 179.07 1xtj h ARG 326 N 0.04 0.20 0.00 1.92 3.08 -0.24 -1.86 114.38 117.52 1xtj h ARG 326 Ca -0.29 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 59.67 1xtj h ARG 326 Cb 2.00 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 32.01 1xtj h ARG 326 CO 0.11 0.29 -0.36 -0.07 -1.07 0.00 0.00 179.97 178.87 1xtj h LEU 327 N 0.20 0.00 -0.14 3.04 3.38 -1.51 -1.46 115.31 118.82 1xtj h LEU 327 Ca 0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1xtj h LEU 327 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1xtj h LEU 327 CO 0.01 0.23 -0.26 0.28 0.09 0.00 0.00 178.44 178.80 1xtj h SER 328 N 0.00 0.47 1.02 -0.43 0.02 -1.36 -2.15 113.55 111.11 1xtj h SER 328 Ca -0.01 -0.55 -0.17 0.00 -0.84 0.00 0.00 61.79 60.22 1xtj h SER 328 Cb 1.19 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 1xtj h SER 328 CO 0.03 0.93 -0.79 0.03 -1.14 0.00 0.00 176.83 175.89 1xtj h ARG 329 N 0.03 0.00 0.00 3.45 3.08 -1.51 -2.96 114.38 116.46 1xtj h ARG 329 Ca 0.01 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1xtj h ARG 329 Cb 0.85 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 1xtj h ARG 329 CO 0.06 0.79 -0.30 -0.92 -1.07 0.00 0.00 179.97 178.53 1xtj h TYR 330 N 0.00 0.00 -0.10 3.04 3.20 -1.27 -2.89 116.97 118.95 1xtj h TYR 330 Ca -0.01 0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.65 1xtj h TYR 330 Cb 1.51 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.79 1xtj h TYR 330 CO 0.00 0.30 -0.79 0.37 -1.64 0.00 0.00 178.16 176.40 1xtj h GLN 331 N 0.00 0.61 0.00 1.82 5.75 -1.23 -1.25 115.11 120.81 1xtj h GLN 331 Ca -0.00 -0.52 0.00 0.00 -0.15 0.00 0.00 58.65 57.98 1xtj h GLN 331 Cb 0.81 0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.48 1xtj h GLN 331 CO 0.04 1.14 0.00 1.04 -2.65 0.00 0.00 178.83 178.40 1xtj n GLN 332 N -3.88 0.13 -0.05 1.69 6.02 -1.10 0.08 117.38 120.27 1xtj n GLN 332 Ca -0.06 0.13 -0.01 0.00 -0.01 0.00 0.00 57.00 57.05 1xtj n GLN 332 Cb 0.75 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 30.38 1xtj n GLN 332 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1xtj n PHE 333 N -1.40 0.00 0.04 1.08 7.35 -1.08 0.02 117.46 123.47 1xtj n PHE 333 Ca 0.07 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.61 1xtj n PHE 333 Cb 0.20 -0.61 -0.14 0.00 0.35 0.00 0.00 39.48 39.28 1xtj n PHE 333 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 1xtj h LYS 334 N 0.00 0.19 0.00 -4.13 3.64 -0.93 -3.22 116.57 112.12 1xtj h LYS 334 Ca -0.25 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 58.80 1xtj h LYS 334 Cb 1.46 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.40 1xtj h LYS 334 CO 0.01 1.01 0.00 -3.47 -2.27 0.00 0.00 179.45 174.73 1xtj n ASP 335 N -3.38 0.52 0.00 4.20 2.03 0.11 -4.84 116.55 115.19 1xtj n ASP 335 Ca -0.18 0.65 0.00 0.00 0.52 0.00 0.00 54.79 55.78 1xtj n ASP 335 Cb 1.04 -0.75 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 1xtj n ASP 335 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1xtj n PHE 336 N -2.10 0.00 -0.05 -0.67 7.35 -1.22 -4.90 117.46 115.87 1xtj n PHE 336 Ca 0.02 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.62 1xtj n PHE 336 Cb 0.17 -0.39 -0.02 0.00 0.35 0.00 0.00 39.48 39.59 1xtj n PHE 336 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 1xtj h GLN 337 N 0.82 0.16 -6.22 -4.13 4.15 -1.65 -3.42 115.11 104.82 1xtj h GLN 337 Ca 0.00 -0.01 -0.56 0.00 0.77 0.00 0.00 58.65 58.85 1xtj h GLN 337 Cb 0.19 -0.04 -0.07 0.00 0.21 0.00 0.00 27.48 27.77 1xtj h GLN 337 CO 0.00 0.10 -0.58 1.03 -1.93 0.00 0.00 178.83 177.46 1xtj s ARG 338 N -6.18 2.79 -0.18 1.69 1.81 0.10 -5.03 118.95 113.96 1xtj s ARG 338 Ca -0.13 -0.98 0.15 0.00 -1.72 0.00 0.00 55.73 53.05 1xtj s ARG 338 Cb 0.10 -2.55 -0.22 0.00 -0.45 0.00 0.00 34.95 31.83 1xtj s ARG 338 CO 0.69 0.45 0.05 0.54 -0.68 0.00 0.00 175.30 176.35 1xtj n ARG 339 N -0.53 1.06 -5.05 3.54 1.74 -0.39 -4.68 116.66 112.36 1xtj n ARG 339 Ca -0.08 -0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.67 1xtj n ARG 339 Cb 0.56 -1.46 -0.15 0.00 -1.02 0.00 0.00 32.46 30.39 1xtj n ARG 339 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xtj s ILE 340 N -2.43 2.63 -0.11 0.55 1.01 -0.90 -1.16 121.20 120.78 1xtj s ILE 340 Ca -0.10 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 59.71 1xtj s ILE 340 Cb 0.05 -2.00 0.00 0.00 0.01 0.00 0.00 42.46 40.52 1xtj s ILE 340 CO 0.72 0.58 -0.23 -0.22 0.00 0.00 0.00 174.94 175.78 1xtj s LEU 341 N -0.43 2.08 -0.58 2.97 2.96 0.23 -2.20 118.68 123.71 1xtj s LEU 341 Ca 0.05 -0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 53.32 1xtj s LEU 341 Cb -0.12 -1.40 0.15 0.00 0.50 0.00 0.00 46.19 45.32 1xtj s LEU 341 CO 0.02 0.14 0.44 -0.69 -1.32 0.00 0.00 176.35 174.93 1xtj s VAL 342 N 0.46 4.18 0.17 1.68 1.01 -0.66 -0.56 120.40 126.69 1xtj s VAL 342 Ca -0.16 -2.37 0.04 0.00 0.00 0.00 0.00 61.98 59.49 1xtj s VAL 342 Cb -0.17 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1xtj s VAL 342 CO 0.06 -0.85 0.26 0.00 0.00 0.00 0.00 175.10 174.57 1xtj s ALA 343 N 0.60 3.84 -0.17 5.51 0.00 -0.72 -1.53 121.76 129.30 1xtj s ALA 343 Ca 0.12 -1.13 0.12 0.00 0.00 0.00 0.00 51.96 51.07 1xtj s ALA 343 Cb -0.21 -1.64 -0.19 0.00 0.00 0.00 0.00 23.12 21.08 1xtj s ALA 343 CO -0.04 0.46 0.02 -2.37 0.00 0.00 0.00 175.76 173.84 1xtj n THR 344 N -0.68 1.12 -3.93 0.00 5.66 -0.73 -2.80 114.28 112.93 1xtj n THR 344 Ca -0.08 -0.65 -0.06 0.00 -3.05 0.00 0.00 64.05 60.22 1xtj n THR 344 Cb 0.55 -0.67 -0.01 0.00 -1.55 0.00 0.00 70.33 68.65 1xtj n THR 344 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1xtj n ASN 345 N -2.68 1.91 0.00 1.09 3.02 -1.26 -4.82 115.26 112.52 1xtj n ASN 345 Ca -0.28 -1.41 0.00 0.00 -0.03 0.00 0.00 54.58 52.86 1xtj n ASN 345 Cb 1.00 0.04 0.00 0.00 -0.61 0.00 0.00 39.78 40.21 1xtj n ASN 345 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1xtj n LEU 346 N 0.00 0.00 0.00 3.41 4.32 -1.26 -5.07 117.00 118.40 1xtj n LEU 346 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.96 1xtj n LEU 346 Cb 0.12 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.92 1xtj n LEU 346 CO 0.07 0.00 0.00 -0.67 -1.22 0.00 0.00 177.39 175.57 1xtj n ASP 352 N 0.00 0.00 0.05 -1.43 2.03 -1.26 -4.40 116.55 111.54 1xtj n ASP 352 Ca 0.00 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.18 1xtj n ASP 352 Cb 0.00 -0.02 -0.06 0.00 -0.72 0.00 0.00 41.12 40.32 1xtj n ASP 352 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1xtj h ILE 353 N 0.00 0.19 -3.19 5.18 2.04 -1.98 -3.25 117.51 116.49 1xtj h ILE 353 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1xtj h ILE 353 Cb 0.00 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.27 1xtj h ILE 353 CO 0.00 0.00 -0.03 -0.62 0.00 0.00 0.00 178.15 177.50 1xtj n GLU 354 N -5.44 -0.17 -0.10 2.37 1.02 -1.26 -4.29 120.64 112.78 1xtj n GLU 354 Ca -0.05 0.62 0.07 0.00 -0.02 0.00 0.00 57.16 57.78 1xtj n GLU 354 Cb 0.36 -1.85 0.25 0.00 -0.02 0.00 0.00 31.44 30.18 1xtj n GLU 354 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1xtj n ARG 355 N -0.69 1.56 -2.55 3.49 0.63 -1.26 -4.83 116.66 113.01 1xtj n ARG 355 Ca 0.01 -0.86 -0.41 0.00 -0.92 0.00 0.00 57.85 55.67 1xtj n ARG 355 Cb 0.20 -1.27 -0.04 0.00 0.45 0.00 0.00 32.46 31.80 1xtj n ARG 355 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1xtj s VAL 356 N -1.74 4.08 -0.09 5.15 1.01 -1.26 -4.06 120.40 123.48 1xtj s VAL 356 Ca 0.23 1.70 0.14 0.00 0.00 0.00 0.00 61.98 64.05 1xtj s VAL 356 Cb 0.12 -4.09 -0.20 0.00 0.00 0.00 0.00 36.38 32.21 1xtj s VAL 356 CO 0.18 0.25 0.17 0.59 0.00 0.00 0.00 175.10 176.28 1xtj n ASN 357 N 2.83 1.47 -3.97 3.32 3.02 -0.72 -4.94 115.26 116.26 1xtj n ASN 357 Ca 0.04 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.37 1xtj n ASN 357 Cb 0.47 1.19 -0.16 0.00 -0.61 0.00 0.00 39.78 40.67 1xtj n ASN 357 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xtj s ILE 358 N -2.64 0.86 -0.10 2.41 1.01 -1.24 -1.26 121.20 120.24 1xtj s ILE 358 Ca -0.07 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.26 1xtj s ILE 358 Cb 0.06 -0.81 -0.02 0.00 0.01 0.00 0.00 42.46 41.71 1xtj s ILE 358 CO 0.61 0.29 -0.13 0.00 0.00 0.00 0.00 174.94 175.71 1xtj s ALA 359 N 0.66 2.68 -0.00 9.38 0.00 0.20 -2.66 121.76 132.03 1xtj s ALA 359 Ca -0.12 -0.92 0.06 0.00 0.00 0.00 0.00 51.96 50.99 1xtj s ALA 359 Cb -0.14 -1.15 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 1xtj s ALA 359 CO 0.02 0.38 -0.20 -0.06 0.00 0.00 0.00 175.76 175.90 1xtj s PHE 360 N -0.12 2.52 -0.64 0.00 0.40 -0.20 -1.76 117.98 118.17 1xtj s PHE 360 Ca -0.01 -0.29 -0.02 0.00 -0.60 0.00 0.00 56.93 56.02 1xtj s PHE 360 Cb -0.14 -1.51 0.16 0.00 0.51 0.00 0.00 43.02 42.04 1xtj s PHE 360 CO 0.03 0.15 0.46 -0.80 0.70 0.00 0.00 175.22 175.76 1xtj s ASN 361 N -1.00 5.17 0.30 1.36 0.01 -0.95 -0.01 114.94 119.82 1xtj s ASN 361 Ca 0.12 -3.00 0.05 0.00 -0.71 0.00 0.00 52.86 49.32 1xtj s ASN 361 Cb -0.10 -1.83 0.72 0.00 0.41 0.00 0.00 41.25 40.45 1xtj s ASN 361 CO 0.02 -0.32 1.75 0.22 -1.51 0.00 0.00 177.10 177.25 1xtj h TYR 362 N 6.80 0.91 -3.74 2.20 3.20 0.21 -2.16 116.97 124.39 1xtj h TYR 362 Ca 0.00 0.04 -0.29 0.00 3.14 0.00 0.00 58.73 61.62 1xtj h TYR 362 Cb 0.92 -0.26 -0.29 0.00 1.54 0.00 0.00 36.73 38.64 1xtj h TYR 362 CO 0.69 0.13 -0.74 0.16 -1.64 0.00 0.00 178.16 176.77 1xtj s ASP 363 N -5.33 0.30 0.19 -2.11 1.47 -0.98 -4.52 116.67 105.70 1xtj s ASP 363 Ca -0.11 -0.04 -0.25 0.00 1.18 0.00 0.00 52.55 53.33 1xtj s ASP 363 Cb 0.25 -0.07 -0.15 0.00 -0.34 0.00 0.00 42.92 42.61 1xtj s ASP 363 CO 0.79 0.00 0.44 0.80 0.68 0.00 0.00 175.17 177.89 1xtj n MET 364 N 3.27 0.00 -2.68 2.11 0.00 -1.24 -4.73 117.12 113.84 1xtj n MET 364 Ca -0.16 0.00 -0.33 0.00 -0.00 0.00 0.00 57.70 57.22 1xtj n MET 364 Cb 0.57 -0.90 -0.06 0.00 0.00 0.00 0.00 33.22 32.83 1xtj n MET 364 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1xtj s PRO 365 N -0.90 4.14 0.39 2.12 0.04 -1.26 -4.93 135.00 134.59 1xtj s PRO 365 Ca 0.57 1.06 0.22 0.00 0.04 0.00 0.00 61.00 62.89 1xtj s PRO 365 Cb -0.82 -2.17 1.27 0.00 0.04 0.00 0.00 34.50 32.82 1xtj s PRO 365 CO 0.51 -0.11 1.63 0.93 0.04 0.00 0.00 177.00 180.00 1xtj h GLU 366 N 1.59 0.16 -2.63 4.56 5.08 -1.96 -3.45 114.58 117.93 1xtj h GLU 366 Ca -0.48 -0.01 0.12 0.00 -1.00 0.00 0.00 59.36 57.99 1xtj h GLU 366 Cb 1.18 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 1xtj h GLU 366 CO 0.61 0.11 0.45 0.16 -1.00 0.00 0.00 179.01 179.34 1xtj s ASP 367 N -4.68 -0.08 0.21 1.42 1.47 -1.26 -5.03 116.67 108.72 1xtj s ASP 367 Ca -0.09 -0.69 -0.14 0.00 1.18 0.00 0.00 52.55 52.80 1xtj s ASP 367 Cb 0.31 0.60 0.23 0.00 -0.34 0.00 0.00 42.92 43.72 1xtj s ASP 367 CO 0.80 -1.16 1.62 0.28 0.68 0.00 0.00 175.17 177.39 1xtj h SER 368 N 2.00 -0.70 -0.30 2.11 0.02 -1.87 -2.31 113.55 112.50 1xtj h SER 368 Ca -0.27 0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1xtj h SER 368 Cb 1.23 0.43 -0.01 0.00 0.14 0.00 0.00 62.40 64.19 1xtj h SER 368 CO 0.32 -0.23 0.15 0.44 -1.14 0.00 0.00 176.83 176.38 1xtj h ASP 369 N -0.03 0.38 -0.99 3.07 3.32 -1.98 -2.33 116.42 117.86 1xtj h ASP 369 Ca 0.30 -0.11 0.13 0.00 0.02 0.00 0.00 57.03 57.37 1xtj h ASP 369 Cb 0.49 -0.10 -0.09 0.00 0.22 0.00 0.00 39.33 39.86 1xtj h ASP 369 CO -0.67 0.38 0.62 0.74 -1.72 0.00 0.00 179.24 178.59 1xtj h THR 370 N 0.36 0.88 0.18 0.35 2.02 -1.83 0.22 112.91 115.09 1xtj h THR 370 Ca 0.10 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 1xtj h THR 370 Cb 0.09 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.37 1xtj h THR 370 CO -0.01 0.17 -0.09 0.22 0.37 0.00 0.00 175.52 176.17 1xtj h TYR 371 N 0.93 -0.24 -0.85 3.16 3.20 -1.15 0.92 116.97 122.95 1xtj h TYR 371 Ca 0.50 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.39 1xtj h TYR 371 Cb 0.57 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.87 1xtj h TYR 371 CO -0.00 -0.15 0.56 1.25 -1.64 0.00 0.00 178.16 178.18 1xtj h LEU 372 N -0.25 0.94 -0.00 2.82 5.85 -0.57 -0.78 115.31 123.32 1xtj h LEU 372 Ca -0.02 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1xtj h LEU 372 Cb 0.20 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1xtj h LEU 372 CO 0.03 0.66 -0.12 1.41 -0.34 0.00 0.00 178.44 180.08 1xtj n HIS 373 N -4.43 0.00 -0.11 1.25 8.25 0.60 -2.80 115.22 117.99 1xtj n HIS 373 Ca 0.11 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.34 1xtj n HIS 373 Cb 0.07 -0.44 -0.10 0.00 1.12 0.00 0.00 29.99 30.65 1xtj n HIS 373 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1xtj n ARG 374 N -1.50 0.56 -0.08 -0.41 1.74 0.28 -4.80 116.66 112.45 1xtj n ARG 374 Ca 0.07 0.45 -0.16 0.00 -0.77 0.00 0.00 57.85 57.44 1xtj n ARG 374 Cb 0.34 -1.64 -0.11 0.00 -1.02 0.00 0.00 32.46 30.03 1xtj n ARG 374 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1xtj h VAL 375 N -1.00 1.20 -0.29 1.55 2.07 -1.30 -3.47 116.25 115.00 1xtj h VAL 375 Ca -0.43 -2.10 -0.67 0.00 0.82 0.00 0.00 66.70 64.32 1xtj h VAL 375 Cb 1.33 2.46 -0.05 0.00 -1.52 0.00 0.00 31.29 33.52 1xtj h VAL 375 CO -0.26 0.41 1.46 0.00 0.02 0.00 0.00 177.57 179.20 1xtj n ALA 376 N -3.02 0.44 -2.60 1.67 0.00 -1.12 -4.88 120.51 111.00 1xtj n ALA 376 Ca -0.18 -0.03 -0.43 0.00 0.00 0.00 0.00 53.44 52.80 1xtj n ALA 376 Cb 0.52 -2.27 -0.02 0.00 0.00 0.00 0.00 19.45 17.67 1xtj n ALA 376 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1xtj s ARG 377 N 6.90 3.69 -0.36 0.00 0.52 -1.26 -4.80 118.95 123.64 1xtj s ARG 377 Ca 1.21 0.52 0.04 0.00 -0.52 0.00 0.00 55.73 56.98 1xtj s ARG 377 Cb -1.25 -3.92 0.32 0.00 0.52 0.00 0.00 34.95 30.62 1xtj s ARG 377 CO 0.56 -1.42 1.30 0.00 0.02 0.00 0.00 175.30 175.77 1xtj n ALA 378 N 7.91 -2.56 -0.09 2.13 0.00 -1.26 -4.90 120.51 121.74 1xtj n ALA 378 Ca 0.12 -0.68 -0.17 0.00 0.00 0.00 0.00 53.44 52.70 1xtj n ALA 378 Cb 0.49 -2.60 -0.06 0.00 0.00 0.00 0.00 19.45 17.28 1xtj n ALA 378 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xtj n GLY 379 N 0.61 -0.39 0.00 0.00 0.00 -1.26 -4.99 105.19 99.17 1xtj n GLY 379 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1xtj n GLY 379 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xtj n ARG 380 N -4.10 0.00 -1.46 1.61 5.12 -1.23 -4.93 116.66 111.67 1xtj n ARG 380 Ca -0.31 0.00 -0.44 0.00 -1.93 0.00 0.00 57.85 55.18 1xtj n ARG 380 Cb 0.65 0.00 -0.01 0.00 -1.16 0.00 0.00 32.46 31.94 1xtj n ARG 380 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1xtj n PHE 381 N 0.00 -0.17 -3.38 -1.55 3.01 -1.26 -4.90 117.46 109.20 1xtj n PHE 381 Ca 0.00 0.72 -0.41 0.00 1.01 0.00 0.00 57.45 58.77 1xtj n PHE 381 Cb 0.00 -2.03 -0.09 0.00 -0.01 0.00 0.00 39.48 37.35 1xtj n PHE 381 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1xtj s GLY 382 N -0.87 1.89 0.00 1.37 0.00 -1.26 -4.87 107.32 103.59 1xtj s GLY 382 Ca 0.62 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 44.15 1xtj s GLY 382 CO 0.58 1.02 0.00 -1.30 0.00 0.00 0.00 173.10 173.41 1xtj n THR 383 N 5.26 0.00 -1.55 0.90 -2.24 -1.26 -5.19 114.28 110.20 1xtj n THR 383 Ca -0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1xtj n THR 383 Cb 0.49 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 1xtj n THR 383 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1xtj n LYS 384 N 0.00 3.74 0.00 -0.78 5.02 -1.26 -5.01 118.16 119.87 1xtj n LYS 384 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1xtj n LYS 384 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1xtj n LYS 384 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xtj n GLY 385 N 5.00 -0.99 2.87 0.72 0.00 -1.22 -4.93 105.19 106.63 1xtj n GLY 385 Ca 0.00 -1.05 -0.20 0.00 0.00 0.00 0.00 46.02 44.76 1xtj n GLY 385 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xtj s LEU 386 N 0.00 1.18 -0.20 0.99 2.96 -0.39 -2.37 118.68 120.85 1xtj s LEU 386 Ca 0.00 -0.12 -0.00 0.00 -0.22 0.00 0.00 54.13 53.79 1xtj s LEU 386 Cb 0.00 -0.44 0.05 0.00 0.50 0.00 0.00 46.19 46.30 1xtj s LEU 386 CO 0.00 -0.08 -0.05 0.00 -1.32 0.00 0.00 176.35 174.90 1xtj s ALA 387 N 1.13 1.65 -0.16 5.97 0.00 0.76 0.60 121.76 131.70 1xtj s ALA 387 Ca -0.08 -1.03 -0.01 0.00 0.00 0.00 0.00 51.96 50.84 1xtj s ALA 387 Cb -0.14 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 21.72 1xtj s ALA 387 CO -0.01 -0.97 -0.12 0.42 0.00 0.00 0.00 175.76 175.09 1xtj s ILE 388 N 1.55 2.98 -0.03 0.00 1.01 -0.72 -0.81 121.20 125.17 1xtj s ILE 388 Ca -0.02 -0.66 0.05 0.00 0.00 0.00 0.00 60.65 60.02 1xtj s ILE 388 Cb -0.17 -2.28 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 1xtj s ILE 388 CO -0.07 0.50 -0.18 -0.89 0.00 0.00 0.00 174.94 174.30 1xtj s THR 389 N 0.81 2.76 0.12 2.92 2.01 0.08 -2.24 115.64 122.10 1xtj s THR 389 Ca -0.04 -0.88 -0.00 0.00 0.31 0.00 0.00 61.69 61.08 1xtj s THR 389 Cb -0.15 -2.06 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 1xtj s THR 389 CO 0.01 0.56 0.28 -0.36 -0.69 0.00 0.00 174.62 174.42 1xtj s PHE 390 N -0.72 3.50 -0.07 4.92 2.99 -0.81 -1.18 117.98 126.60 1xtj s PHE 390 Ca 0.11 0.27 -0.04 0.00 0.00 0.00 0.00 56.93 57.28 1xtj s PHE 390 Cb -0.10 -1.79 0.03 0.00 0.00 0.00 0.00 43.02 41.16 1xtj s PHE 390 CO 0.01 0.51 0.16 0.08 -0.00 0.00 0.00 175.22 175.98 1xtj s VAL 391 N -1.65 -0.04 0.00 -0.44 1.01 -1.18 -3.61 120.40 114.49 1xtj s VAL 391 Ca 0.36 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1xtj s VAL 391 Cb -0.12 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 36.01 1xtj s VAL 391 CO 0.28 0.06 0.39 -1.20 0.00 0.00 0.00 175.10 174.63 1xtj n SER 392 N 3.97 0.74 -3.01 3.32 7.64 -1.26 -1.99 113.62 123.03 1xtj n SER 392 Ca -0.24 -1.09 -0.08 0.00 1.01 0.00 0.00 58.87 58.48 1xtj n SER 392 Cb 0.53 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.76 1xtj n SER 392 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1xtj s ASP 393 N -0.09 0.01 0.42 6.43 1.47 -1.26 -4.87 116.67 118.77 1xtj s ASP 393 Ca 0.00 -1.05 0.28 0.00 1.18 0.00 0.00 52.55 52.96 1xtj s ASP 393 Cb 0.00 0.78 0.95 0.00 -0.34 0.00 0.00 42.92 44.31 1xtj s ASP 393 CO 0.00 -1.55 1.81 1.05 0.68 0.00 0.00 175.17 177.16 1xtj h GLU 394 N 2.00 0.00 -0.23 2.11 4.11 -1.99 -2.36 114.58 118.22 1xtj h GLU 394 Ca -0.31 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.08 1xtj h GLU 394 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1xtj h GLU 394 CO 0.40 0.00 -0.01 -0.91 0.07 0.00 0.00 179.01 178.56 1xtj h ASN 395 N 0.00 0.41 -0.36 3.06 2.35 -1.99 0.13 115.58 119.18 1xtj h ASN 395 Ca 0.00 -0.32 -0.04 0.00 -0.55 0.00 0.00 56.30 55.39 1xtj h ASN 395 Cb 0.64 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1xtj h ASN 395 CO 0.00 0.64 0.06 0.44 -1.65 0.00 0.00 177.43 176.92 1xtj h ASP 396 N 0.18 0.57 -0.16 5.81 3.32 -1.93 -2.79 116.42 121.42 1xtj h ASP 396 Ca 0.06 -0.26 0.05 0.00 0.02 0.00 0.00 57.03 56.91 1xtj h ASP 396 Cb 0.43 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.77 1xtj h ASP 396 CO 0.01 0.68 -0.22 0.00 -1.72 0.00 0.00 179.24 177.99 1xtj h ALA 397 N 0.91 -0.16 -0.70 3.45 0.00 -1.20 -1.50 119.26 120.05 1xtj h ALA 397 Ca 0.11 0.05 0.14 0.00 0.00 0.00 0.00 54.91 55.21 1xtj h ALA 397 Cb 0.36 0.45 -0.10 0.00 0.00 0.00 0.00 17.79 18.49 1xtj h ALA 397 CO 0.01 -0.67 0.19 -0.22 0.00 0.00 0.00 179.25 178.55 1xtj h LYS 398 N -0.27 0.29 -0.76 0.00 3.64 -0.64 -0.48 116.57 118.36 1xtj h LYS 398 Ca 0.11 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.42 1xtj h LYS 398 Cb 0.43 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1xtj h LYS 398 CO -0.32 0.19 0.26 0.82 -2.27 0.00 0.00 179.45 178.14 1xtj h ILE 399 N 0.30 1.26 0.00 2.00 2.04 -1.08 -2.12 117.51 119.91 1xtj h ILE 399 Ca 0.39 -0.88 -0.11 0.00 1.00 0.00 0.00 64.86 65.25 1xtj h ILE 399 Cb 0.62 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1xtj h ILE 399 CO -0.46 0.35 -0.54 0.25 0.00 0.00 0.00 178.15 177.75 1xtj h LEU 400 N 1.12 0.00 -0.64 1.44 5.85 -0.32 -2.80 115.31 119.96 1xtj h LEU 400 Ca 0.25 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.82 1xtj h LEU 400 Cb 0.28 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1xtj h LEU 400 CO -0.01 0.54 -0.56 0.78 -0.34 0.00 0.00 178.44 178.85 1xtj h ASN 401 N 0.00 0.39 0.51 1.25 2.35 -0.77 -2.43 115.58 116.88 1xtj h ASN 401 Ca -0.01 -0.21 -0.07 0.00 -0.55 0.00 0.00 56.30 55.46 1xtj h ASN 401 Cb 1.02 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 1xtj h ASN 401 CO 0.07 0.87 -0.36 0.44 -1.65 0.00 0.00 177.43 176.81 1xtj h ASP 402 N 0.27 0.00 -0.43 5.81 3.32 -1.20 -1.55 116.42 122.63 1xtj h ASP 402 Ca 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1xtj h ASP 402 Cb 1.07 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 1xtj h ASP 402 CO 0.09 0.36 -0.22 0.58 -1.72 0.00 0.00 179.24 178.33 1xtj h VAL 403 N 0.00 1.27 -0.01 -1.35 2.07 -1.21 0.26 116.25 117.28 1xtj h VAL 403 Ca -0.00 -1.37 -0.13 0.00 0.82 0.00 0.00 66.70 66.01 1xtj h VAL 403 Cb 0.71 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1xtj h VAL 403 CO 0.05 0.47 -0.60 1.56 0.02 0.00 0.00 177.57 179.06 1xtj h GLN 404 N 0.82 0.03 0.00 1.57 4.20 -0.96 -2.78 115.11 117.99 1xtj h GLN 404 Ca 0.11 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.76 1xtj h GLN 404 Cb 0.78 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.56 1xtj h GLN 404 CO 0.06 0.63 -0.19 -0.44 -0.67 0.00 0.00 178.83 178.22 1xtj h ASP 405 N 0.02 0.00 0.04 1.46 3.32 -1.08 -3.09 116.42 117.09 1xtj h ASP 405 Ca -0.01 -0.75 -0.00 0.00 0.02 0.00 0.00 57.03 56.29 1xtj h ASP 405 Cb 1.08 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.62 1xtj h ASP 405 CO 0.08 0.99 -0.04 0.03 -1.72 0.00 0.00 179.24 178.58 1xtj h ARG 406 N -1.00 -0.07 -5.87 3.56 2.47 -0.58 -3.33 114.38 109.56 1xtj h ARG 406 Ca -0.05 0.01 -0.61 0.00 -1.26 0.00 0.00 59.98 58.07 1xtj h ARG 406 Cb 0.88 0.02 -0.11 0.00 -1.65 0.00 0.00 29.97 29.11 1xtj h ARG 406 CO -0.03 -0.05 0.44 -0.06 0.56 0.00 0.00 179.97 180.83 1xtj s PHE 407 N -3.22 3.11 -0.70 3.04 0.40 -1.05 -4.91 117.98 114.65 1xtj s PHE 407 Ca -0.01 0.62 -0.23 0.00 -0.60 0.00 0.00 56.93 56.71 1xtj s PHE 407 Cb 0.00 -3.46 -0.19 0.00 0.51 0.00 0.00 43.02 39.89 1xtj s PHE 407 CO 0.05 -0.75 1.88 0.39 0.70 0.00 0.00 175.22 177.49 1xtj n GLU 408 N 6.51 1.29 -4.54 0.44 1.02 -1.25 -4.17 120.64 119.93 1xtj n GLU 408 Ca 0.04 -1.77 -0.25 0.00 -0.02 0.00 0.00 57.16 55.16 1xtj n GLU 408 Cb 0.48 -2.93 -0.10 0.00 -0.02 0.00 0.00 31.44 28.87 1xtj n GLU 408 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1xtj s VAL 409 N 5.88 1.39 0.10 2.62 1.01 -1.17 -5.07 120.40 125.16 1xtj s VAL 409 Ca 0.60 -2.00 0.10 0.00 0.00 0.00 0.00 61.98 60.68 1xtj s VAL 409 Cb 0.13 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1xtj s VAL 409 CO 0.15 0.00 -0.26 0.21 0.00 0.00 0.00 175.10 175.20 1xtj s ASN 410 N -3.61 3.22 -0.27 3.32 2.47 -1.26 -4.58 114.94 114.22 1xtj s ASN 410 Ca 0.31 -0.69 -0.04 0.00 0.42 0.00 0.00 52.86 52.87 1xtj s ASN 410 Cb 0.08 -0.24 0.09 0.00 -1.45 0.00 0.00 41.25 39.73 1xtj s ASN 410 CO 0.15 0.20 0.12 -0.63 -3.72 0.00 0.00 177.10 173.22 1xtj s ILE 411 N -0.97 -0.01 0.59 -5.21 1.01 -1.26 -4.76 121.20 110.60 1xtj s ILE 411 Ca 0.13 -0.69 -0.02 0.00 0.00 0.00 0.00 60.65 60.07 1xtj s ILE 411 Cb -0.10 -0.95 0.04 0.00 0.01 0.00 0.00 42.46 41.46 1xtj s ILE 411 CO 0.04 -0.64 0.85 -0.94 0.00 0.00 0.00 174.94 174.26 1xtj s SER 412 N 2.07 5.20 0.56 3.58 1.04 -1.25 -4.67 113.70 120.24 1xtj s SER 412 Ca 0.08 0.21 -0.20 0.00 0.48 0.00 0.00 55.95 56.52 1xtj s SER 412 Cb -0.16 -1.06 -0.05 0.00 0.10 0.00 0.00 66.02 64.85 1xtj s SER 412 CO -0.31 -1.24 1.18 -0.70 0.98 0.00 0.00 173.24 173.15 1xtj s GLU 413 N -4.91 3.22 0.29 4.02 2.12 -1.26 -0.94 118.70 121.23 1xtj s GLU 413 Ca 0.57 1.76 -0.30 0.00 0.36 0.00 0.00 54.97 57.37 1xtj s GLU 413 Cb -0.10 -2.03 -0.11 0.00 0.26 0.00 0.00 34.13 32.15 1xtj s GLU 413 CO 0.41 -0.99 1.51 -1.17 -0.54 0.00 0.00 175.26 174.47 1xtj s LEU 414 N -3.82 4.36 0.00 2.70 2.96 0.13 -4.70 118.68 120.32 1xtj s LEU 414 Ca 0.74 2.85 0.00 0.00 -0.22 0.00 0.00 54.13 57.49 1xtj s LEU 414 Cb -0.28 -3.64 0.00 0.00 0.50 0.00 0.00 46.19 42.77 1xtj s LEU 414 CO 0.32 -0.81 0.00 -0.81 -1.32 0.00 0.00 176.35 173.72 1xtj n PRO 415 N 1.95 0.00 -0.59 0.98 -0.04 -1.26 -5.01 135.00 131.03 1xtj n PRO 415 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1xtj n PRO 415 Cb 0.39 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.85 1xtj n PRO 415 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1xtj n ASP 416 N 0.00 -0.79 0.00 3.54 2.03 -1.26 -5.11 116.55 114.96 1xtj n ASP 416 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1xtj n ASP 416 Cb 0.00 -0.39 0.00 0.00 -0.72 0.00 0.00 41.12 40.01 1xtj n ASP 416 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1xtj n GLU 417 N -0.25 0.00 0.00 -0.67 2.13 -1.26 -4.82 120.64 115.77 1xtj n GLU 417 Ca 0.00 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.86 1xtj n GLU 417 Cb 0.05 -0.03 -0.01 0.00 0.27 0.00 0.00 31.44 31.73 1xtj n GLU 417 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1xtj n ILE 418 N 0.00 0.00 0.00 6.31 5.41 -1.26 -4.95 119.36 124.87 1xtj n ILE 418 Ca 0.00 -0.40 0.00 0.00 1.00 0.00 0.00 62.75 63.35 1xtj n ILE 418 Cb 0.00 1.06 0.00 0.00 -0.71 0.00 0.00 39.64 39.99 1xtj n ILE 418 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1xtj n ASP 419 N -0.55 0.00 0.00 4.38 8.00 -1.26 -5.15 116.55 121.97 1xtj n ASP 419 Ca 0.03 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.53 1xtj n ASP 419 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 1xtj n ASP 419 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1xtj n ILE 420 N 0.00 0.00 0.00 0.53 -0.00 -1.26 -4.94 119.36 113.69 1xtj n ILE 420 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1xtj n ILE 420 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 1xtj n ILE 420 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 1xtj n SER 421 N 0.00 0.00 0.00 7.28 3.41 -1.26 -4.31 113.62 118.74 1xtj n SER 421 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1xtj n SER 421 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1xtj n SER 421 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1xtj n SER 422 N 0.00 0.79 0.00 4.04 2.88 -1.26 -4.90 113.62 115.17 1xtj n SER 422 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1xtj n SER 422 Cb 0.00 0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 1xtj n SER 422 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81