#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a05 s LYS 2 N 0.00 2.83 -0.16 2.12 1.02 -1.22 -5.01 119.74 119.33 1a05 s LYS 2 Ca 0.00 -0.62 -0.11 0.00 0.02 0.00 0.00 55.97 55.26 1a05 s LYS 2 Cb 0.00 -2.54 -0.05 0.00 -0.52 0.00 0.00 37.83 34.72 1a05 s LYS 2 CO 0.00 0.55 0.21 0.15 -0.92 0.00 0.00 175.35 175.33 1a05 s LYS 3 N -0.51 4.03 -0.14 1.68 1.02 -1.26 -0.69 119.74 123.88 1a05 s LYS 3 Ca 0.07 -0.05 0.01 0.00 0.02 0.00 0.00 55.97 56.02 1a05 s LYS 3 Cb -0.12 -3.36 0.02 0.00 -0.52 0.00 0.00 37.83 33.85 1a05 s LYS 3 CO 0.02 0.41 -0.16 0.42 -0.92 0.00 0.00 175.35 175.11 1a05 s ILE 4 N -0.00 1.69 -0.24 2.17 1.01 0.13 -0.15 121.20 125.81 1a05 s ILE 4 Ca 0.13 -0.72 -0.16 0.00 0.00 0.00 0.00 60.65 59.90 1a05 s ILE 4 Cb -0.12 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 1a05 s ILE 4 CO 0.02 0.48 0.40 0.00 0.00 0.00 0.00 174.94 175.84 1a05 s ALA 5 N 1.25 3.57 -0.20 9.38 0.00 -0.35 -1.58 121.76 133.83 1a05 s ALA 5 Ca 0.01 -0.66 -0.06 0.00 0.00 0.00 0.00 51.96 51.25 1a05 s ALA 5 Cb -0.14 -2.70 -0.03 0.00 0.00 0.00 0.00 23.12 20.26 1a05 s ALA 5 CO -0.08 -0.50 0.03 0.42 0.00 0.00 0.00 175.76 175.63 1a05 s ILE 6 N 1.75 4.28 -0.46 0.00 1.01 0.24 -1.01 121.20 127.01 1a05 s ILE 6 Ca 0.18 -0.20 0.03 0.00 0.00 0.00 0.00 60.65 60.65 1a05 s ILE 6 Cb -0.15 -2.95 0.13 0.00 0.01 0.00 0.00 42.46 39.50 1a05 s ILE 6 CO 0.09 0.42 0.24 -0.36 0.00 0.00 0.00 174.94 175.32 1a05 s PHE 7 N 0.92 2.49 0.29 3.97 0.08 0.11 -0.03 117.98 125.80 1a05 s PHE 7 Ca 0.02 -2.72 -0.02 0.00 0.12 0.00 0.00 56.93 54.34 1a05 s PHE 7 Cb -0.14 -2.28 0.42 0.00 -0.57 0.00 0.00 43.02 40.46 1a05 s PHE 7 CO 0.02 -0.77 1.96 0.00 -0.10 0.00 0.00 175.22 176.33 1a05 h ALA 8 N 6.70 1.40 -0.06 5.36 0.00 -1.80 -1.45 119.26 129.42 1a05 h ALA 8 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1a05 h ALA 8 Cb 0.92 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1a05 h ALA 8 CO 0.56 0.55 0.00 0.41 0.00 0.00 0.00 179.25 180.77 1a05 n GLY 9 N -1.40 -0.04 3.91 0.00 0.00 -1.26 -2.91 105.19 103.49 1a05 n GLY 9 Ca 0.10 -1.02 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 1a05 n GLY 9 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a05 s ASP 10 N -4.00 5.36 1.79 1.61 1.01 0.72 -4.46 116.67 118.71 1a05 s ASP 10 Ca 0.00 -0.54 0.00 0.00 0.71 0.00 0.00 52.55 52.72 1a05 s ASP 10 Cb 0.00 -0.78 0.00 0.00 1.01 0.00 0.00 42.92 43.15 1a05 s ASP 10 CO 0.00 -0.57 0.00 0.61 0.21 0.00 0.00 175.17 175.42 1a05 n GLY 11 N -1.58 3.50 0.04 0.21 0.00 -1.26 -1.24 105.19 104.86 1a05 n GLY 11 Ca 0.03 0.24 0.14 0.00 0.00 0.00 0.00 46.02 46.43 1a05 n GLY 11 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1a05 n ILE 12 N 0.00 0.00 -0.09 -0.61 -5.35 -0.70 -4.21 119.36 108.41 1a05 n ILE 12 Ca 0.00 -0.02 -0.06 0.00 -0.27 0.00 0.00 62.75 62.40 1a05 n ILE 12 Cb 0.00 -0.31 0.00 0.00 -1.74 0.00 0.00 39.64 37.59 1a05 n ILE 12 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1a05 h GLY 13 N 4.99 0.14 0.88 3.28 0.00 -1.35 -0.60 103.07 110.41 1a05 h GLY 13 Ca 0.00 0.17 0.06 0.00 0.00 0.00 0.00 47.33 47.56 1a05 h GLY 13 CO 0.00 -0.16 0.60 -2.55 0.00 0.00 0.00 176.54 174.43 1a05 h PRO 14 N -0.08 1.05 0.03 4.80 0.11 -1.74 -2.00 132.00 134.17 1a05 h PRO 14 Ca 0.17 -0.06 -0.22 0.00 0.11 0.00 0.00 66.00 65.99 1a05 h PRO 14 Cb 0.33 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.18 1a05 h PRO 14 CO -0.38 0.70 -1.05 1.05 -0.21 0.00 0.00 178.00 178.11 1a05 h GLU 15 N 1.08 0.06 0.00 1.05 4.11 -1.74 -2.87 114.58 116.28 1a05 h GLU 15 Ca 0.39 -0.11 -0.12 0.00 0.07 0.00 0.00 59.36 59.59 1a05 h GLU 15 Cb 0.14 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1a05 h GLU 15 CO -0.14 1.04 -0.57 -0.84 0.07 0.00 0.00 179.01 178.58 1a05 h ILE 16 N 0.02 1.04 0.00 -1.06 3.07 -0.96 -2.67 117.51 116.95 1a05 h ILE 16 Ca -0.04 -2.28 -0.18 0.00 1.55 0.00 0.00 64.86 63.91 1a05 h ILE 16 Cb 1.80 2.38 -0.03 0.00 -0.27 0.00 0.00 36.82 40.70 1a05 h ILE 16 CO 0.15 0.55 -0.89 0.58 -1.05 0.00 0.00 178.15 177.49 1a05 h VAL 17 N 0.00 1.41 -0.27 0.16 2.07 -1.45 -2.05 116.25 116.12 1a05 h VAL 17 Ca -0.01 -3.02 -0.10 0.00 0.82 0.00 0.00 66.70 64.40 1a05 h VAL 17 Cb 1.34 2.69 -0.01 0.00 -1.52 0.00 0.00 31.29 33.79 1a05 h VAL 17 CO 0.07 0.80 -0.21 0.00 0.02 0.00 0.00 177.57 178.25 1a05 h ALA 18 N 1.16 0.39 0.07 1.67 0.00 -1.45 0.43 119.26 121.52 1a05 h ALA 18 Ca -0.02 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1a05 h ALA 18 Cb 1.66 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1a05 h ALA 18 CO 0.11 0.34 -0.03 0.00 0.00 0.00 0.00 179.25 179.66 1a05 h ALA 19 N 0.71 -0.09 -0.52 0.00 0.00 -1.52 -1.30 119.26 116.53 1a05 h ALA 19 Ca 0.05 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1a05 h ALA 19 Cb 0.76 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1a05 h ALA 19 CO 0.06 -0.50 0.35 0.00 0.00 0.00 0.00 179.25 179.16 1a05 h ALA 20 N 0.73 1.76 -0.32 0.00 0.00 -1.29 -1.19 119.26 118.96 1a05 h ALA 20 Ca -0.01 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1a05 h ALA 20 Cb 0.17 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1a05 h ALA 20 CO 0.01 0.18 -0.11 0.00 0.00 0.00 0.00 179.25 179.34 1a05 h ARG 21 N 0.59 0.54 -0.53 0.00 3.08 0.55 -0.93 114.38 117.68 1a05 h ARG 21 Ca 0.21 -0.15 0.06 0.00 0.07 0.00 0.00 59.98 60.16 1a05 h ARG 21 Cb 0.11 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.06 1a05 h ARG 21 CO -0.06 0.65 0.25 1.96 -1.07 0.00 0.00 179.97 181.70 1a05 h GLN 22 N 0.50 0.46 -0.38 0.04 4.20 -0.10 -0.41 115.11 119.42 1a05 h GLN 22 Ca 0.09 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.65 1a05 h GLN 22 Cb 0.49 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1a05 h GLN 22 CO 0.03 0.30 -0.27 0.28 -0.67 0.00 0.00 178.83 178.51 1a05 h VAL 23 N 0.47 1.28 -0.38 -0.54 2.07 -1.32 -2.25 116.25 115.58 1a05 h VAL 23 Ca 0.24 -1.42 -0.03 0.00 0.82 0.00 0.00 66.70 66.30 1a05 h VAL 23 Cb 0.19 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1a05 h VAL 23 CO -0.19 0.47 0.10 0.25 0.02 0.00 0.00 177.57 178.23 1a05 h LEU 24 N 0.67 0.57 -0.74 2.57 6.46 -0.87 -2.11 115.31 121.86 1a05 h LEU 24 Ca 0.08 -0.22 -0.04 0.00 -0.12 0.00 0.00 57.88 57.58 1a05 h LEU 24 Cb 0.84 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.59 1a05 h LEU 24 CO 0.07 0.64 0.32 0.44 -0.62 0.00 0.00 178.44 179.29 1a05 h ASP 25 N 0.47 1.00 -0.36 1.25 3.32 -1.10 0.24 116.42 121.24 1a05 h ASP 25 Ca 0.12 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 1a05 h ASP 25 Cb 0.29 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1a05 h ASP 25 CO -0.00 0.88 0.06 0.00 -1.72 0.00 0.00 179.24 178.47 1a05 h ALA 26 N 1.16 1.28 0.14 3.45 0.00 -1.28 -1.33 119.26 122.68 1a05 h ALA 26 Ca 0.25 -0.20 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 1a05 h ALA 26 Cb 0.18 -0.18 0.03 0.00 0.00 0.00 0.00 17.79 17.81 1a05 h ALA 26 CO -0.02 0.49 -1.04 0.28 0.00 0.00 0.00 179.25 178.96 1a05 h VAL 27 N 0.66 1.39 -0.39 0.00 2.07 -1.03 -2.85 116.25 116.10 1a05 h VAL 27 Ca 0.14 -2.48 0.02 0.00 0.82 0.00 0.00 66.70 65.20 1a05 h VAL 27 Cb 0.32 2.94 -0.03 0.00 -1.52 0.00 0.00 31.29 33.00 1a05 h VAL 27 CO 0.01 0.73 0.23 -0.78 0.02 0.00 0.00 177.57 177.77 1a05 h ASP 28 N -0.04 0.38 -0.06 0.57 3.58 -0.38 0.19 116.42 120.66 1a05 h ASP 28 Ca -0.17 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.28 1a05 h ASP 28 Cb 1.78 -0.08 -0.00 0.00 1.72 0.00 0.00 39.33 42.75 1a05 h ASP 28 CO 0.20 0.27 0.01 1.56 -2.88 0.00 0.00 179.24 178.40 1a05 h GLN 29 N 0.47 0.09 -0.29 0.28 1.08 -1.36 0.45 115.11 115.83 1a05 h GLN 29 Ca 0.15 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.31 1a05 h GLN 29 Cb -0.00 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 1a05 h GLN 29 CO -0.07 0.30 0.12 0.00 -0.95 0.00 0.00 178.83 178.24 1a05 h ALA 30 N 0.79 0.38 0.00 3.87 0.00 -1.38 -3.09 119.26 119.82 1a05 h ALA 30 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1a05 h ALA 30 Cb 0.25 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1a05 h ALA 30 CO 0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 179.25 179.01 1a05 h ALA 31 N 0.96 0.88 -5.34 0.00 0.00 -0.65 -3.48 119.26 111.63 1a05 h ALA 31 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.73 1a05 h ALA 31 Cb 0.18 0.00 0.17 0.00 0.00 0.00 0.00 17.79 18.13 1a05 h ALA 31 CO -0.01 0.00 -0.74 0.72 0.00 0.00 0.00 179.25 179.22 1a05 n HIS 32 N -2.66 -2.11 0.22 0.00 -0.00 0.15 -4.93 115.22 105.88 1a05 n HIS 32 Ca 0.04 0.85 0.11 0.00 -0.00 0.00 0.00 57.72 58.72 1a05 n HIS 32 Cb 0.49 -4.58 0.26 0.00 -0.00 0.00 0.00 29.99 26.16 1a05 n HIS 32 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 1a05 h LEU 33 N -1.51 0.00 -1.95 2.41 3.38 -1.67 -3.48 115.31 112.48 1a05 h LEU 33 Ca -0.55 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.08 1a05 h LEU 33 Cb 1.31 0.00 0.15 0.00 0.09 0.00 0.00 40.66 42.21 1a05 h LEU 33 CO 0.44 0.10 -0.81 0.61 0.09 0.00 0.00 178.44 178.87 1a05 n GLY 34 N 0.85 -0.58 3.83 0.83 0.00 -1.26 -4.58 105.19 104.28 1a05 n GLY 34 Ca 0.03 0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.92 1a05 n GLY 34 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a05 s LEU 35 N -6.19 4.42 -0.33 0.99 1.43 -1.26 -3.37 118.68 114.37 1a05 s LEU 35 Ca 0.14 1.17 -0.03 0.00 -1.03 0.00 0.00 54.13 54.38 1a05 s LEU 35 Cb -0.02 -3.11 0.06 0.00 0.03 0.00 0.00 46.19 43.15 1a05 s LEU 35 CO 0.76 0.18 0.07 -0.60 0.23 0.00 0.00 176.35 176.98 1a05 s ARG 36 N -1.58 2.38 -0.12 1.70 6.06 0.13 -4.98 118.95 122.54 1a05 s ARG 36 Ca 0.34 -1.37 -0.06 0.00 -2.50 0.00 0.00 55.73 52.14 1a05 s ARG 36 Cb -0.17 -3.34 -0.04 0.00 0.06 0.00 0.00 34.95 31.47 1a05 s ARG 36 CO 0.19 -0.73 0.09 0.00 -2.50 0.00 0.00 175.30 172.34 1a05 s THR 38 N -0.71 0.89 -0.09 0.00 -4.23 -0.61 -4.98 115.64 105.90 1a05 s THR 38 Ca 0.12 -0.87 -0.02 0.00 -1.18 0.00 0.00 61.69 59.75 1a05 s THR 38 Cb -0.12 -0.82 -0.03 0.00 1.34 0.00 0.00 72.50 72.87 1a05 s THR 38 CO 0.03 -0.04 -0.01 -1.61 -0.54 0.00 0.00 174.62 172.45 1a05 s GLU 39 N -1.02 3.02 0.35 3.99 2.02 -1.26 0.83 118.70 126.63 1a05 s GLU 39 Ca -0.00 -0.44 0.04 0.00 0.02 0.00 0.00 54.97 54.59 1a05 s GLU 39 Cb -0.07 -2.78 -0.03 0.00 0.10 0.00 0.00 34.13 31.35 1a05 s GLU 39 CO 0.01 0.65 0.16 0.20 0.02 0.00 0.00 175.26 176.30 1a05 s GLY 40 N -0.74 2.31 -0.07 -1.39 0.00 0.95 -4.92 107.32 103.46 1a05 s GLY 40 Ca 0.11 -1.63 -0.01 0.00 0.00 0.00 0.00 44.72 43.19 1a05 s GLY 40 CO 0.02 -1.66 0.00 1.08 0.00 0.00 0.00 173.10 172.54 1a05 s LEU 41 N -3.46 3.56 -0.02 0.66 1.43 -1.26 -4.37 118.68 115.22 1a05 s LEU 41 Ca 0.32 0.12 -0.16 0.00 -1.03 0.00 0.00 54.13 53.38 1a05 s LEU 41 Cb 0.04 -1.85 0.03 0.00 0.03 0.00 0.00 46.19 44.44 1a05 s LEU 41 CO 0.18 0.36 0.34 0.54 0.23 0.00 0.00 176.35 178.01 1a05 s VAL 42 N -0.91 0.05 0.00 -1.59 0.11 -1.26 -4.63 120.40 112.17 1a05 s VAL 42 Ca 0.14 -0.43 0.00 0.00 -2.93 0.00 0.00 61.98 58.77 1a05 s VAL 42 Cb -0.11 -0.65 0.00 0.00 -1.53 0.00 0.00 36.38 34.09 1a05 s VAL 42 CO 0.03 -0.23 0.00 0.61 -3.33 0.00 0.00 175.10 172.18 1a05 n GLY 43 N 1.26 0.51 0.25 6.54 0.00 0.14 -3.49 105.19 110.41 1a05 n GLY 43 Ca -0.21 -0.87 0.09 0.00 0.00 0.00 0.00 46.02 45.03 1a05 n GLY 43 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1a05 h GLY 44 N 0.00 0.00 1.06 -0.02 0.00 -1.88 -0.82 103.07 101.40 1a05 h GLY 44 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 1a05 h GLY 44 CO 0.00 0.00 0.23 0.00 0.00 0.00 0.00 176.54 176.77 1a05 h ALA 45 N 1.90 0.98 -0.03 3.60 0.00 -1.85 0.13 119.26 124.00 1a05 h ALA 45 Ca -0.00 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.52 1a05 h ALA 45 Cb 0.20 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1a05 h ALA 45 CO 0.01 0.67 -0.69 0.00 0.00 0.00 0.00 179.25 179.25 1a05 h ALA 46 N 1.12 0.80 0.02 0.00 0.00 -1.30 -2.56 119.26 117.34 1a05 h ALA 46 Ca 0.24 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1a05 h ALA 46 Cb 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1a05 h ALA 46 CO -0.01 0.81 -0.01 -0.07 0.00 0.00 0.00 179.25 179.97 1a05 h LEU 47 N 0.09 -0.02 -1.96 0.00 3.38 -0.71 1.02 115.31 117.11 1a05 h LEU 47 Ca -0.01 -0.39 0.08 0.00 0.09 0.00 0.00 57.88 57.64 1a05 h LEU 47 Cb 1.22 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 1a05 h LEU 47 CO 0.10 0.38 0.22 0.44 0.09 0.00 0.00 178.44 179.67 1a05 h ASP 48 N -0.43 0.05 0.09 -0.43 3.32 -0.73 0.93 116.42 119.21 1a05 h ASP 48 Ca -0.00 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.68 1a05 h ASP 48 Cb 0.41 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.90 1a05 h ASP 48 CO 0.00 0.03 -2.24 0.00 -1.72 0.00 0.00 179.24 175.31 1a05 n ALA 49 N -2.58 1.32 -0.46 3.45 0.00 -0.97 -4.74 120.51 116.52 1a05 n ALA 49 Ca 0.04 -0.98 0.00 0.00 0.00 0.00 0.00 53.44 52.50 1a05 n ALA 49 Cb 0.35 -0.36 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1a05 n ALA 49 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1a05 n SER 50 N -3.18 0.56 -3.37 0.00 7.64 0.35 -5.01 113.62 110.61 1a05 n SER 50 Ca -0.36 -1.01 -0.24 0.00 1.01 0.00 0.00 58.87 58.27 1a05 n SER 50 Cb 1.05 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 64.30 1a05 n SER 50 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1a05 n ASP 51 N -0.01 -6.07 -3.65 6.43 2.03 0.32 -4.92 116.55 110.69 1a05 n ASP 51 Ca 0.00 -0.44 -0.04 0.00 0.52 0.00 0.00 54.79 54.83 1a05 n ASP 51 Cb 0.12 -4.84 -0.05 0.00 -0.72 0.00 0.00 41.12 35.63 1a05 n ASP 51 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1a05 s ASP 52 N -3.03 -1.05 0.59 1.67 -1.08 -1.24 -4.94 116.67 107.60 1a05 s ASP 52 Ca 0.47 1.55 0.37 0.00 -0.52 0.00 0.00 52.55 54.41 1a05 s ASP 52 Cb -0.21 1.90 1.84 0.00 -1.46 0.00 0.00 42.92 44.99 1a05 s ASP 52 CO 0.58 -0.23 2.17 1.55 0.52 0.00 0.00 175.17 179.76 1a05 h PRO 53 N 7.57 0.00 -1.71 4.34 0.13 -1.76 -3.18 132.00 137.39 1a05 h PRO 53 Ca -0.23 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.47 1a05 h PRO 53 Cb 1.16 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.99 1a05 h PRO 53 CO 0.13 0.03 -0.81 -0.11 -0.23 0.00 0.00 178.00 177.00 1a05 n LEU 54 N -3.23 -1.49 -4.61 1.56 -0.00 -1.26 -0.68 117.00 107.29 1a05 n LEU 54 Ca -0.02 -3.90 -0.36 0.00 -0.00 0.00 0.00 56.01 51.74 1a05 n LEU 54 Cb 0.19 0.65 0.09 0.00 -0.00 0.00 0.00 43.42 44.34 1a05 n LEU 54 CO 0.25 1.92 0.52 -2.65 -0.00 0.00 0.00 177.39 177.43 1a05 n PRO 55 N 2.57 0.50 -0.15 1.96 -0.02 -1.26 -4.72 135.00 133.88 1a05 n PRO 55 Ca 0.23 0.22 0.16 0.00 -2.02 0.00 0.00 63.50 62.10 1a05 n PRO 55 Cb 0.52 -2.21 0.52 0.00 -0.02 0.00 0.00 33.50 32.31 1a05 n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1a05 h ALA 56 N -0.26 2.15 -0.65 3.55 0.00 -1.99 -0.64 119.26 121.41 1a05 h ALA 56 Ca -0.47 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 1a05 h ALA 56 Cb 1.33 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1a05 h ALA 56 CO 0.47 -0.35 0.13 0.00 0.00 0.00 0.00 179.25 179.50 1a05 h ALA 57 N 1.65 0.86 -0.41 0.00 0.00 -1.99 -1.30 119.26 118.07 1a05 h ALA 57 Ca 0.36 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 1a05 h ALA 57 Cb 0.87 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1a05 h ALA 57 CO -0.11 0.60 -0.21 0.77 0.00 0.00 0.00 179.25 180.30 1a05 h SER 58 N 0.97 0.82 -0.47 0.00 0.02 -1.45 -2.04 113.55 111.40 1a05 h SER 58 Ca 0.20 -0.29 -0.10 0.00 -0.84 0.00 0.00 61.79 60.76 1a05 h SER 58 Cb 0.40 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1a05 h SER 58 CO 0.01 1.01 -0.08 0.25 -1.14 0.00 0.00 176.83 176.87 1a05 h LEU 59 N 0.70 0.89 -0.90 5.07 6.46 -1.07 -2.07 115.31 124.40 1a05 h LEU 59 Ca 0.10 -0.35 -0.11 0.00 -0.12 0.00 0.00 57.88 57.40 1a05 h LEU 59 Cb 0.73 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.40 1a05 h LEU 59 CO 0.06 1.03 -0.47 0.06 -0.62 0.00 0.00 178.44 178.49 1a05 h GLN 60 N 0.74 0.18 -0.35 1.25 3.07 -1.14 0.93 115.11 119.80 1a05 h GLN 60 Ca 0.12 -0.10 -0.05 0.00 0.09 0.00 0.00 58.65 58.72 1a05 h GLN 60 Cb 0.62 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.17 1a05 h GLN 60 CO 0.04 0.62 0.04 1.25 0.09 0.00 0.00 178.83 180.87 1a05 h LEU 61 N 0.15 0.57 -0.70 0.06 5.85 -1.25 -1.00 115.31 118.98 1a05 h LEU 61 Ca 0.01 -0.28 -0.11 0.00 0.84 0.00 0.00 57.88 58.34 1a05 h LEU 61 Cb 0.89 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 1a05 h LEU 61 CO 0.07 0.70 -0.21 0.00 -0.34 0.00 0.00 178.44 178.66 1a05 h ALA 62 N 0.88 0.89 0.00 1.25 0.00 -1.14 -2.18 119.26 118.96 1a05 h ALA 62 Ca 0.10 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 1a05 h ALA 62 Cb 0.39 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1a05 h ALA 62 CO 0.01 0.63 -0.34 0.52 0.00 0.00 0.00 179.25 180.07 1a05 h MET 63 N 0.68 0.00 0.00 0.00 2.86 -0.64 -3.05 114.93 114.78 1a05 h MET 63 Ca 0.10 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.62 1a05 h MET 63 Cb 0.72 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.36 1a05 h MET 63 CO 0.06 0.34 -0.87 0.00 1.06 0.00 0.00 176.91 177.50 1a05 h ALA 64 N 1.66 0.67 -2.38 6.32 0.00 -0.91 -3.48 119.26 121.14 1a05 h ALA 64 Ca -0.00 -0.54 -0.48 0.00 0.00 0.00 0.00 54.91 53.89 1a05 h ALA 64 Cb 0.72 0.07 0.13 0.00 0.00 0.00 0.00 17.79 18.71 1a05 h ALA 64 CO 0.04 0.65 0.29 0.00 0.00 0.00 0.00 179.25 180.23 1a05 s ALA 65 N -3.00 1.91 -0.14 0.00 0.00 -0.84 -4.93 121.76 114.76 1a05 s ALA 65 Ca 0.01 -0.15 0.12 0.00 0.00 0.00 0.00 51.96 51.94 1a05 s ALA 65 Cb 0.08 -3.14 -0.23 0.00 0.00 0.00 0.00 23.12 19.82 1a05 s ALA 65 CO 0.77 -2.04 0.28 -0.25 0.00 0.00 0.00 175.76 174.52 1a05 n ASP 66 N -3.65 0.77 -3.80 0.00 8.00 0.79 -4.92 116.55 113.73 1a05 n ASP 66 Ca 0.07 0.15 -0.12 0.00 0.71 0.00 0.00 54.79 55.60 1a05 n ASP 66 Cb 0.56 0.26 -0.11 0.00 -0.02 0.00 0.00 41.12 41.80 1a05 n ASP 66 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a05 s ALA 67 N -2.54 -0.53 -0.05 2.24 0.00 -1.02 -3.82 121.76 116.05 1a05 s ALA 67 Ca -0.12 0.49 0.05 0.00 0.00 0.00 0.00 51.96 52.37 1a05 s ALA 67 Cb 0.07 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 1a05 s ALA 67 CO 0.79 -0.13 -0.19 0.08 0.00 0.00 0.00 175.76 176.32 1a05 s VAL 68 N -0.22 2.67 -0.13 0.00 1.01 0.26 -1.21 120.40 122.77 1a05 s VAL 68 Ca -0.03 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.11 1a05 s VAL 68 Cb -0.03 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.35 1a05 s VAL 68 CO 0.01 0.58 -0.22 -0.63 0.00 0.00 0.00 175.10 174.84 1a05 s ILE 69 N -0.59 2.07 -0.04 2.22 1.01 -0.18 0.78 121.20 126.47 1a05 s ILE 69 Ca 0.09 -0.98 0.04 0.00 0.00 0.00 0.00 60.65 59.79 1a05 s ILE 69 Cb -0.11 -1.82 -0.00 0.00 0.01 0.00 0.00 42.46 40.54 1a05 s ILE 69 CO 0.01 0.55 -0.16 -0.22 0.00 0.00 0.00 174.94 175.12 1a05 s LEU 70 N 0.73 1.89 0.00 2.97 0.20 0.01 0.04 118.68 124.52 1a05 s LEU 70 Ca -0.09 -0.32 0.00 0.00 0.69 0.00 0.00 54.13 54.40 1a05 s LEU 70 Cb -0.16 -0.90 0.00 0.00 -0.43 0.00 0.00 46.19 44.70 1a05 s LEU 70 CO -0.00 0.14 0.00 0.61 -0.29 0.00 0.00 176.35 176.81 1a05 n GLY 71 N 3.16 0.25 3.52 7.98 0.00 -0.55 -4.14 105.19 115.43 1a05 n GLY 71 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 1a05 n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a05 s ALA 72 N -3.52 -1.80 0.01 4.61 0.00 -1.14 -4.23 121.76 115.69 1a05 s ALA 72 Ca 0.00 1.30 0.03 0.00 0.00 0.00 0.00 51.96 53.29 1a05 s ALA 72 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 1a05 s ALA 72 CO 0.00 -0.40 -0.08 0.14 0.00 0.00 0.00 175.76 175.41 1a05 s VAL 73 N -1.48 0.63 0.00 0.00 -7.23 -1.26 -0.20 120.40 110.87 1a05 s VAL 73 Ca -0.07 -0.61 0.00 0.00 -1.81 0.00 0.00 61.98 59.49 1a05 s VAL 73 Cb -0.00 -0.58 0.00 0.00 0.56 0.00 0.00 36.38 36.36 1a05 s VAL 73 CO 0.05 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.44 1a05 n GLY 74 N 2.38 3.27 0.00 2.32 0.00 -1.26 -4.47 105.19 107.42 1a05 n GLY 74 Ca -0.16 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1a05 n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a05 n GLY 75 N -0.94 3.52 0.27 -0.02 0.00 -1.26 -4.64 105.19 102.11 1a05 n GLY 75 Ca 0.00 -0.66 0.18 0.00 0.00 0.00 0.00 46.02 45.54 1a05 n GLY 75 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a05 h PRO 76 N 0.00 0.00 -0.55 1.61 0.13 -2.02 -2.92 132.00 128.25 1a05 h PRO 76 Ca 0.00 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.24 1a05 h PRO 76 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 1a05 h PRO 76 CO 0.00 0.00 0.38 0.00 -0.23 0.00 0.00 178.00 178.15 1a05 h ARG 77 N 0.00 0.28 -0.57 0.86 3.08 -2.05 -2.47 114.38 113.53 1a05 h ARG 77 Ca 0.00 -0.02 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 1a05 h ARG 77 Cb 0.11 -0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.01 1a05 h ARG 77 CO 0.00 0.19 0.14 0.91 -1.07 0.00 0.00 179.97 180.14 1a05 n TRP 78 N -4.46 1.90 0.21 3.04 8.01 -1.10 -4.46 117.44 120.58 1a05 n TRP 78 Ca 0.09 -1.15 0.08 0.00 -1.31 0.00 0.00 57.50 55.21 1a05 n TRP 78 Cb 0.41 -0.56 0.46 0.00 -2.01 0.00 0.00 31.31 29.61 1a05 n TRP 78 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.69 176.24 1a05 h ASP 79 N 2.34 0.00 0.69 -0.99 3.32 -1.62 -2.02 116.42 118.13 1a05 h ASP 79 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1a05 h ASP 79 Cb 2.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.57 1a05 h ASP 79 CO 0.56 0.28 0.00 0.00 -1.72 0.00 0.00 179.24 178.36 1a05 n ALA 80 N -2.30 1.81 -1.89 3.45 0.00 -1.26 -4.79 120.51 115.53 1a05 n ALA 80 Ca -0.01 -0.03 -0.38 0.00 0.00 0.00 0.00 53.44 53.03 1a05 n ALA 80 Cb 0.41 -1.32 -0.06 0.00 0.00 0.00 0.00 19.45 18.48 1a05 n ALA 80 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1a05 s TYR 81 N -3.08 3.77 0.52 0.00 1.51 -0.76 -5.03 117.35 114.28 1a05 s TYR 81 Ca 0.08 1.68 -0.23 0.00 -1.01 0.00 0.00 57.07 57.59 1a05 s TYR 81 Cb 0.11 -2.83 -0.06 0.00 -0.11 0.00 0.00 41.96 39.07 1a05 s TYR 81 CO 0.36 0.34 1.39 -2.14 -1.11 0.00 0.00 175.55 174.39 1a05 s PRO 82 N -1.72 3.31 0.37 -1.71 0.02 -1.26 -4.74 135.00 129.26 1a05 s PRO 82 Ca 0.44 2.32 0.20 0.00 0.02 0.00 0.00 61.00 63.98 1a05 s PRO 82 Cb -0.20 -2.39 1.28 0.00 0.02 0.00 0.00 34.50 33.21 1a05 s PRO 82 CO 0.25 -1.08 1.61 -1.35 -0.33 0.00 0.00 177.00 176.09 1a05 h PRO 83 N 1.74 0.11 0.00 5.54 0.11 -1.96 0.18 132.00 137.72 1a05 h PRO 83 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1a05 h PRO 83 Cb 1.29 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1a05 h PRO 83 CO 0.58 0.07 0.00 0.00 -0.21 0.00 0.00 178.00 178.45 1a05 h ALA 84 N 1.91 1.00 -0.02 -0.75 0.00 -2.04 -3.16 119.26 116.21 1a05 h ALA 84 Ca 0.81 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.72 1a05 h ALA 84 Cb 2.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.90 1a05 h ALA 84 CO -0.68 0.00 -0.04 1.63 0.00 0.00 0.00 179.25 180.16 1a05 n LYS 85 N -2.49 1.16 -1.70 0.00 5.02 0.62 -4.87 118.16 115.90 1a05 n LYS 85 Ca 0.02 -1.29 -0.40 0.00 -2.02 0.00 0.00 58.31 54.63 1a05 n LYS 85 Cb 0.29 -1.27 0.03 0.00 -0.02 0.00 0.00 35.03 34.06 1a05 n LYS 85 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1a05 n ARG 86 N 0.69 1.67 -0.33 1.97 5.12 -1.13 -4.31 116.66 120.35 1a05 n ARG 86 Ca 0.08 0.61 0.29 0.00 -1.93 0.00 0.00 57.85 56.90 1a05 n ARG 86 Cb 0.36 -2.40 0.55 0.00 -1.16 0.00 0.00 32.46 29.81 1a05 n ARG 86 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1a05 h PRO 87 N 1.61 0.12 0.00 5.56 0.11 -1.89 0.38 132.00 137.88 1a05 h PRO 87 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1a05 h PRO 87 Cb 1.31 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1a05 h PRO 87 CO 0.57 0.08 0.00 1.05 -0.21 0.00 0.00 178.00 179.49 1a05 h GLU 88 N 0.12 0.00 -0.21 1.05 9.09 -1.89 -2.41 114.58 120.33 1a05 h GLU 88 Ca 0.81 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 60.10 1a05 h GLU 88 Cb 2.04 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 29.12 1a05 h GLU 88 CO -0.71 0.00 -0.35 1.96 0.05 0.00 0.00 179.01 179.96 1a05 h GLN 89 N 0.00 0.45 -0.83 1.06 1.08 -1.24 -2.30 115.11 113.33 1a05 h GLN 89 Ca 0.00 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 56.99 1a05 h GLN 89 Cb 0.28 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.66 1a05 h GLN 89 CO 0.00 0.75 0.48 0.78 -0.95 0.00 0.00 178.83 179.88 1a05 h GLY 90 N 1.09 1.22 0.76 3.46 0.00 -1.57 0.40 103.07 108.42 1a05 h GLY 90 Ca 0.04 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 1a05 h GLY 90 CO 0.06 0.51 -0.03 -2.00 0.00 0.00 0.00 176.54 175.09 1a05 h LEU 91 N 1.14 -0.07 -0.86 3.11 5.85 -1.60 -2.12 115.31 120.77 1a05 h LEU 91 Ca 0.29 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1a05 h LEU 91 Cb -0.01 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1a05 h LEU 91 CO -0.05 0.19 0.52 -0.07 -0.34 0.00 0.00 178.44 178.68 1a05 h LEU 92 N -0.32 1.03 -1.53 2.25 3.38 -1.25 -2.13 115.31 116.74 1a05 h LEU 92 Ca -0.01 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1a05 h LEU 92 Cb 0.29 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1a05 h LEU 92 CO 0.01 0.80 -0.23 0.03 0.09 0.00 0.00 178.44 179.14 1a05 h ARG 93 N 1.18 0.00 -0.01 1.13 3.08 -0.87 -1.14 114.38 117.75 1a05 h ARG 93 Ca 0.31 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.33 1a05 h ARG 93 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1a05 h ARG 93 CO -0.06 0.23 -0.08 -0.07 -1.07 0.00 0.00 179.97 178.92 1a05 h LEU 94 N 0.00 0.10 -0.63 3.04 3.38 -0.82 0.45 115.31 120.82 1a05 h LEU 94 Ca -0.00 -0.69 0.04 0.00 0.09 0.00 0.00 57.88 57.32 1a05 h LEU 94 Cb 0.52 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 1a05 h LEU 94 CO 0.03 0.77 0.36 0.03 0.09 0.00 0.00 178.44 179.73 1a05 h ARG 95 N -0.57 0.67 -0.01 1.13 3.08 -1.26 -0.55 114.38 116.87 1a05 h ARG 95 Ca -0.01 -0.04 -0.24 0.00 0.07 0.00 0.00 59.98 59.76 1a05 h ARG 95 Cb 0.78 -0.15 0.02 0.00 0.08 0.00 0.00 29.97 30.69 1a05 h ARG 95 CO 0.02 0.45 -0.92 -0.22 -1.07 0.00 0.00 179.97 178.22 1a05 h LYS 96 N 0.70 0.65 -0.78 0.04 1.63 -1.26 0.18 116.57 117.72 1a05 h LYS 96 Ca 0.27 -0.68 -0.02 0.00 -0.85 0.00 0.00 60.65 59.37 1a05 h LYS 96 Cb 0.10 0.19 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 1a05 h LYS 96 CO -0.14 1.27 0.41 0.78 -3.45 0.00 0.00 179.45 178.32 1a05 h GLY 97 N 0.29 1.18 -1.57 5.01 0.00 0.18 -2.41 103.07 105.75 1a05 h GLY 97 Ca -0.11 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.66 1a05 h GLY 97 CO 0.18 0.53 0.00 1.04 0.00 0.00 0.00 176.54 178.29 1a05 n LEU 98 N -4.40 2.49 -4.04 3.11 4.32 -0.24 -4.96 117.00 113.27 1a05 n LEU 98 Ca 0.07 -1.12 -0.29 0.00 -0.02 0.00 0.00 56.01 54.65 1a05 n LEU 98 Cb 0.11 -0.22 -0.04 0.00 -1.62 0.00 0.00 43.42 41.65 1a05 n LEU 98 CO 0.39 0.56 -0.29 -0.67 -1.22 0.00 0.00 177.39 176.16 1a05 n ASP 99 N 0.85 -0.58 -4.50 -1.43 2.03 -0.76 -4.75 116.55 107.41 1a05 n ASP 99 Ca 0.17 -1.10 -0.44 0.00 0.52 0.00 0.00 54.79 53.94 1a05 n ASP 99 Cb 0.43 -2.59 -0.00 0.00 -0.72 0.00 0.00 41.12 38.24 1a05 n ASP 99 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1a05 s LEU 100 N -7.08 4.62 0.35 -2.67 1.43 0.57 -4.44 118.68 111.47 1a05 s LEU 100 Ca 0.07 -2.73 0.19 0.00 -1.03 0.00 0.00 54.13 50.63 1a05 s LEU 100 Cb -0.03 -2.46 0.47 0.00 0.03 0.00 0.00 46.19 44.20 1a05 s LEU 100 CO 0.92 -0.92 1.63 0.10 0.23 0.00 0.00 176.35 178.32 1a05 h TYR 101 N 7.45 0.00 -3.31 0.29 -0.00 -1.74 -3.40 116.97 116.26 1a05 h TYR 101 Ca 0.35 0.00 -0.73 0.00 0.00 0.00 0.00 58.73 58.34 1a05 h TYR 101 Cb 0.88 0.00 -0.25 0.00 0.00 0.00 0.00 36.73 37.37 1a05 h TYR 101 CO 1.21 0.38 -0.36 0.00 -0.00 0.00 0.00 178.16 179.40 1a05 s ALA 102 N -3.33 3.49 -0.23 0.10 0.00 -0.34 -0.48 121.76 120.97 1a05 s ALA 102 Ca 0.02 -2.21 -0.14 0.00 0.00 0.00 0.00 51.96 49.64 1a05 s ALA 102 Cb 0.09 -2.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 1a05 s ALA 102 CO 0.70 -1.76 0.30 1.21 0.00 0.00 0.00 175.76 176.21 1a05 s ASN 103 N 2.61 6.27 -0.21 0.00 3.04 -0.25 0.32 114.94 126.73 1a05 s ASN 103 Ca 0.04 0.31 -0.02 0.00 0.04 0.00 0.00 52.86 53.22 1a05 s ASN 103 Cb -0.25 -2.18 -0.00 0.00 -1.54 0.00 0.00 41.25 37.28 1a05 s ASN 103 CO 0.04 -0.04 -0.09 -0.76 -3.04 0.00 0.00 177.10 173.21 1a05 s LEU 104 N 1.38 2.67 -0.38 3.21 1.43 0.17 -0.76 118.68 126.41 1a05 s LEU 104 Ca 0.14 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.78 1a05 s LEU 104 Cb -0.15 -1.66 0.13 0.00 0.03 0.00 0.00 46.19 44.54 1a05 s LEU 104 CO 0.07 -0.01 0.19 -0.13 0.23 0.00 0.00 176.35 176.70 1a05 s ARG 105 N 1.42 0.89 -0.02 1.70 0.52 -0.19 -1.60 118.95 121.67 1a05 s ARG 105 Ca 0.06 -1.53 -0.30 0.00 -0.52 0.00 0.00 55.73 53.44 1a05 s ARG 105 Cb -0.14 -1.89 -0.05 0.00 0.52 0.00 0.00 34.95 33.39 1a05 s ARG 105 CO -0.06 -1.13 1.30 -1.25 0.02 0.00 0.00 175.30 174.18 1a05 s PRO 106 N 0.93 4.33 -0.56 3.54 0.04 -1.26 -1.74 135.00 140.28 1a05 s PRO 106 Ca 0.16 1.82 -0.07 0.00 0.04 0.00 0.00 61.00 62.95 1a05 s PRO 106 Cb -0.22 -3.54 0.14 0.00 0.04 0.00 0.00 34.50 30.92 1a05 s PRO 106 CO -0.07 -0.49 0.41 0.00 0.04 0.00 0.00 177.00 176.89 1a05 s ALA 107 N 2.18 3.51 0.12 8.56 0.00 0.45 -4.70 121.76 131.88 1a05 s ALA 107 Ca 0.60 -2.85 0.06 0.00 0.00 0.00 0.00 51.96 49.77 1a05 s ALA 107 Cb -0.28 -2.82 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 1a05 s ALA 107 CO 0.25 -2.00 -0.15 -1.14 0.00 0.00 0.00 175.76 172.71 1a05 s GLN 108 N 0.77 1.05 -0.11 0.00 2.00 -1.26 -1.19 119.66 120.91 1a05 s GLN 108 Ca 0.11 -1.23 0.01 0.00 -2.00 0.00 0.00 55.36 52.25 1a05 s GLN 108 Cb -0.22 -1.00 -0.02 0.00 0.80 0.00 0.00 33.01 32.57 1a05 s GLN 108 CO -0.03 0.20 -0.13 -1.50 -0.50 0.00 0.00 175.29 173.33 1a05 s ILE 109 N -1.95 3.11 0.11 -2.34 2.07 -1.26 -4.93 121.20 116.01 1a05 s ILE 109 Ca 0.08 -0.66 -0.30 0.00 -1.41 0.00 0.00 60.65 58.36 1a05 s ILE 109 Cb -0.06 -2.28 -0.06 0.00 0.13 0.00 0.00 42.46 40.19 1a05 s ILE 109 CO 0.04 0.54 1.03 -0.36 -1.91 0.00 0.00 174.94 174.28 1a05 s PHE 110 N 0.02 3.68 0.35 3.50 0.40 -1.26 -4.95 117.98 119.72 1a05 s PHE 110 Ca -0.04 1.67 0.16 0.00 -0.60 0.00 0.00 56.93 58.12 1a05 s PHE 110 Cb -0.14 -3.17 1.14 0.00 0.51 0.00 0.00 43.02 41.36 1a05 s PHE 110 CO 0.04 -0.24 1.66 -1.35 0.70 0.00 0.00 175.22 176.02 1a05 h PRO 111 N 5.76 0.27 -0.01 0.24 0.11 -1.99 0.25 132.00 136.63 1a05 h PRO 111 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1a05 h PRO 111 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1a05 h PRO 111 CO 0.74 0.18 -0.22 0.00 -0.21 0.00 0.00 178.00 178.48 1a05 n GLN 112 N -5.03 0.69 -0.35 1.05 0.00 -1.26 -3.88 117.38 108.60 1a05 n GLN 112 Ca 0.33 -0.35 0.08 0.00 0.00 0.00 0.00 57.00 57.06 1a05 n GLN 112 Cb 1.05 -1.49 0.21 0.00 0.00 0.00 0.00 30.24 30.01 1a05 n GLN 112 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1a05 n LEU 113 N -0.85 3.35 0.23 2.61 4.77 0.85 -4.73 117.00 123.23 1a05 n LEU 113 Ca 0.12 -3.12 0.07 0.00 -0.03 0.00 0.00 56.01 53.06 1a05 n LEU 113 Cb 0.32 -0.51 0.55 0.00 -2.33 0.00 0.00 43.42 41.45 1a05 n LEU 113 CO 0.26 0.75 0.88 0.25 -1.33 0.00 0.00 177.39 178.20 1a05 h LEU 114 N 1.10 0.00 -2.13 2.23 6.46 -1.62 -2.93 115.31 118.42 1a05 h LEU 114 Ca 0.02 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.77 1a05 h LEU 114 Cb 1.30 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.23 1a05 h LEU 114 CO 0.15 0.21 -0.02 -0.78 -0.62 0.00 0.00 178.44 177.38 1a05 h ASP 115 N 0.00 0.00 1.26 1.25 3.58 -1.90 -2.51 116.42 118.09 1a05 h ASP 115 Ca -0.00 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.40 1a05 h ASP 115 Cb 0.42 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 1a05 h ASP 115 CO 0.03 0.02 -0.22 0.00 -2.88 0.00 0.00 179.24 176.19 1a05 h ALA 116 N 1.98 0.94 -2.86 -0.78 0.00 -1.82 -3.45 119.26 113.27 1a05 h ALA 116 Ca -0.00 -0.20 -0.53 0.00 0.00 0.00 0.00 54.91 54.18 1a05 h ALA 116 Cb 0.29 -0.03 0.09 0.00 0.00 0.00 0.00 17.79 18.13 1a05 h ALA 116 CO 0.00 0.27 0.80 0.45 0.00 0.00 0.00 179.25 180.77 1a05 s SER 117 N -6.19 6.45 0.20 0.00 0.15 -0.95 -4.43 113.70 108.93 1a05 s SER 117 Ca 0.03 2.92 0.25 0.00 0.70 0.00 0.00 55.95 59.84 1a05 s SER 117 Cb 0.09 -2.65 0.49 0.00 -1.71 0.00 0.00 66.02 62.24 1a05 s SER 117 CO 0.65 -0.82 1.51 1.55 1.20 0.00 0.00 173.24 177.33 1a05 h PRO 118 N 4.03 0.00 -7.24 5.44 0.13 -1.79 -3.47 132.00 129.09 1a05 h PRO 118 Ca -0.48 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.16 1a05 h PRO 118 Cb 1.23 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.42 1a05 h PRO 118 CO 0.72 0.00 0.26 -0.51 -0.23 0.00 0.00 178.00 178.24 1a05 s LEU 119 N -4.66 3.13 -0.02 1.56 1.43 -1.26 -5.00 118.68 113.87 1a05 s LEU 119 Ca 0.07 0.88 -0.30 0.00 -1.03 0.00 0.00 54.13 53.76 1a05 s LEU 119 Cb 0.12 -3.71 -0.06 0.00 0.03 0.00 0.00 46.19 42.57 1a05 s LEU 119 CO 0.67 -1.14 1.66 -0.13 0.23 0.00 0.00 176.35 177.64 1a05 s ARG 120 N -5.11 4.19 0.17 1.70 0.52 -1.26 -4.85 118.95 114.31 1a05 s ARG 120 Ca 0.55 2.23 0.08 0.00 -0.52 0.00 0.00 55.73 58.07 1a05 s ARG 120 Cb -0.11 -3.90 0.59 0.00 0.52 0.00 0.00 34.95 32.05 1a05 s ARG 120 CO 0.48 -0.81 0.75 -2.30 0.02 0.00 0.00 175.30 173.43 1a05 n PRO 121 N 6.76 -0.03 0.23 3.54 -0.02 -1.26 0.40 135.00 144.63 1a05 n PRO 121 Ca 0.17 0.66 0.08 0.00 -2.02 0.00 0.00 63.50 62.39 1a05 n PRO 121 Cb 0.42 -1.16 0.57 0.00 -0.02 0.00 0.00 33.50 33.31 1a05 n PRO 121 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1a05 h GLU 122 N 0.00 0.00 0.02 -0.52 9.09 -2.01 -1.75 114.58 119.41 1a05 h GLU 122 Ca 0.38 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.79 1a05 h GLU 122 Cb 0.97 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.08 1a05 h GLU 122 CO -0.38 0.19 -0.01 -0.07 0.05 0.00 0.00 179.01 178.79 1a05 h LEU 123 N 0.00 -0.02 -0.85 3.06 3.38 -0.41 -3.39 115.31 117.08 1a05 h LEU 123 Ca -0.00 -0.57 -0.10 0.00 0.09 0.00 0.00 57.88 57.30 1a05 h LEU 123 Cb 0.38 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1a05 h LEU 123 CO 0.02 0.74 -0.49 1.62 0.09 0.00 0.00 178.44 180.42 1a05 h VAL 124 N -0.98 1.16 -1.13 1.22 3.04 -1.59 -3.36 116.25 114.61 1a05 h VAL 124 Ca -0.00 -1.81 0.43 0.00 -1.01 0.00 0.00 66.70 64.31 1a05 h VAL 124 Cb 0.59 2.03 -0.16 0.00 -2.01 0.00 0.00 31.29 31.74 1a05 h VAL 124 CO 0.00 0.48 0.66 -1.14 -1.01 0.00 0.00 177.57 176.57 1a05 n ARG 125 N -3.67 -0.05 -0.41 4.17 0.63 -0.66 -0.59 116.66 116.08 1a05 n ARG 125 Ca -0.01 1.30 0.09 0.00 -0.92 0.00 0.00 57.85 58.31 1a05 n ARG 125 Cb 0.56 -2.43 0.24 0.00 0.45 0.00 0.00 32.46 31.29 1a05 n ARG 125 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1a05 n ASP 126 N -5.00 3.67 -4.68 6.15 8.00 -1.26 -5.00 116.55 118.43 1a05 n ASP 126 Ca 0.38 -3.05 -0.42 0.00 0.71 0.00 0.00 54.79 52.41 1a05 n ASP 126 Cb 1.37 -0.53 -0.03 0.00 -0.02 0.00 0.00 41.12 41.91 1a05 n ASP 126 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1a05 s VAL 127 N -2.85 3.29 -0.39 2.53 0.11 0.24 -4.82 120.40 118.51 1a05 s VAL 127 Ca 0.41 0.62 0.03 0.00 -2.93 0.00 0.00 61.98 60.12 1a05 s VAL 127 Cb 0.34 -3.40 0.16 0.00 -1.53 0.00 0.00 36.38 31.94 1a05 s VAL 127 CO 0.08 -0.02 0.38 -0.62 -3.33 0.00 0.00 175.10 171.59 1a05 s ASP 128 N 2.65 1.23 0.07 3.54 -1.08 -1.25 -4.06 116.67 117.77 1a05 s ASP 128 Ca 0.73 -2.04 0.09 0.00 -0.52 0.00 0.00 52.55 50.81 1a05 s ASP 128 Cb -0.37 0.32 -0.03 0.00 -1.46 0.00 0.00 42.92 41.38 1a05 s ASP 128 CO 0.31 -0.22 -0.25 -0.63 0.52 0.00 0.00 175.17 174.90 1a05 s ILE 129 N 1.00 2.34 -0.18 4.11 1.01 -0.34 -4.41 121.20 124.72 1a05 s ILE 129 Ca 0.22 -1.47 0.00 0.00 0.00 0.00 0.00 60.65 59.40 1a05 s ILE 129 Cb -0.11 -1.97 0.04 0.00 0.01 0.00 0.00 42.46 40.43 1a05 s ILE 129 CO -0.06 0.26 -0.09 -0.22 0.00 0.00 0.00 174.94 174.84 1a05 s LEU 130 N -1.58 2.00 -0.24 2.97 2.96 0.02 0.17 118.68 124.97 1a05 s LEU 130 Ca 0.13 -0.78 -0.16 0.00 -0.22 0.00 0.00 54.13 53.10 1a05 s LEU 130 Cb -0.10 -1.11 -0.03 0.00 0.50 0.00 0.00 46.19 45.44 1a05 s LEU 130 CO 0.04 -0.15 0.44 -0.69 -1.32 0.00 0.00 176.35 174.67 1a05 s VAL 131 N 1.49 5.14 -0.37 1.68 1.01 -0.71 -1.28 120.40 127.36 1a05 s VAL 131 Ca -0.00 0.74 -0.08 0.00 0.00 0.00 0.00 61.98 62.63 1a05 s VAL 131 Cb -0.16 -3.76 0.05 0.00 0.00 0.00 0.00 36.38 32.52 1a05 s VAL 131 CO -0.08 0.16 0.18 -0.69 0.00 0.00 0.00 175.10 174.66 1a05 s VAL 132 N 1.92 4.07 -0.15 2.92 1.01 -0.61 -1.02 120.40 128.53 1a05 s VAL 132 Ca 0.19 -1.19 -0.02 0.00 0.00 0.00 0.00 61.98 60.96 1a05 s VAL 132 Cb -0.15 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 1a05 s VAL 132 CO 0.09 -0.31 -0.08 -0.60 0.00 0.00 0.00 175.10 174.21 1a05 s ARG 133 N 1.43 3.52 0.18 2.72 3.52 0.06 -2.51 118.95 127.88 1a05 s ARG 133 Ca 0.01 -0.60 -0.31 0.00 -0.13 0.00 0.00 55.73 54.70 1a05 s ARG 133 Cb -0.21 -2.81 -0.09 0.00 -1.56 0.00 0.00 34.95 30.28 1a05 s ARG 133 CO 0.03 0.19 1.44 -2.00 -0.81 0.00 0.00 175.30 174.15 1a05 s GLU 134 N 0.47 4.29 -0.01 5.12 -6.30 -0.88 -1.09 118.70 120.30 1a05 s GLU 134 Ca -0.06 2.22 0.08 0.00 -2.50 0.00 0.00 54.97 54.70 1a05 s GLU 134 Cb -0.15 -3.17 -0.11 0.00 0.00 0.00 0.00 34.13 30.70 1a05 s GLU 134 CO 0.04 -0.45 0.22 -0.11 0.02 0.00 0.00 175.26 174.98 1a05 n LEU 135 N 3.28 0.13 -0.25 2.70 7.94 0.37 -2.48 117.00 128.68 1a05 n LEU 135 Ca 0.10 -0.18 0.06 0.00 -1.11 0.00 0.00 56.01 54.88 1a05 n LEU 135 Cb 0.41 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.35 1a05 n LEU 135 CO 0.60 0.03 0.22 0.35 -1.11 0.00 0.00 177.39 177.48 1a05 n THR 136 N -1.56 0.00 -1.17 1.96 -2.24 -1.26 -4.88 114.28 105.13 1a05 n THR 136 Ca -0.00 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1a05 n THR 136 Cb 0.17 1.13 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 1a05 n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a05 n GLY 137 N 0.95 4.53 5.79 3.38 0.00 -1.26 -4.71 105.19 113.86 1a05 n GLY 137 Ca 0.05 -1.76 0.03 0.00 0.00 0.00 0.00 46.02 44.34 1a05 n GLY 137 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a05 n ASP 138 N 0.00 -4.19 0.27 1.61 -0.08 -1.05 -3.69 116.55 109.42 1a05 n ASP 138 Ca 0.00 0.20 0.18 0.00 -1.51 0.00 0.00 54.79 53.66 1a05 n ASP 138 Cb 0.00 -0.57 0.90 0.00 2.34 0.00 0.00 41.12 43.80 1a05 n ASP 138 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1a05 h ILE 139 N -0.17 0.17 -0.93 5.18 2.10 -1.81 -1.74 117.51 120.30 1a05 h ILE 139 Ca 0.00 0.00 0.01 0.00 1.08 0.00 0.00 64.86 65.95 1a05 h ILE 139 Cb 0.17 0.79 -0.05 0.00 -1.09 0.00 0.00 36.82 36.64 1a05 h ILE 139 CO 0.00 0.00 0.62 1.88 -1.08 0.00 0.00 178.15 179.57 1a05 h TYR 140 N 0.00 1.17 -0.01 2.19 -1.99 -1.83 -3.15 116.97 113.36 1a05 h TYR 140 Ca 0.04 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.80 1a05 h TYR 140 Cb 0.51 -0.40 0.00 0.00 2.00 0.00 0.00 36.73 38.85 1a05 h TYR 140 CO 0.00 0.73 0.00 1.19 -0.00 0.00 0.00 178.16 180.08 1a05 n PHE 141 N -4.44 0.03 -2.51 4.88 3.72 -0.80 -5.06 117.46 113.28 1a05 n PHE 141 Ca 0.11 -0.75 -0.39 0.00 -0.05 0.00 0.00 57.45 56.36 1a05 n PHE 141 Cb 0.02 -0.10 -0.04 0.00 -0.94 0.00 0.00 39.48 38.41 1a05 n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1a05 s GLY 142 N -1.95 2.95 0.04 1.37 0.00 -0.72 -4.97 107.32 104.05 1a05 s GLY 142 Ca 0.17 0.82 0.09 0.00 0.00 0.00 0.00 44.72 45.80 1a05 s GLY 142 CO 0.02 1.36 -0.25 1.62 0.00 0.00 0.00 173.10 175.85 1a05 s GLN 143 N -1.81 1.72 0.76 2.90 2.00 -1.26 -4.02 119.66 119.96 1a05 s GLN 143 Ca 0.49 -1.07 -0.11 0.00 -2.00 0.00 0.00 55.36 52.67 1a05 s GLN 143 Cb -0.28 -1.88 0.05 0.00 0.80 0.00 0.00 33.01 31.70 1a05 s GLN 143 CO 0.36 0.49 1.13 -1.25 -0.50 0.00 0.00 175.29 175.52 1a05 s PRO 144 N -1.20 2.37 0.16 1.67 0.04 -1.26 -4.80 135.00 131.98 1a05 s PRO 144 Ca 0.11 0.25 -0.23 0.00 0.04 0.00 0.00 61.00 61.17 1a05 s PRO 144 Cb -0.10 -1.99 0.07 0.00 0.04 0.00 0.00 34.50 32.52 1a05 s PRO 144 CO 0.02 -1.33 0.60 -0.98 0.04 0.00 0.00 177.00 175.34 1a05 s ARG 145 N -5.47 1.30 0.00 4.56 1.70 -1.26 -2.69 118.95 117.09 1a05 s ARG 145 Ca 0.60 -0.51 0.00 0.00 -0.47 0.00 0.00 55.73 55.35 1a05 s ARG 145 Cb -0.11 0.59 0.00 0.00 -0.57 0.00 0.00 34.95 34.86 1a05 s ARG 145 CO 0.50 -0.57 0.00 0.41 -1.08 0.00 0.00 175.30 174.56 1a05 n GLY 146 N -0.38 0.62 2.87 3.88 0.00 -0.01 -4.96 105.19 107.21 1a05 n GLY 146 Ca -0.16 -1.78 -0.22 0.00 0.00 0.00 0.00 46.02 43.86 1a05 n GLY 146 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a05 s LEU 147 N 0.00 1.13 0.33 0.99 1.02 -1.26 -1.32 118.68 119.56 1a05 s LEU 147 Ca 0.00 -0.16 0.04 0.00 0.02 0.00 0.00 54.13 54.03 1a05 s LEU 147 Cb 0.00 -0.54 -0.04 0.00 0.02 0.00 0.00 46.19 45.63 1a05 s LEU 147 CO 0.00 -0.09 0.16 -1.83 0.02 0.00 0.00 176.35 174.61 1a05 s GLU 148 N 1.31 1.67 -0.15 1.70 -1.05 0.05 -4.97 118.70 117.26 1a05 s GLU 148 Ca -0.04 -1.97 0.01 0.00 -0.15 0.00 0.00 54.97 52.81 1a05 s GLU 148 Cb -0.14 -0.17 0.02 0.00 -0.44 0.00 0.00 34.13 33.41 1a05 s GLU 148 CO -0.02 -0.47 -0.15 0.08 0.95 0.00 0.00 175.26 175.64 1a05 s VAL 149 N -3.51 1.66 -0.15 1.83 1.01 -1.26 0.34 120.40 120.33 1a05 s VAL 149 Ca 0.34 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.64 1a05 s VAL 149 Cb 0.04 -1.54 0.01 0.00 0.00 0.00 0.00 36.38 34.89 1a05 s VAL 149 CO 0.18 0.47 -0.20 -0.63 0.00 0.00 0.00 175.10 174.92 1a05 s ILE 150 N 1.39 2.17 -1.48 2.22 -1.09 0.33 -4.70 121.20 120.04 1a05 s ILE 150 Ca 0.04 -0.93 -0.08 0.00 -2.23 0.00 0.00 60.65 57.45 1a05 s ILE 150 Cb -0.13 -1.88 0.06 0.00 -1.58 0.00 0.00 42.46 38.92 1a05 s ILE 150 CO -0.10 0.54 0.72 0.47 -1.23 0.00 0.00 174.94 175.34 1a05 n ASP 151 N 4.14 -2.40 0.00 3.58 8.00 -1.26 -0.74 116.55 127.87 1a05 n ASP 151 Ca -0.20 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.40 1a05 n ASP 151 Cb 0.51 -3.48 0.00 0.00 -0.02 0.00 0.00 41.12 38.14 1a05 n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a05 n GLY 152 N -1.69 0.56 3.33 0.44 0.00 -1.26 -5.01 105.19 101.55 1a05 n GLY 152 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 1a05 n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a05 s LYS 153 N -0.41 2.90 0.17 1.61 -0.14 0.08 -5.09 119.74 118.86 1a05 s LYS 153 Ca 0.00 -0.80 -0.31 0.00 -1.36 0.00 0.00 55.97 53.51 1a05 s LYS 153 Cb 0.00 -2.37 -0.09 0.00 -1.68 0.00 0.00 37.83 33.69 1a05 s LYS 153 CO 0.00 0.33 1.38 1.03 -0.76 0.00 0.00 175.35 177.33 1a05 s ARG 154 N -0.01 4.33 -0.08 1.68 0.52 -1.26 -0.52 118.95 123.61 1a05 s ARG 154 Ca -0.06 2.12 0.01 0.00 -0.52 0.00 0.00 55.73 57.29 1a05 s ARG 154 Cb -0.15 -3.20 0.02 0.00 0.52 0.00 0.00 34.95 32.14 1a05 s ARG 154 CO 0.05 -0.38 -0.11 0.50 0.02 0.00 0.00 175.30 175.38 1a05 s ARG 155 N 0.43 1.70 -0.11 3.54 3.52 0.15 -4.93 118.95 123.26 1a05 s ARG 155 Ca 0.61 -0.38 -0.01 0.00 -0.13 0.00 0.00 55.73 55.82 1a05 s ARG 155 Cb -0.38 -1.51 -0.03 0.00 -1.56 0.00 0.00 34.95 31.47 1a05 s ARG 155 CO 0.35 -0.07 -0.06 0.20 -0.81 0.00 0.00 175.30 174.92 1a05 s GLY 156 N 1.00 1.70 0.02 8.12 0.00 -1.26 -0.77 107.32 116.13 1a05 s GLY 156 Ca -0.08 -0.86 -0.06 0.00 0.00 0.00 0.00 44.72 43.73 1a05 s GLY 156 CO -0.00 -0.39 0.10 -0.11 0.00 0.00 0.00 173.10 172.69 1a05 s PHE 157 N -0.27 0.14 -0.01 1.90 -0.71 -0.44 -5.01 117.98 113.58 1a05 s PHE 157 Ca 0.04 -0.36 -0.16 0.00 -1.04 0.00 0.00 56.93 55.41 1a05 s PHE 157 Cb -0.13 -0.11 0.03 0.00 -1.21 0.00 0.00 43.02 41.60 1a05 s PHE 157 CO 0.02 -0.31 0.33 -0.80 -1.34 0.00 0.00 175.22 173.12 1a05 s ASN 158 N -1.75 -0.22 -0.21 1.98 -0.87 -1.26 -0.83 114.94 111.78 1a05 s ASN 158 Ca -0.10 0.11 -0.03 0.00 -1.57 0.00 0.00 52.86 51.27 1a05 s ASN 158 Cb -0.05 0.33 -0.00 0.00 -0.02 0.00 0.00 41.25 41.50 1a05 s ASN 158 CO -0.02 -0.46 -0.07 -0.89 -2.57 0.00 0.00 177.10 173.09 1a05 s THR 159 N -1.36 3.15 -0.05 1.60 2.01 -1.09 -4.96 115.64 114.93 1a05 s THR 159 Ca -0.13 -0.57 -0.22 0.00 0.31 0.00 0.00 61.69 61.08 1a05 s THR 159 Cb -0.05 -2.41 -0.04 0.00 0.01 0.00 0.00 72.50 70.01 1a05 s THR 159 CO 0.04 0.45 0.64 -0.32 -0.69 0.00 0.00 174.62 174.74 1a05 s MET 160 N 1.37 4.39 -0.23 4.92 1.75 -1.26 -3.45 119.30 126.79 1a05 s MET 160 Ca 0.05 0.78 -0.26 0.00 -1.25 0.00 0.00 55.69 55.00 1a05 s MET 160 Cb -0.14 -3.41 0.08 0.00 2.84 0.00 0.00 34.83 34.20 1a05 s MET 160 CO -0.04 0.18 0.76 0.54 -0.65 0.00 0.00 175.02 175.80 1a05 s VAL 161 N 0.43 0.00 -0.12 10.11 0.11 -1.26 -4.84 120.40 124.83 1a05 s VAL 161 Ca 0.34 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 59.27 1a05 s VAL 161 Cb -0.18 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.71 1a05 s VAL 161 CO 0.17 0.00 0.33 -0.31 -3.33 0.00 0.00 175.10 171.96 1a05 s TYR 162 N 0.08 -0.36 0.36 1.54 2.02 -1.26 -2.53 117.35 117.19 1a05 s TYR 162 Ca -0.01 0.88 0.08 0.00 -0.37 0.00 0.00 57.07 57.65 1a05 s TYR 162 Cb -0.04 0.12 -0.04 0.00 -0.40 0.00 0.00 41.96 41.60 1a05 s TYR 162 CO 0.02 -0.18 0.19 0.16 -1.57 0.00 0.00 175.55 174.16 1a05 s ASP 163 N 0.15 4.75 0.57 2.29 1.47 -1.26 -5.03 116.67 119.61 1a05 s ASP 163 Ca -0.00 -0.78 0.26 0.00 1.18 0.00 0.00 52.55 53.21 1a05 s ASP 163 Cb -0.02 -0.71 1.68 0.00 -0.34 0.00 0.00 42.92 43.53 1a05 s ASP 163 CO 0.01 -0.37 2.23 1.05 0.68 0.00 0.00 175.17 178.76 1a05 h GLU 164 N 1.45 0.00 -0.19 2.11 4.11 -2.00 -2.55 114.58 117.52 1a05 h GLU 164 Ca -0.43 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 58.78 1a05 h GLU 164 Cb 1.25 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.51 1a05 h GLU 164 CO 0.63 0.01 -0.73 -0.44 0.07 0.00 0.00 179.01 178.54 1a05 h ASP 165 N 0.00 0.97 -0.73 3.06 3.32 -1.98 -0.81 116.42 120.24 1a05 h ASP 165 Ca -0.00 -0.61 -0.03 0.00 0.02 0.00 0.00 57.03 56.41 1a05 h ASP 165 Cb 0.01 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.25 1a05 h ASP 165 CO 0.00 1.41 0.35 -0.33 -1.72 0.00 0.00 179.24 178.95 1a05 h GLU 166 N 0.58 1.06 0.03 3.56 5.08 -1.87 -1.73 114.58 121.29 1a05 h GLU 166 Ca -0.04 -0.15 -0.27 0.00 -1.00 0.00 0.00 59.36 57.90 1a05 h GLU 166 Cb 1.36 -0.19 0.02 0.00 0.50 0.00 0.00 28.75 30.44 1a05 h GLU 166 CO 0.15 0.82 -1.09 0.82 -1.00 0.00 0.00 179.01 178.72 1a05 h ILE 167 N 1.06 1.28 -0.53 3.13 2.04 -1.49 -3.15 117.51 119.84 1a05 h ILE 167 Ca 0.26 -2.29 -0.00 0.00 1.00 0.00 0.00 64.86 63.82 1a05 h ILE 167 Cb 0.11 2.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.63 1a05 h ILE 167 CO -0.03 0.71 0.32 -0.09 0.00 0.00 0.00 178.15 179.06 1a05 h ARG 168 N 0.36 0.73 -0.43 2.37 2.43 -0.92 0.04 114.38 118.95 1a05 h ARG 168 Ca -0.14 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 58.87 1a05 h ARG 168 Cb 1.75 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 31.13 1a05 h ARG 168 CO 0.21 0.53 -0.07 0.07 -1.51 0.00 0.00 179.97 179.19 1a05 h ARG 169 N 0.72 0.81 0.00 0.20 0.11 -1.41 -1.78 114.38 113.03 1a05 h ARG 169 Ca 0.19 -0.30 -0.12 0.00 0.10 0.00 0.00 59.98 59.86 1a05 h ARG 169 Cb -0.01 -0.05 -0.02 0.00 1.11 0.00 0.00 29.97 31.00 1a05 h ARG 169 CO -0.04 0.91 -0.55 0.97 0.10 0.00 0.00 179.97 181.36 1a05 h ILE 170 N 0.64 1.32 -0.56 0.08 6.09 -1.49 -2.87 117.51 120.72 1a05 h ILE 170 Ca 0.11 -1.95 -0.11 0.00 -1.37 0.00 0.00 64.86 61.55 1a05 h ILE 170 Cb 0.60 2.07 -0.02 0.00 0.47 0.00 0.00 36.82 39.94 1a05 h ILE 170 CO 0.04 0.54 -0.07 0.00 -3.07 0.00 0.00 178.15 175.59 1a05 h ALA 171 N 1.45 0.83 -0.48 0.18 0.00 -0.81 -2.25 119.26 118.17 1a05 h ALA 171 Ca -0.01 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 1a05 h ALA 171 Cb 1.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1a05 h ALA 171 CO 0.07 0.66 0.18 0.45 0.00 0.00 0.00 179.25 180.61 1a05 h HIS 172 N 0.92 0.75 -0.57 0.00 3.86 -1.13 0.64 115.15 119.61 1a05 h HIS 172 Ca 0.15 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1a05 h HIS 172 Cb 0.62 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.84 1a05 h HIS 172 CO 0.04 0.64 0.34 0.28 0.86 0.00 0.00 177.93 180.09 1a05 h VAL 173 N 0.64 1.17 -0.42 2.45 2.07 -1.37 -0.43 116.25 120.35 1a05 h VAL 173 Ca 0.16 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.19 1a05 h VAL 173 Cb 0.22 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1a05 h VAL 173 CO -0.01 0.18 -0.10 0.00 0.02 0.00 0.00 177.57 177.66 1a05 h ALA 174 N 1.16 0.58 -0.62 1.67 0.00 -1.18 0.30 119.26 121.17 1a05 h ALA 174 Ca 0.20 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1a05 h ALA 174 Cb -0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1a05 h ALA 174 CO -0.04 0.46 0.03 0.74 0.00 0.00 0.00 179.25 180.44 1a05 h PHE 175 N 0.64 1.17 -0.42 0.00 0.04 -0.67 -1.48 116.94 116.21 1a05 h PHE 175 Ca 0.11 -0.19 -0.06 0.00 2.80 0.00 0.00 57.97 60.63 1a05 h PHE 175 Cb 0.63 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 38.46 1a05 h PHE 175 CO 0.05 1.02 0.04 0.00 -0.60 0.00 0.00 178.31 178.81 1a05 h ARG 176 N 0.98 0.71 -0.77 1.51 3.08 -0.98 -2.26 114.38 116.66 1a05 h ARG 176 Ca 0.18 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1a05 h ARG 176 Cb 0.53 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.47 1a05 h ARG 176 CO 0.03 0.77 0.43 0.00 -1.07 0.00 0.00 179.97 180.13 1a05 h ALA 177 N 0.91 0.98 -0.78 0.04 0.00 -0.79 -2.63 119.26 117.00 1a05 h ALA 177 Ca 0.12 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1a05 h ALA 177 Cb 0.42 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1a05 h ALA 177 CO 0.01 0.48 0.35 0.00 0.00 0.00 0.00 179.25 180.10 1a05 h ALA 178 N 1.22 1.14 -0.33 0.00 0.00 -1.10 -2.84 119.26 117.35 1a05 h ALA 178 Ca 0.27 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1a05 h ALA 178 Cb 0.02 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.45 1a05 h ALA 178 CO -0.05 0.64 0.05 1.96 0.00 0.00 0.00 179.25 181.85 1a05 h GLN 179 N 1.12 0.15 0.00 0.00 4.20 -1.03 0.28 115.11 119.83 1a05 h GLN 179 Ca 0.27 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1a05 h GLN 179 Cb 0.15 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1a05 h GLN 179 CO -0.03 0.10 0.00 0.41 -0.67 0.00 0.00 178.83 178.64 1a05 n GLY 180 N -1.23 -0.78 0.00 3.46 0.00 -1.09 -4.45 105.19 101.10 1a05 n GLY 180 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1a05 n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a05 n ARG 181 N -1.20 0.38 -0.10 1.61 1.74 -0.38 -4.98 116.66 113.73 1a05 n ARG 181 Ca 0.10 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.22 1a05 n ARG 181 Cb 0.12 0.00 0.15 0.00 -1.02 0.00 0.00 32.46 31.70 1a05 n ARG 181 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1a05 n ARG 182 N 0.00 1.49 -3.68 5.56 1.74 -1.22 -4.91 116.66 115.64 1a05 n ARG 182 Ca 0.00 -0.76 -0.27 0.00 -0.77 0.00 0.00 57.85 56.05 1a05 n ARG 182 Cb 0.00 -1.19 0.05 0.00 -1.02 0.00 0.00 32.46 30.29 1a05 n ARG 182 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1a05 n LYS 183 N 0.10 -6.31 -3.86 5.56 5.02 0.84 -4.94 118.16 114.57 1a05 n LYS 183 Ca 0.08 0.71 -0.25 0.00 -2.02 0.00 0.00 58.31 56.83 1a05 n LYS 183 Cb 0.19 -5.66 -0.17 0.00 -0.02 0.00 0.00 35.03 29.37 1a05 n LYS 183 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1a05 s GLN 184 N -6.39 1.21 -0.10 1.97 -0.21 -1.26 -0.66 119.66 114.22 1a05 s GLN 184 Ca 0.59 -0.13 0.03 0.00 0.02 0.00 0.00 55.36 55.87 1a05 s GLN 184 Cb -0.28 -1.37 0.01 0.00 1.00 0.00 0.00 33.01 32.36 1a05 s GLN 184 CO 0.73 -0.28 -0.19 -1.17 -2.12 0.00 0.00 175.29 172.26 1a05 s LEU 185 N 1.80 1.91 -0.25 2.90 2.96 -0.14 -2.25 118.68 125.62 1a05 s LEU 185 Ca 0.05 -0.48 -0.03 0.00 -0.22 0.00 0.00 54.13 53.45 1a05 s LEU 185 Cb -0.12 -1.21 0.02 0.00 0.50 0.00 0.00 46.19 45.37 1a05 s LEU 185 CO -0.07 0.09 -0.03 0.00 -1.32 0.00 0.00 176.35 175.01 1a05 s SER 187 N 1.39 6.28 -0.21 0.00 0.15 -0.34 -0.03 113.70 120.93 1a05 s SER 187 Ca 0.02 0.32 -0.10 0.00 0.70 0.00 0.00 55.95 56.89 1a05 s SER 187 Cb -0.16 -2.20 -0.05 0.00 -1.71 0.00 0.00 66.02 61.90 1a05 s SER 187 CO -0.03 -0.12 0.14 -0.69 1.20 0.00 0.00 173.24 173.73 1a05 s VAL 188 N 1.75 5.37 0.00 4.45 1.01 0.80 -1.71 120.40 132.07 1a05 s VAL 188 Ca 0.15 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.31 1a05 s VAL 188 Cb -0.15 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.76 1a05 s VAL 188 CO 0.09 0.41 0.00 -0.90 0.00 0.00 0.00 175.10 174.70 1a05 n ASP 189 N 3.78 0.00 -2.68 3.32 5.68 -0.79 -4.44 116.55 121.42 1a05 n ASP 189 Ca -0.16 -0.49 -0.08 0.00 -0.50 0.00 0.00 54.79 53.56 1a05 n ASP 189 Cb 0.52 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.56 1a05 n ASP 189 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1a05 n LYS 190 N 0.00 1.18 0.29 0.11 3.00 -1.26 -0.14 118.16 121.34 1a05 n LYS 190 Ca 0.00 -2.76 0.16 0.00 -0.00 0.00 0.00 58.31 55.71 1a05 n LYS 190 Cb 0.00 -0.83 0.85 0.00 0.00 0.00 0.00 35.03 35.05 1a05 n LYS 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1a05 h ALA 191 N 2.63 1.16 -0.01 3.14 0.00 -1.76 0.16 119.26 124.58 1a05 h ALA 191 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1a05 h ALA 191 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1a05 h ALA 191 CO 0.29 -0.16 -0.12 0.27 0.00 0.00 0.00 179.25 179.54 1a05 n ASN 192 N -2.74 1.30 0.00 0.00 6.94 -1.26 -4.46 115.26 115.03 1a05 n ASN 192 Ca -0.02 -1.23 0.00 0.00 -0.02 0.00 0.00 54.58 53.31 1a05 n ASN 192 Cb 0.22 0.06 0.00 0.00 -2.36 0.00 0.00 39.78 37.70 1a05 n ASN 192 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1a05 n VAL 193 N -0.19 0.00 -3.69 3.53 0.31 -0.58 -5.05 118.33 112.66 1a05 n VAL 193 Ca 0.16 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 64.11 1a05 n VAL 193 Cb 0.35 -0.20 -0.12 0.00 -0.91 0.00 0.00 33.84 32.96 1a05 n VAL 193 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1a05 s LEU 194 N -3.73 4.10 0.36 7.52 1.02 0.45 -4.99 118.68 123.42 1a05 s LEU 194 Ca 0.00 -0.68 0.04 0.00 0.02 0.00 0.00 54.13 53.51 1a05 s LEU 194 Cb 0.00 -1.95 0.70 0.00 0.02 0.00 0.00 46.19 44.95 1a05 s LEU 194 CO 0.00 -0.22 1.99 -0.33 0.02 0.00 0.00 176.35 177.81 1a05 h GLU 195 N 8.31 0.77 -0.78 1.70 3.07 -1.85 -2.13 114.58 123.67 1a05 h GLU 195 Ca -0.31 -0.05 0.06 0.00 -0.50 0.00 0.00 59.36 58.57 1a05 h GLU 195 Cb 1.13 -0.17 -0.06 0.00 -0.84 0.00 0.00 28.75 28.81 1a05 h GLU 195 CO 0.62 0.51 0.47 1.15 -1.40 0.00 0.00 179.01 180.35 1a05 h THR 196 N 0.79 1.00 0.00 1.13 2.02 -1.94 -1.06 112.91 114.86 1a05 h THR 196 Ca 0.26 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1a05 h THR 196 Cb 0.06 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.55 1a05 h THR 196 CO -0.07 0.15 0.00 0.35 0.37 0.00 0.00 175.52 176.32 1a05 n THR 197 N -4.70 0.04 0.08 3.16 -2.24 -0.83 -2.25 114.28 107.55 1a05 n THR 197 Ca 0.11 0.01 -0.19 0.00 -2.27 0.00 0.00 64.05 61.71 1a05 n THR 197 Cb 0.19 -0.52 -0.14 0.00 -2.10 0.00 0.00 70.33 67.75 1a05 n THR 197 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1a05 h ARG 198 N 0.00 0.31 -0.60 -0.78 2.43 -0.87 -2.54 114.38 112.34 1a05 h ARG 198 Ca 0.00 -0.53 -0.08 0.00 -0.81 0.00 0.00 59.98 58.56 1a05 h ARG 198 Cb 0.42 0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.15 1a05 h ARG 198 CO 0.00 1.20 0.06 1.25 -1.51 0.00 0.00 179.97 180.97 1a05 h LEU 199 N 0.09 0.98 -0.29 3.80 5.85 -1.25 -1.63 115.31 122.86 1a05 h LEU 199 Ca -0.25 -0.28 0.06 0.00 0.84 0.00 0.00 57.88 58.25 1a05 h LEU 199 Cb 2.04 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 42.76 1a05 h LEU 199 CO 0.18 1.01 -0.09 -0.25 -0.34 0.00 0.00 178.44 178.95 1a05 h TRP 200 N 0.91 -0.21 -0.48 1.25 2.91 -1.48 0.10 115.95 118.96 1a05 h TRP 200 Ca 0.18 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.23 1a05 h TRP 200 Cb 0.47 0.14 -0.02 0.00 -0.51 0.00 0.00 29.16 29.24 1a05 h TRP 200 CO 0.03 -0.15 0.31 -0.09 -1.03 0.00 0.00 178.44 177.52 1a05 h ARG 201 N -0.03 0.63 -0.37 2.65 2.43 -1.23 -1.64 114.38 116.83 1a05 h ARG 201 Ca 0.14 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1a05 h ARG 201 Cb 0.25 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1a05 h ARG 201 CO -0.31 0.42 0.15 0.93 -1.51 0.00 0.00 179.97 179.65 1a05 h GLU 202 N 0.64 0.54 -0.49 0.20 5.08 -0.55 -0.84 114.58 119.16 1a05 h GLU 202 Ca 0.17 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 1a05 h GLU 202 Cb -0.07 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1a05 h GLU 202 CO -0.04 0.52 -0.00 0.28 -1.00 0.00 0.00 179.01 178.77 1a05 h VAL 203 N 0.45 1.26 -0.84 3.13 2.07 -0.77 -1.83 116.25 119.72 1a05 h VAL 203 Ca 0.12 -1.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 1a05 h VAL 203 Cb 0.18 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1a05 h VAL 203 CO -0.01 0.38 0.50 0.58 0.02 0.00 0.00 177.57 179.03 1a05 h VAL 204 N 0.72 1.24 -0.48 2.57 2.07 -1.19 -1.21 116.25 119.98 1a05 h VAL 204 Ca 0.14 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 1a05 h VAL 204 Cb 0.52 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1a05 h VAL 204 CO 0.03 0.25 0.23 0.74 0.02 0.00 0.00 177.57 178.83 1a05 h THR 205 N 1.16 1.16 0.19 2.57 2.02 -0.96 -0.89 112.91 118.16 1a05 h THR 205 Ca 0.30 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1a05 h THR 205 Cb -0.03 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1a05 h THR 205 CO -0.05 0.19 -0.09 -0.33 0.37 0.00 0.00 175.52 175.60 1a05 h GLU 206 N 0.67 -0.24 0.00 6.66 5.08 -0.40 -3.12 114.58 123.22 1a05 h GLU 206 Ca 0.17 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1a05 h GLU 206 Cb 0.08 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1a05 h GLU 206 CO -0.02 0.10 -0.09 0.28 -1.00 0.00 0.00 179.01 178.28 1a05 h VAL 207 N -0.63 0.61 -0.13 3.13 2.07 -1.06 -2.41 116.25 117.84 1a05 h VAL 207 Ca -0.03 -0.38 0.04 0.00 0.82 0.00 0.00 66.70 67.15 1a05 h VAL 207 Cb 0.46 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1a05 h VAL 207 CO 0.04 0.09 0.16 0.00 0.02 0.00 0.00 177.57 177.88 1a05 h ALA 208 N 1.91 1.69 0.00 1.67 0.00 -1.10 0.24 119.26 123.68 1a05 h ALA 208 Ca -0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1a05 h ALA 208 Cb 0.23 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1a05 h ALA 208 CO 0.01 -0.22 -0.10 0.00 0.00 0.00 0.00 179.25 178.94 1a05 h ARG 209 N 0.00 0.00 0.00 0.00 3.08 -1.54 -2.00 114.38 113.91 1a05 h ARG 209 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1a05 h ARG 209 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1a05 h ARG 209 CO -0.00 0.10 -0.17 -0.25 -1.07 0.00 0.00 179.97 178.58 1a05 n ASP 210 N -3.41 0.58 -3.41 7.04 8.00 0.07 -4.30 116.55 121.12 1a05 n ASP 210 Ca -0.01 0.40 -0.26 0.00 0.71 0.00 0.00 54.79 55.62 1a05 n ASP 210 Cb 0.26 -0.45 -0.08 0.00 -0.02 0.00 0.00 41.12 40.83 1a05 n ASP 210 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1a05 n TYR 211 N -2.00 2.66 0.32 1.24 4.02 -0.75 -4.92 117.16 117.72 1a05 n TYR 211 Ca 0.05 -4.02 0.21 0.00 -0.01 0.00 0.00 57.90 54.13 1a05 n TYR 211 Cb 0.40 -0.50 1.05 0.00 -0.02 0.00 0.00 39.34 40.28 1a05 n TYR 211 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1a05 h PRO 212 N 4.26 0.00 0.00 -0.72 0.13 -1.75 -2.42 132.00 131.49 1a05 h PRO 212 Ca 0.17 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1a05 h PRO 212 Cb 0.72 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 1a05 h PRO 212 CO 0.74 0.00 -0.10 0.38 -0.23 0.00 0.00 178.00 178.79 1a05 h ASP 213 N 0.00 0.00 -3.20 1.44 2.03 -1.92 -3.45 116.42 111.33 1a05 h ASP 213 Ca 0.00 0.00 -0.63 0.00 -0.73 0.00 0.00 57.03 55.67 1a05 h ASP 213 Cb 0.16 0.00 -0.14 0.00 -0.83 0.00 0.00 39.33 38.52 1a05 h ASP 213 CO 0.00 0.01 -0.55 0.54 -1.03 0.00 0.00 179.24 178.22 1a05 s VAL 214 N -3.22 4.94 -0.23 4.15 0.11 -0.91 -4.87 120.40 120.36 1a05 s VAL 214 Ca 0.06 0.01 -0.27 0.00 -2.93 0.00 0.00 61.98 58.85 1a05 s VAL 214 Cb 0.05 -3.21 0.00 0.00 -1.53 0.00 0.00 36.38 31.70 1a05 s VAL 214 CO 0.68 0.50 0.95 -0.60 -3.33 0.00 0.00 175.10 173.30 1a05 s ARG 215 N 0.04 4.23 -0.15 1.54 3.52 0.17 -4.93 118.95 123.36 1a05 s ARG 215 Ca 0.07 1.19 -0.06 0.00 -0.13 0.00 0.00 55.73 56.80 1a05 s ARG 215 Cb -0.12 -3.64 -0.04 0.00 -1.56 0.00 0.00 34.95 29.59 1a05 s ARG 215 CO 0.00 -0.58 0.06 -1.17 -0.81 0.00 0.00 175.30 172.80 1a05 s LEU 216 N 3.05 3.83 0.02 -0.88 2.96 -1.26 -0.96 118.68 125.44 1a05 s LEU 216 Ca 0.40 0.15 0.01 0.00 -0.22 0.00 0.00 54.13 54.47 1a05 s LEU 216 Cb -0.15 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 1a05 s LEU 216 CO 0.07 0.26 -0.03 -0.94 -1.32 0.00 0.00 176.35 174.38 1a05 s SER 217 N -0.12 0.31 0.08 3.68 1.04 -0.70 -5.01 113.70 112.98 1a05 s SER 217 Ca 0.07 -0.34 0.03 0.00 0.48 0.00 0.00 55.95 56.19 1a05 s SER 217 Cb -0.12 0.05 -0.04 0.00 0.10 0.00 0.00 66.02 66.01 1a05 s SER 217 CO 0.01 -0.17 0.07 -1.00 0.98 0.00 0.00 173.24 173.13 1a05 s HIS 218 N -0.93 3.16 -0.09 5.02 0.09 -1.26 -1.20 115.29 120.08 1a05 s HIS 218 Ca -0.09 0.07 -0.17 0.00 -0.00 0.00 0.00 55.06 54.86 1a05 s HIS 218 Cb -0.07 -1.61 0.04 0.00 -0.00 0.00 0.00 32.58 30.94 1a05 s HIS 218 CO -0.00 0.52 0.42 1.41 -0.00 0.00 0.00 174.74 177.09 1a05 s MET 219 N -2.37 0.66 0.33 1.40 0.00 -0.69 -4.93 119.30 113.70 1a05 s MET 219 Ca 0.29 0.24 -0.26 0.00 0.00 0.00 0.00 55.69 55.96 1a05 s MET 219 Cb -0.12 0.31 -0.10 0.00 0.00 0.00 0.00 34.83 34.92 1a05 s MET 219 CO 0.21 -0.15 0.95 0.71 0.00 0.00 0.00 175.02 176.74 1a05 s TYR 220 N -0.60 3.66 0.29 4.11 2.02 -1.26 -1.89 117.35 123.69 1a05 s TYR 220 Ca -0.07 1.77 0.04 0.00 -0.37 0.00 0.00 57.07 58.44 1a05 s TYR 220 Cb -0.03 -2.92 0.66 0.00 -0.40 0.00 0.00 41.96 39.27 1a05 s TYR 220 CO 0.03 0.18 1.79 -0.24 -1.57 0.00 0.00 175.55 175.75 1a05 h VAL 221 N 2.56 0.78 -0.37 0.71 3.04 -0.88 -0.72 116.25 121.38 1a05 h VAL 221 Ca -0.47 -0.29 -0.06 0.00 -1.01 0.00 0.00 66.70 64.87 1a05 h VAL 221 Cb 1.19 -0.13 -0.01 0.00 -2.01 0.00 0.00 31.29 30.33 1a05 h VAL 221 CO 0.65 0.15 -0.02 -2.24 -1.01 0.00 0.00 177.57 175.10 1a05 h ASP 222 N 0.83 0.65 -0.22 3.17 2.03 -1.93 -2.34 116.42 118.62 1a05 h ASP 222 Ca 0.54 -0.32 -0.06 0.00 -0.73 0.00 0.00 57.03 56.46 1a05 h ASP 222 Cb 0.75 -0.18 -0.02 0.00 -0.83 0.00 0.00 39.33 39.05 1a05 h ASP 222 CO -0.34 0.82 -0.04 -1.13 -1.03 0.00 0.00 179.24 177.52 1a05 h ASN 223 N 0.47 0.51 -0.59 4.15 -0.00 -1.69 -2.21 115.58 116.23 1a05 h ASN 223 Ca 0.10 -0.11 -0.06 0.00 -0.00 0.00 0.00 56.30 56.24 1a05 h ASN 223 Cb 0.50 -0.14 -0.03 0.00 -0.00 0.00 0.00 38.32 38.66 1a05 h ASN 223 CO 0.02 0.61 0.17 0.00 -0.00 0.00 0.00 177.43 178.23 1a05 h ALA 224 N 1.45 1.12 0.00 1.57 0.00 -0.98 0.12 119.26 122.54 1a05 h ALA 224 Ca 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1a05 h ALA 224 Cb 0.39 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1a05 h ALA 224 CO 0.02 0.60 -0.07 0.00 0.00 0.00 0.00 179.25 179.79 1a05 h ALA 225 N 1.25 1.65 0.01 0.00 0.00 -0.85 -0.85 119.26 120.48 1a05 h ALA 225 Ca 0.20 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1a05 h ALA 225 Cb 0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1a05 h ALA 225 CO -0.00 0.09 -0.43 0.52 0.00 0.00 0.00 179.25 179.42 1a05 h MET 226 N 0.00 0.02 -0.30 0.00 2.07 -1.11 -3.37 114.93 112.25 1a05 h MET 226 Ca -0.00 -0.04 0.05 0.00 -2.07 0.00 0.00 59.70 57.64 1a05 h MET 226 Cb 0.14 0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 29.87 1a05 h MET 226 CO 0.01 1.02 0.20 1.96 1.07 0.00 0.00 176.91 181.17 1a05 h GLN 227 N -0.94 0.17 -0.71 1.72 1.08 -0.49 -1.23 115.11 114.71 1a05 h GLN 227 Ca -0.11 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 1a05 h GLN 227 Cb 1.14 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 28.50 1a05 h GLN 227 CO -0.05 0.11 0.42 -0.07 -0.95 0.00 0.00 178.83 178.29 1a05 h LEU 228 N 0.17 0.86 0.03 1.46 3.38 -1.32 -1.90 115.31 117.99 1a05 h LEU 228 Ca 0.13 -0.07 -0.31 0.00 0.09 0.00 0.00 57.88 57.72 1a05 h LEU 228 Cb 0.30 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1a05 h LEU 228 CO -0.02 0.68 -1.76 2.30 0.09 0.00 0.00 178.44 179.73 1a05 n ILE 229 N -4.52 1.65 -0.11 1.22 -5.35 -1.04 -2.75 119.36 108.46 1a05 n ILE 229 Ca 0.06 -0.77 -0.10 0.00 -0.27 0.00 0.00 62.75 61.67 1a05 n ILE 229 Cb 0.06 -1.20 -0.02 0.00 -1.74 0.00 0.00 39.64 36.74 1a05 n ILE 229 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 1a05 h ARG 230 N 0.02 0.56 -0.68 6.28 2.43 -1.24 -3.40 114.38 118.35 1a05 h ARG 230 Ca -0.31 -0.15 -0.30 0.00 -0.81 0.00 0.00 59.98 58.41 1a05 h ARG 230 Cb 2.02 -0.06 -0.21 0.00 -0.42 0.00 0.00 29.97 31.30 1a05 h ARG 230 CO 0.08 0.64 -0.64 0.00 -1.51 0.00 0.00 179.97 178.54 1a05 n ALA 231 N -2.35 -0.48 0.19 2.80 0.00 -0.72 -5.02 120.51 114.94 1a05 n ALA 231 Ca -0.02 -1.85 0.17 0.00 0.00 0.00 0.00 53.44 51.75 1a05 n ALA 231 Cb 0.22 -1.22 0.81 0.00 0.00 0.00 0.00 19.45 19.26 1a05 n ALA 231 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1a05 h PRO 232 N 4.23 0.00 0.00 0.00 0.13 -1.54 -2.11 132.00 132.71 1a05 h PRO 232 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1a05 h PRO 232 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1a05 h PRO 232 CO 0.31 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.08 1a05 n ALA 233 N -2.35 1.99 0.32 -0.56 0.00 -1.26 -2.44 120.51 116.21 1a05 n ALA 233 Ca 0.02 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.51 1a05 n ALA 233 Cb 0.36 -1.29 0.29 0.00 0.00 0.00 0.00 19.45 18.81 1a05 n ALA 233 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 1a05 h GLN 234 N 0.00 0.00 -5.76 0.00 3.07 -1.74 -3.45 115.11 107.22 1a05 h GLN 234 Ca 0.00 0.00 -0.64 0.00 0.09 0.00 0.00 58.65 58.10 1a05 h GLN 234 Cb 0.16 0.00 -0.07 0.00 0.08 0.00 0.00 27.48 27.65 1a05 h GLN 234 CO 0.00 0.00 -0.36 -0.06 0.09 0.00 0.00 178.83 178.50 1a05 s PHE 235 N -3.24 3.63 0.00 0.06 0.08 -1.02 -5.00 117.98 112.49 1a05 s PHE 235 Ca 0.07 0.71 0.00 0.00 0.12 0.00 0.00 56.93 57.83 1a05 s PHE 235 Cb 0.07 -2.12 0.00 0.00 -0.57 0.00 0.00 43.02 40.40 1a05 s PHE 235 CO 0.63 0.65 0.00 -3.47 -0.10 0.00 0.00 175.22 172.93 1a05 n ASP 236 N 2.10 0.00 -4.40 1.36 2.03 -1.26 -4.47 116.55 111.90 1a05 n ASP 236 Ca -0.17 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 54.80 1a05 n ASP 236 Cb 0.54 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.80 1a05 n ASP 236 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1a05 s VAL 237 N 0.00 3.55 -0.27 5.18 1.01 -0.95 -0.80 120.40 128.12 1a05 s VAL 237 Ca 0.00 -0.46 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 1a05 s VAL 237 Cb 0.00 -2.57 0.02 0.00 0.00 0.00 0.00 36.38 33.83 1a05 s VAL 237 CO 0.00 0.47 0.02 -0.22 0.00 0.00 0.00 175.10 175.36 1a05 s LEU 238 N 0.80 3.54 -0.16 3.92 0.20 -0.40 -1.11 118.68 125.47 1a05 s LEU 238 Ca -0.02 -0.77 -0.07 0.00 0.69 0.00 0.00 54.13 53.96 1a05 s LEU 238 Cb -0.15 -1.78 -0.04 0.00 -0.43 0.00 0.00 46.19 43.79 1a05 s LEU 238 CO 0.02 -0.16 0.08 -0.22 -0.29 0.00 0.00 176.35 175.78 1a05 s LEU 239 N 1.42 3.99 0.23 -0.68 2.96 0.95 -1.58 118.68 125.98 1a05 s LEU 239 Ca 0.02 0.20 -0.21 0.00 -0.22 0.00 0.00 54.13 53.91 1a05 s LEU 239 Cb -0.17 -1.99 0.06 0.00 0.50 0.00 0.00 46.19 44.59 1a05 s LEU 239 CO -0.01 0.25 0.91 0.28 -1.32 0.00 0.00 176.35 176.47 1a05 s THR 240 N -0.08 0.00 0.87 3.68 -1.32 -1.04 -0.14 115.64 117.60 1a05 s THR 240 Ca 0.08 -0.76 -0.15 0.00 -1.21 0.00 0.00 61.69 59.65 1a05 s THR 240 Cb -0.12 -2.48 0.21 0.00 -1.51 0.00 0.00 72.50 68.61 1a05 s THR 240 CO 0.01 0.00 0.91 0.61 -2.21 0.00 0.00 174.62 173.93 1a05 n GLY 241 N -0.56 -2.21 0.49 6.08 0.00 -1.26 -2.08 105.19 105.66 1a05 n GLY 241 Ca -0.05 -1.57 -0.20 0.00 0.00 0.00 0.00 46.02 44.20 1a05 n GLY 241 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1a05 h ASN 242 N -1.95 -1.08 0.29 1.61 -0.73 -1.80 0.52 115.58 112.44 1a05 h ASN 242 Ca -0.32 0.05 -0.01 0.00 1.87 0.00 0.00 56.30 57.88 1a05 h ASN 242 Cb 0.94 0.29 0.00 0.00 0.27 0.00 0.00 38.32 39.83 1a05 h ASN 242 CO 0.22 -0.73 -0.14 -0.03 -0.37 0.00 0.00 177.43 176.38 1a05 h MET 243 N -1.19 -0.37 -0.53 6.67 4.05 -1.92 -0.14 114.93 121.50 1a05 h MET 243 Ca -0.11 0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.32 1a05 h MET 243 Cb 0.93 0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.79 1a05 h MET 243 CO 0.16 -0.14 0.29 0.74 0.23 0.00 0.00 176.91 178.19 1a05 h PHE 244 N -0.55 0.72 -0.68 1.39 0.04 -1.95 -1.96 116.94 113.96 1a05 h PHE 244 Ca -0.04 -0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.74 1a05 h PHE 244 Cb 0.40 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.28 1a05 h PHE 244 CO -0.02 0.53 0.45 0.78 -0.60 0.00 0.00 178.31 179.46 1a05 h GLY 245 N 0.71 0.94 0.95 -1.45 0.00 0.10 0.20 103.07 104.52 1a05 h GLY 245 Ca 0.19 -0.34 0.01 0.00 0.00 0.00 0.00 47.33 47.19 1a05 h GLY 245 CO -0.03 0.31 0.07 -1.80 0.00 0.00 0.00 176.54 175.09 1a05 h ASP 246 N 0.86 0.11 0.01 0.19 3.58 -0.26 -1.61 116.42 119.30 1a05 h ASP 246 Ca 0.26 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.72 1a05 h ASP 246 Cb -0.01 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.03 1a05 h ASP 246 CO -0.07 0.09 -0.01 0.40 -2.88 0.00 0.00 179.24 176.77 1a05 h ILE 247 N 0.16 1.44 -0.64 2.25 2.04 -0.96 -3.22 117.51 118.57 1a05 h ILE 247 Ca 0.06 -1.40 -0.04 0.00 1.00 0.00 0.00 64.86 64.47 1a05 h ILE 247 Cb 0.01 2.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.44 1a05 h ILE 247 CO -0.04 0.36 0.24 -0.07 0.00 0.00 0.00 178.15 178.64 1a05 h LEU 248 N -0.62 0.88 -0.93 1.44 3.38 -1.01 -2.41 115.31 116.04 1a05 h LEU 248 Ca -0.00 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 1a05 h LEU 248 Cb 0.60 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1a05 h LEU 248 CO 0.00 0.80 -0.00 -1.28 0.09 0.00 0.00 178.44 178.05 1a05 h SER 249 N 0.94 0.75 0.03 -0.43 0.87 -1.41 -0.23 113.55 114.05 1a05 h SER 249 Ca 0.22 -0.18 -0.12 0.00 -1.23 0.00 0.00 61.79 60.48 1a05 h SER 249 Cb 0.21 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1a05 h SER 249 CO -0.02 0.82 -0.37 0.44 -0.53 0.00 0.00 176.83 177.17 1a05 h ASP 250 N 0.73 0.48 -0.38 6.23 5.19 -1.50 -0.81 116.42 126.36 1a05 h ASP 250 Ca 0.14 -0.20 -0.15 0.00 -0.62 0.00 0.00 57.03 56.20 1a05 h ASP 250 Cb 0.45 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.82 1a05 h ASP 250 CO 0.02 0.81 -0.36 -0.08 -3.12 0.00 0.00 179.24 176.51 1a05 h GLU 251 N 0.39 0.91 -0.08 3.56 4.81 -0.95 -1.92 114.58 121.31 1a05 h GLU 251 Ca 0.04 -0.48 -0.09 0.00 -0.13 0.00 0.00 59.36 58.71 1a05 h GLU 251 Cb 0.83 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 1a05 h GLU 251 CO 0.07 1.13 -0.35 0.00 -0.73 0.00 0.00 179.01 179.13 1a05 h ALA 252 N 0.77 1.27 -0.40 2.92 0.00 -0.89 -2.86 119.26 120.07 1a05 h ALA 252 Ca 0.06 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.47 1a05 h ALA 252 Cb 0.96 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1a05 h ALA 252 CO 0.09 0.51 -0.32 0.77 0.00 0.00 0.00 179.25 180.30 1a05 h SER 253 N 0.14 0.95 -0.59 0.00 0.02 -0.92 -3.21 113.55 109.92 1a05 h SER 253 Ca 0.02 -0.40 -0.09 0.00 -0.84 0.00 0.00 61.79 60.48 1a05 h SER 253 Cb 0.69 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 1a05 h SER 253 CO 0.05 1.18 0.03 -0.61 -1.14 0.00 0.00 176.83 176.34 1a05 h GLN 254 N 0.76 1.05 0.00 3.45 5.75 -1.14 -2.98 115.11 122.00 1a05 h GLN 254 Ca 0.08 -0.31 0.00 0.00 -0.15 0.00 0.00 58.65 58.27 1a05 h GLN 254 Cb 0.89 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.34 1a05 h GLN 254 CO 0.08 1.00 0.00 1.37 -2.65 0.00 0.00 178.83 178.64 1a05 h LEU 255 N 0.96 0.00 -0.51 -2.39 8.10 -1.52 -0.89 115.31 119.06 1a05 h LEU 255 Ca 0.18 0.00 -0.13 0.00 0.11 0.00 0.00 57.88 58.04 1a05 h LEU 255 Cb 0.52 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.72 1a05 h LEU 255 CO 0.02 0.00 -0.61 0.71 -4.11 0.00 0.00 178.44 174.46 1a05 h THR 256 N 0.00 1.22 0.00 0.15 1.35 -1.56 -3.39 112.91 110.69 1a05 h THR 256 Ca 0.00 -2.25 0.00 0.00 -0.55 0.00 0.00 66.41 63.61 1a05 h THR 256 Cb 0.38 2.29 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 1a05 h THR 256 CO 0.00 0.59 0.00 0.61 -0.25 0.00 0.00 175.52 176.47 1a05 n GLY 257 N 0.67 2.97 3.20 5.82 0.00 -0.34 -3.88 105.19 113.63 1a05 n GLY 257 Ca -0.00 -0.79 -0.40 0.00 0.00 0.00 0.00 46.02 44.84 1a05 n GLY 257 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a05 s SER 258 N 0.00 5.60 0.49 1.61 0.01 -1.26 -4.76 113.70 115.38 1a05 s SER 258 Ca 0.00 -1.91 0.22 0.00 1.31 0.00 0.00 55.95 55.58 1a05 s SER 258 Cb 0.00 -1.97 1.26 0.00 0.21 0.00 0.00 66.02 65.52 1a05 s SER 258 CO 0.00 -0.65 2.03 -0.29 0.41 0.00 0.00 173.24 174.74 1a05 h ILE 259 N 6.18 0.79 0.00 1.44 2.10 -1.94 -2.66 117.51 123.42 1a05 h ILE 259 Ca -0.19 -0.61 0.00 0.00 1.08 0.00 0.00 64.86 65.13 1a05 h ILE 259 Cb 1.07 1.36 0.00 0.00 -1.09 0.00 0.00 36.82 38.16 1a05 h ILE 259 CO 0.82 0.15 0.00 0.61 -1.08 0.00 0.00 178.15 178.65 1a05 n GLY 260 N -0.78 -0.68 0.16 8.18 0.00 -1.26 -2.76 105.19 108.05 1a05 n GLY 260 Ca -0.02 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 45.94 1a05 n GLY 260 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1a05 n MET 261 N -0.93 2.45 -3.13 1.61 2.81 -1.00 -1.79 117.12 117.13 1a05 n MET 261 Ca 0.14 -0.39 -0.41 0.00 -1.81 0.00 0.00 57.70 55.24 1a05 n MET 261 Cb 0.06 -1.11 -0.07 0.00 -0.71 0.00 0.00 33.22 31.40 1a05 n MET 261 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1a05 s LEU 262 N -2.12 4.07 0.53 4.03 1.43 -1.11 -4.38 118.68 121.12 1a05 s LEU 262 Ca 0.08 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 53.84 1a05 s LEU 262 Cb 0.10 -2.82 0.03 0.00 0.03 0.00 0.00 46.19 43.52 1a05 s LEU 262 CO 0.39 -0.37 0.75 -2.16 0.23 0.00 0.00 176.35 175.19 1a05 s PRO 263 N 2.48 2.64 0.03 1.29 0.04 -1.26 -3.20 135.00 137.02 1a05 s PRO 263 Ca 0.25 -0.73 -0.20 0.00 0.04 0.00 0.00 61.00 60.36 1a05 s PRO 263 Cb -0.15 -2.50 0.04 0.00 0.04 0.00 0.00 34.50 31.92 1a05 s PRO 263 CO 0.09 -0.62 0.45 -1.54 0.04 0.00 0.00 177.00 175.41 1a05 s SER 264 N -4.39 -0.35 -0.03 6.66 1.04 -1.06 -4.29 113.70 111.29 1a05 s SER 264 Ca 0.56 0.13 0.00 0.00 0.48 0.00 0.00 55.95 57.12 1a05 s SER 264 Cb -0.10 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.48 1a05 s SER 264 CO 0.38 -0.64 0.02 0.00 0.98 0.00 0.00 173.24 173.98 1a05 s ALA 265 N -2.16 0.23 -0.36 5.32 0.00 -0.63 -3.28 121.76 120.87 1a05 s ALA 265 Ca -0.07 0.22 -0.03 0.00 0.00 0.00 0.00 51.96 52.08 1a05 s ALA 265 Cb -0.01 -0.32 0.08 0.00 0.00 0.00 0.00 23.12 22.87 1a05 s ALA 265 CO 0.00 -0.12 0.12 -1.12 0.00 0.00 0.00 175.76 174.64 1a05 s SER 266 N 1.13 5.13 -0.03 0.00 0.01 -0.06 0.42 113.70 120.30 1a05 s SER 266 Ca -0.08 -1.68 -0.03 0.00 1.31 0.00 0.00 55.95 55.46 1a05 s SER 266 Cb -0.13 -1.79 -0.04 0.00 0.21 0.00 0.00 66.02 64.27 1a05 s SER 266 CO -0.02 -0.42 0.15 -0.76 0.41 0.00 0.00 173.24 172.59 1a05 s LEU 267 N 1.20 4.27 0.00 2.44 1.43 0.15 -1.44 118.68 126.73 1a05 s LEU 267 Ca 0.03 0.33 0.02 0.00 -1.03 0.00 0.00 54.13 53.48 1a05 s LEU 267 Cb -0.21 -2.42 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 1a05 s LEU 267 CO -0.02 0.30 0.08 0.61 0.23 0.00 0.00 176.35 177.54 1a05 n GLY 268 N 1.23 3.71 3.58 -3.19 0.00 -0.30 -1.20 105.19 109.01 1a05 n GLY 268 Ca -0.13 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 1a05 n GLY 268 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a05 s GLU 269 N -2.41 3.33 0.00 1.61 0.41 -1.26 -3.45 118.70 116.94 1a05 s GLU 269 Ca 0.12 0.49 0.00 0.00 -0.41 0.00 0.00 54.97 55.17 1a05 s GLU 269 Cb 0.01 -4.11 0.00 0.00 -1.78 0.00 0.00 34.13 28.24 1a05 s GLU 269 CO 0.08 -1.90 0.00 0.41 -0.49 0.00 0.00 175.26 173.36 1a05 n GLY 270 N 5.24 0.67 3.23 -1.39 0.00 -1.26 -4.99 105.19 106.69 1a05 n GLY 270 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 1a05 n GLY 270 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a05 s ARG 271 N -0.29 1.01 -0.27 1.61 0.52 -1.22 -4.82 118.95 115.49 1a05 s ARG 271 Ca 0.00 -1.38 -0.25 0.00 -0.52 0.00 0.00 55.73 53.57 1a05 s ARG 271 Cb 0.00 -0.62 0.11 0.00 0.52 0.00 0.00 34.95 34.97 1a05 s ARG 271 CO 0.00 0.08 0.98 0.00 0.02 0.00 0.00 175.30 176.38 1a05 s ALA 272 N -3.09 -1.94 -0.02 2.13 0.00 -1.25 -1.15 121.76 116.44 1a05 s ALA 272 Ca 0.14 1.87 0.05 0.00 0.00 0.00 0.00 51.96 54.03 1a05 s ALA 272 Cb 0.01 -1.34 -0.01 0.00 0.00 0.00 0.00 23.12 21.78 1a05 s ALA 272 CO 0.00 -0.26 -0.17 1.41 0.00 0.00 0.00 175.76 176.75 1a05 s MET 273 N 0.15 1.43 -0.10 0.00 0.00 -0.52 0.89 119.30 121.14 1a05 s MET 273 Ca 0.02 -0.61 0.03 0.00 0.00 0.00 0.00 55.69 55.13 1a05 s MET 273 Cb -0.05 -1.36 0.01 0.00 0.00 0.00 0.00 34.83 33.43 1a05 s MET 273 CO -0.05 0.35 -0.18 0.71 0.00 0.00 0.00 175.02 175.86 1a05 s TYR 274 N -0.35 2.12 0.02 4.11 1.51 0.23 -0.88 117.35 124.12 1a05 s TYR 274 Ca 0.05 -0.93 -0.11 0.00 -1.01 0.00 0.00 57.07 55.08 1a05 s TYR 274 Cb -0.07 -1.48 0.01 0.00 -0.11 0.00 0.00 41.96 40.31 1a05 s TYR 274 CO -0.00 -0.43 0.23 -1.83 -1.11 0.00 0.00 175.55 172.41 1a05 s GLU 275 N 0.69 0.68 1.01 -0.62 -1.05 -1.20 -0.81 118.70 117.40 1a05 s GLU 275 Ca -0.12 -0.48 -0.17 0.00 -0.15 0.00 0.00 54.97 54.05 1a05 s GLU 275 Cb -0.16 0.29 0.22 0.00 -0.44 0.00 0.00 34.13 34.03 1a05 s GLU 275 CO 0.03 -0.20 1.28 -1.25 0.95 0.00 0.00 175.26 176.07 1a05 s PRO 276 N -2.15 0.29 -0.19 -4.83 0.04 -1.26 -2.56 135.00 124.35 1a05 s PRO 276 Ca -0.08 -0.34 0.15 0.00 0.04 0.00 0.00 61.00 60.77 1a05 s PRO 276 Cb -0.03 -1.80 0.44 0.00 0.04 0.00 0.00 34.50 33.15 1a05 s PRO 276 CO -0.01 -2.66 1.19 0.44 0.04 0.00 0.00 177.00 176.00 1a05 n ILE 277 N -3.96 1.71 0.81 0.56 -5.35 -1.19 -4.76 119.36 107.17 1a05 n ILE 277 Ca 0.15 -2.95 0.08 0.00 -0.27 0.00 0.00 62.75 59.76 1a05 n ILE 277 Cb 0.59 -0.01 -0.08 0.00 -1.74 0.00 0.00 39.64 38.40 1a05 n ILE 277 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1a05 n HIS 278 N -0.62 0.00 0.00 4.28 1.44 -1.26 -5.05 115.22 114.00 1a05 n HIS 278 Ca 0.21 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.92 1a05 n HIS 278 Cb 0.86 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.97 1a05 n HIS 278 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1a05 n GLY 279 N 1.37 -0.71 0.06 -1.39 0.00 -1.26 -4.58 105.19 98.68 1a05 n GLY 279 Ca 0.04 -1.73 0.15 0.00 0.00 0.00 0.00 46.02 44.49 1a05 n GLY 279 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a05 n SER 280 N -0.86 0.21 -3.58 1.61 3.41 -1.26 -4.88 113.62 108.26 1a05 n SER 280 Ca 0.00 -0.75 -0.19 0.00 -0.26 0.00 0.00 58.87 57.68 1a05 n SER 280 Cb 0.00 -0.09 0.01 0.00 -0.26 0.00 0.00 64.21 63.87 1a05 n SER 280 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a05 n ALA 281 N -0.97 -1.83 -0.30 7.33 0.00 -1.26 -1.72 120.51 121.76 1a05 n ALA 281 Ca 0.19 -0.23 0.19 0.00 0.00 0.00 0.00 53.44 53.59 1a05 n ALA 281 Cb 0.19 -0.86 0.46 0.00 0.00 0.00 0.00 19.45 19.24 1a05 n ALA 281 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1a05 h PRO 282 N 0.32 0.49 -0.53 0.00 0.11 -1.93 -2.67 132.00 127.80 1a05 h PRO 282 Ca -0.34 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1a05 h PRO 282 Cb 0.69 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.66 1a05 h PRO 282 CO 0.22 0.33 0.34 0.38 -0.21 0.00 0.00 178.00 179.06 1a05 h ASP 283 N 0.51 0.61 -0.42 -2.05 2.03 -2.01 -2.59 116.42 112.50 1a05 h ASP 283 Ca 0.55 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.83 1a05 h ASP 283 Cb 1.22 -0.15 0.00 0.00 -0.83 0.00 0.00 39.33 39.56 1a05 h ASP 283 CO -0.28 0.45 0.00 2.30 -1.03 0.00 0.00 179.24 180.68 1a05 n ILE 284 N -4.45 0.83 -1.68 4.15 -5.35 -1.03 -5.01 119.36 106.82 1a05 n ILE 284 Ca 0.05 -0.91 -0.45 0.00 -0.27 0.00 0.00 62.75 61.16 1a05 n ILE 284 Cb 0.06 0.64 -0.04 0.00 -1.74 0.00 0.00 39.64 38.56 1a05 n ILE 284 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1a05 n ALA 285 N 0.95 1.59 -1.23 -1.28 0.00 -0.98 -2.17 120.51 117.39 1a05 n ALA 285 Ca 0.15 0.36 -0.05 0.00 0.00 0.00 0.00 53.44 53.91 1a05 n ALA 285 Cb 0.49 -2.47 -0.02 0.00 0.00 0.00 0.00 19.45 17.44 1a05 n ALA 285 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a05 n GLY 286 N 3.94 0.72 0.62 0.00 0.00 -1.26 -4.91 105.19 104.30 1a05 n GLY 286 Ca 0.19 -0.82 0.07 0.00 0.00 0.00 0.00 46.02 45.46 1a05 n GLY 286 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1a05 n GLN 287 N -2.73 1.52 -2.65 1.61 6.02 -0.92 -4.96 117.38 115.27 1a05 n GLN 287 Ca -0.05 -1.59 -0.21 0.00 -0.01 0.00 0.00 57.00 55.14 1a05 n GLN 287 Cb 0.20 -1.28 0.01 0.00 1.02 0.00 0.00 30.24 30.19 1a05 n GLN 287 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1a05 n ASP 288 N 0.76 -5.81 -0.09 1.08 2.03 -1.26 -4.88 116.55 108.39 1a05 n ASP 288 Ca 0.10 -0.13 -0.10 0.00 0.52 0.00 0.00 54.79 55.18 1a05 n ASP 288 Cb 0.38 -4.74 -0.12 0.00 -0.72 0.00 0.00 41.12 35.92 1a05 n ASP 288 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1a05 n LYS 289 N -3.34 1.13 -1.60 -0.67 5.02 -1.26 -0.65 118.16 116.79 1a05 n LYS 289 Ca -0.18 0.03 -0.45 0.00 -2.02 0.00 0.00 58.31 55.69 1a05 n LYS 289 Cb 0.65 -1.41 -0.02 0.00 -0.02 0.00 0.00 35.03 34.23 1a05 n LYS 289 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a05 n ALA 290 N -2.74 -0.08 -2.47 7.82 0.00 -1.26 -4.36 120.51 117.42 1a05 n ALA 290 Ca -0.29 0.40 -0.43 0.00 0.00 0.00 0.00 53.44 53.12 1a05 n ALA 290 Cb 0.99 -2.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.35 1a05 n ALA 290 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1a05 s ASN 291 N -0.39 6.79 0.00 0.00 3.84 -1.26 -4.11 114.94 119.81 1a05 s ASN 291 Ca 0.61 1.29 0.26 0.00 0.21 0.00 0.00 52.86 55.23 1a05 s ASN 291 Cb -0.71 -2.54 0.97 0.00 -0.55 0.00 0.00 41.25 38.43 1a05 s ASN 291 CO 0.58 -0.96 1.70 -0.81 -2.79 0.00 0.00 177.10 174.82 1a05 n PRO 292 N 7.04 1.69 -0.03 0.43 -0.04 -1.26 -4.41 135.00 138.42 1a05 n PRO 292 Ca 0.14 -1.01 0.02 0.00 -0.04 0.00 0.00 63.50 62.61 1a05 n PRO 292 Cb 0.46 -1.46 0.34 0.00 -0.04 0.00 0.00 33.50 32.80 1a05 n PRO 292 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1a05 h LEU 293 N 2.35 0.53 -0.60 1.53 3.38 -1.91 -1.57 115.31 119.02 1a05 h LEU 293 Ca 0.00 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1a05 h LEU 293 Cb 0.50 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1a05 h LEU 293 CO 0.00 0.48 0.01 0.00 0.09 0.00 0.00 178.44 179.03 1a05 h ALA 294 N 1.60 0.80 -0.33 1.53 0.00 -1.55 -0.68 119.26 120.63 1a05 h ALA 294 Ca 0.14 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.59 1a05 h ALA 294 Cb 0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1a05 h ALA 294 CO -0.01 0.63 -0.45 1.15 0.00 0.00 0.00 179.25 180.57 1a05 h THR 295 N 0.94 1.28 -0.45 0.00 2.02 -1.79 -1.33 112.91 113.58 1a05 h THR 295 Ca 0.17 -1.63 -0.01 0.00 0.77 0.00 0.00 66.41 65.71 1a05 h THR 295 Cb 0.54 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 1a05 h THR 295 CO 0.03 0.54 0.23 0.40 0.37 0.00 0.00 175.52 177.09 1a05 h ILE 296 N 0.68 1.17 0.00 3.11 2.04 -1.14 0.25 117.51 123.63 1a05 h ILE 296 Ca 0.04 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 1a05 h ILE 296 Cb 1.04 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.76 1a05 h ILE 296 CO 0.10 0.18 -0.03 -0.07 0.00 0.00 0.00 178.15 178.33 1a05 h LEU 297 N 0.58 0.00 -0.19 1.44 3.38 -1.03 -0.86 115.31 118.63 1a05 h LEU 297 Ca 0.16 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.91 1a05 h LEU 297 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1a05 h LEU 297 CO -0.02 0.03 -0.94 0.28 0.09 0.00 0.00 178.44 177.88 1a05 h SER 298 N 0.00 0.31 -0.10 -0.43 0.02 -0.04 -2.03 113.55 111.28 1a05 h SER 298 Ca -0.00 -0.27 -0.11 0.00 -0.84 0.00 0.00 61.79 60.57 1a05 h SER 298 Cb 0.45 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1a05 h SER 298 CO 0.00 1.09 -0.30 0.58 -1.14 0.00 0.00 176.83 177.07 1a05 h VAL 299 N 0.12 1.28 -0.57 2.27 2.07 0.29 -1.76 116.25 119.95 1a05 h VAL 299 Ca -0.06 -1.39 -0.05 0.00 0.82 0.00 0.00 66.70 66.01 1a05 h VAL 299 Cb 1.60 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 32.73 1a05 h VAL 299 CO 0.15 0.45 0.14 0.00 0.02 0.00 0.00 177.57 178.32 1a05 h ALA 300 N 1.18 1.18 -0.21 1.67 0.00 -1.01 -0.50 119.26 121.56 1a05 h ALA 300 Ca 0.06 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1a05 h ALA 300 Cb 0.77 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1a05 h ALA 300 CO 0.06 0.56 -0.26 0.52 0.00 0.00 0.00 179.25 180.14 1a05 h MET 301 N 0.84 0.39 -0.44 0.00 2.86 -0.88 -2.70 114.93 115.01 1a05 h MET 301 Ca 0.18 -0.14 -0.15 0.00 -2.06 0.00 0.00 59.70 57.53 1a05 h MET 301 Cb 0.30 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1a05 h MET 301 CO -0.00 0.63 -0.30 1.98 1.06 0.00 0.00 176.91 180.27 1a05 h MET 302 N 0.35 0.98 -0.92 1.72 -1.53 -0.46 0.17 114.93 115.24 1a05 h MET 302 Ca 0.05 -0.47 0.01 0.00 -3.44 0.00 0.00 59.70 55.86 1a05 h MET 302 Cb 0.64 -0.01 -0.05 0.00 -0.55 0.00 0.00 31.60 31.64 1a05 h MET 302 CO 0.05 1.14 0.61 -0.07 0.14 0.00 0.00 176.91 178.77 1a05 h LEU 303 N 0.82 1.04 0.00 3.39 3.38 -0.88 0.12 115.31 123.18 1a05 h LEU 303 Ca 0.09 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1a05 h LEU 303 Cb 0.90 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1a05 h LEU 303 CO 0.08 0.75 -0.16 -0.09 0.09 0.00 0.00 178.44 179.11 1a05 h ARG 304 N 1.23 0.11 0.00 1.13 2.43 -1.36 0.74 114.38 118.66 1a05 h ARG 304 Ca 0.34 -0.12 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 1a05 h ARG 304 Cb -0.12 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1a05 h ARG 304 CO -0.08 0.88 -0.77 0.45 -1.51 0.00 0.00 179.97 178.94 1a05 h HIS 305 N -0.61 0.00 0.00 2.20 3.86 -0.61 -3.38 115.15 116.61 1a05 h HIS 305 Ca -0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1a05 h HIS 305 Cb 0.94 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.41 1a05 h HIS 305 CO 0.19 0.16 -0.94 0.43 0.86 0.00 0.00 177.93 178.64 1a05 n SER 306 N -2.89 0.78 -0.27 2.45 7.64 0.31 -4.82 113.62 116.84 1a05 n SER 306 Ca -0.00 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.02 1a05 n SER 306 Cb 0.62 0.00 0.67 0.00 -1.01 0.00 0.00 64.21 64.49 1a05 n SER 306 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1a05 n LEU 307 N -2.86 0.83 -3.83 -3.43 4.77 -0.48 -4.93 117.00 107.08 1a05 n LEU 307 Ca 0.00 -0.29 -0.25 0.00 -0.03 0.00 0.00 56.01 55.43 1a05 n LEU 307 Cb 0.47 -0.01 0.02 0.00 -2.33 0.00 0.00 43.42 41.57 1a05 n LEU 307 CO 0.00 0.15 -0.04 -3.20 -1.33 0.00 0.00 177.39 172.97 1a05 n ASN 308 N -0.33 -2.24 -2.66 -1.43 4.05 -0.68 -4.91 115.26 107.06 1a05 n ASN 308 Ca 0.20 -0.85 -0.24 0.00 0.45 0.00 0.00 54.58 54.15 1a05 n ASN 308 Cb 0.24 -3.78 -0.01 0.00 1.23 0.00 0.00 39.78 37.46 1a05 n ASN 308 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1a05 n ALA 309 N -4.43 4.53 -0.17 5.20 0.00 0.25 -4.94 120.51 120.95 1a05 n ALA 309 Ca -0.18 -4.18 -0.04 0.00 0.00 0.00 0.00 53.44 49.04 1a05 n ALA 309 Cb 0.62 -0.67 0.03 0.00 0.00 0.00 0.00 19.45 19.43 1a05 n ALA 309 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1a05 h GLU 310 N 2.77 -0.09 -0.62 0.00 4.57 -1.85 0.54 114.58 119.89 1a05 h GLU 310 Ca 0.19 0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.40 1a05 h GLU 310 Cb 0.86 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.44 1a05 h GLU 310 CO 0.77 -0.06 0.41 -1.00 -1.18 0.00 0.00 179.01 177.95 1a05 h PRO 311 N -0.10 0.74 0.00 0.92 0.13 -1.95 0.76 132.00 132.50 1a05 h PRO 311 Ca 0.25 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 65.26 1a05 h PRO 311 Cb 0.48 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.43 1a05 h PRO 311 CO -0.60 0.49 -0.35 -1.49 -0.23 0.00 0.00 178.00 175.82 1a05 h TRP 312 N 0.76 0.00 -0.34 1.56 4.06 -1.58 -2.18 115.95 118.22 1a05 h TRP 312 Ca 0.25 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 61.05 1a05 h TRP 312 Cb 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.20 1a05 h TRP 312 CO -0.00 0.35 -0.34 0.00 -3.56 0.00 0.00 178.44 174.90 1a05 h ALA 313 N 1.65 0.51 -0.61 1.49 0.00 0.17 -2.52 119.26 119.94 1a05 h ALA 313 Ca -0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.39 1a05 h ALA 313 Cb 1.20 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1a05 h ALA 313 CO 0.05 0.57 0.03 1.96 0.00 0.00 0.00 179.25 181.85 1a05 h GLN 314 N 0.62 1.04 -0.48 0.00 4.20 -0.83 -2.18 115.11 117.50 1a05 h GLN 314 Ca 0.06 -0.31 -0.06 0.00 0.06 0.00 0.00 58.65 58.39 1a05 h GLN 314 Cb 0.92 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.57 1a05 h GLN 314 CO 0.08 1.00 0.03 0.00 -0.67 0.00 0.00 178.83 179.28 1a05 h ARG 315 N 0.96 0.77 -0.34 1.46 3.08 -1.31 0.73 114.38 119.72 1a05 h ARG 315 Ca 0.18 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 1a05 h ARG 315 Cb 0.52 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 1a05 h ARG 315 CO 0.02 0.76 -0.12 0.28 -1.07 0.00 0.00 179.97 179.84 1a05 h VAL 316 N 0.72 1.28 -0.52 2.04 2.07 -1.31 0.10 116.25 120.64 1a05 h VAL 316 Ca 0.15 -1.21 -0.08 0.00 0.82 0.00 0.00 66.70 66.38 1a05 h VAL 316 Cb 0.40 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1a05 h VAL 316 CO 0.01 0.39 -0.01 -0.33 0.02 0.00 0.00 177.57 177.66 1a05 h GLU 317 N 0.47 0.89 -0.11 1.57 5.08 -0.89 -1.89 114.58 119.69 1a05 h GLU 317 Ca 0.08 -0.26 -0.11 0.00 -1.00 0.00 0.00 59.36 58.08 1a05 h GLU 317 Cb 0.64 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1a05 h GLU 317 CO 0.04 0.89 -0.43 0.00 -1.00 0.00 0.00 179.01 178.51 1a05 h ALA 318 N 1.17 1.08 -0.12 3.43 0.00 0.62 -2.79 119.26 122.66 1a05 h ALA 318 Ca 0.15 -0.42 -0.14 0.00 0.00 0.00 0.00 54.91 54.50 1a05 h ALA 318 Cb 0.50 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1a05 h ALA 318 CO 0.02 0.60 -0.55 0.00 0.00 0.00 0.00 179.25 179.33 1a05 h ALA 319 N 1.35 0.85 -0.27 0.00 0.00 -0.48 -1.45 119.26 119.25 1a05 h ALA 319 Ca 0.02 -0.51 -0.14 0.00 0.00 0.00 0.00 54.91 54.28 1a05 h ALA 319 Cb 0.84 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1a05 h ALA 319 CO 0.07 0.69 -0.39 0.28 0.00 0.00 0.00 179.25 179.90 1a05 h VAL 320 N 0.26 1.29 -0.18 0.00 2.07 -1.21 -1.36 116.25 117.12 1a05 h VAL 320 Ca 0.00 -1.55 -0.06 0.00 0.82 0.00 0.00 66.70 65.91 1a05 h VAL 320 Cb 1.05 1.51 -0.00 0.00 -1.52 0.00 0.00 31.29 32.32 1a05 h VAL 320 CO 0.09 0.50 -0.11 -0.61 0.02 0.00 0.00 177.57 177.46 1a05 h GLN 321 N 0.52 0.40 -0.52 1.57 5.75 -1.37 -2.79 115.11 118.68 1a05 h GLN 321 Ca 0.05 -0.18 0.07 0.00 -0.15 0.00 0.00 58.65 58.43 1a05 h GLN 321 Cb 0.91 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 29.39 1a05 h GLN 321 CO 0.08 0.72 0.20 0.00 -2.65 0.00 0.00 178.83 177.18 1a05 h ARG 322 N 0.08 0.38 -0.96 1.69 2.47 -1.13 -0.94 114.38 115.96 1a05 h ARG 322 Ca 0.04 -0.02 0.06 0.00 -1.26 0.00 0.00 59.98 58.80 1a05 h ARG 322 Cb 0.61 -0.08 -0.06 0.00 -1.65 0.00 0.00 29.97 28.78 1a05 h ARG 322 CO 0.03 0.25 0.63 0.28 0.56 0.00 0.00 179.97 181.71 1a05 h VAL 323 N 0.39 1.09 -0.31 2.04 2.07 -1.20 -0.88 116.25 119.45 1a05 h VAL 323 Ca 0.25 -0.39 -0.16 0.00 0.82 0.00 0.00 66.70 67.22 1a05 h VAL 323 Cb 0.26 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 1a05 h VAL 323 CO -0.24 0.21 -0.46 -0.07 0.02 0.00 0.00 177.57 177.03 1a05 h LEU 324 N 1.13 0.87 -1.29 2.57 3.38 -1.03 -2.36 115.31 118.58 1a05 h LEU 324 Ca 0.41 -0.42 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1a05 h LEU 324 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1a05 h LEU 324 CO -0.16 1.19 -0.10 0.44 0.09 0.00 0.00 178.44 179.91 1a05 h ASP 325 N 0.64 0.35 0.52 -0.43 3.32 -0.50 -0.72 116.42 119.60 1a05 h ASP 325 Ca 0.04 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1a05 h ASP 325 Cb 1.03 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1a05 h ASP 325 CO 0.10 0.48 0.00 0.00 -1.72 0.00 0.00 179.24 178.10 1a05 n GLN 326 N -4.26 0.03 -1.38 3.56 6.02 -0.40 -4.87 117.38 116.08 1a05 n GLN 326 Ca 0.00 0.21 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 1a05 n GLN 326 Cb 0.27 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.03 1a05 n GLN 326 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1a05 n GLY 327 N 0.15 0.45 3.70 1.08 0.00 -0.28 -5.03 105.19 105.27 1a05 n GLY 327 Ca 0.04 -0.93 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 1a05 n GLY 327 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a05 s LEU 328 N 0.00 4.27 -0.02 0.99 1.43 -0.91 -4.90 118.68 119.54 1a05 s LEU 328 Ca 0.00 1.20 -0.01 0.00 -1.03 0.00 0.00 54.13 54.30 1a05 s LEU 328 Cb 0.00 -3.15 0.02 0.00 0.03 0.00 0.00 46.19 43.09 1a05 s LEU 328 CO 0.00 -0.22 0.04 -0.13 0.23 0.00 0.00 176.35 176.27 1a05 s ARG 329 N 1.26 -0.01 0.55 1.70 1.81 -1.26 -4.56 118.95 118.45 1a05 s ARG 329 Ca 0.38 0.17 -0.05 0.00 -1.72 0.00 0.00 55.73 54.51 1a05 s ARG 329 Cb -0.18 -0.17 -0.00 0.00 -0.45 0.00 0.00 34.95 34.15 1a05 s ARG 329 CO 0.17 -0.13 0.85 0.95 -0.68 0.00 0.00 175.30 176.47 1a05 s THR 330 N 0.82 3.91 0.27 0.02 -4.23 -1.26 -0.33 115.64 114.84 1a05 s THR 330 Ca -0.07 -0.02 -0.05 0.00 -1.18 0.00 0.00 61.69 60.36 1a05 s THR 330 Cb -0.10 -3.52 0.38 0.00 1.34 0.00 0.00 72.50 70.60 1a05 s THR 330 CO -0.03 -0.52 1.59 0.00 -0.54 0.00 0.00 174.62 175.13 1a05 h ALA 331 N -0.04 0.81 -0.36 3.99 0.00 -1.76 -1.63 119.26 120.28 1a05 h ALA 331 Ca -0.46 0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1a05 h ALA 331 Cb 1.25 0.61 -0.02 0.00 0.00 0.00 0.00 17.79 19.63 1a05 h ALA 331 CO 0.60 -0.45 0.23 0.38 0.00 0.00 0.00 179.25 180.01 1a05 h ASP 332 N 0.02 0.41 -0.34 0.00 2.03 -1.93 -2.70 116.42 113.91 1a05 h ASP 332 Ca 0.48 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.77 1a05 h ASP 332 Cb 0.85 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 39.25 1a05 h ASP 332 CO -0.88 0.30 0.00 2.30 -1.03 0.00 0.00 179.24 179.93 1a05 n ILE 333 N -4.48 1.72 -3.69 4.15 -5.35 -0.68 -4.99 119.36 106.04 1a05 n ILE 333 Ca 0.02 -1.44 -0.36 0.00 -0.27 0.00 0.00 62.75 60.69 1a05 n ILE 333 Cb 0.07 0.09 -0.07 0.00 -1.74 0.00 0.00 39.64 37.99 1a05 n ILE 333 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1a05 s ALA 334 N -1.98 3.72 0.50 -1.28 0.00 -0.81 -4.81 121.76 117.10 1a05 s ALA 334 Ca 0.35 -0.54 -0.20 0.00 0.00 0.00 0.00 51.96 51.57 1a05 s ALA 334 Cb 0.25 -2.20 -0.08 0.00 0.00 0.00 0.00 23.12 21.09 1a05 s ALA 334 CO 0.13 0.33 1.05 0.00 0.00 0.00 0.00 175.76 177.27 1a05 s ALA 335 N -0.24 2.84 0.22 0.00 0.00 -1.26 -4.95 121.76 118.37 1a05 s ALA 335 Ca 0.15 0.62 -0.32 0.00 0.00 0.00 0.00 51.96 52.41 1a05 s ALA 335 Cb -0.13 -3.26 -0.13 0.00 0.00 0.00 0.00 23.12 19.60 1a05 s ALA 335 CO 0.04 -0.40 1.63 -2.30 0.00 0.00 0.00 175.76 174.72 1a05 n PRO 336 N -1.08 2.52 -0.94 0.00 -0.02 -1.26 -1.47 135.00 132.75 1a05 n PRO 336 Ca 0.10 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 1a05 n PRO 336 Cb 0.52 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 1a05 n PRO 336 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1a05 n GLY 337 N 3.27 0.52 3.90 -1.23 0.00 -1.26 -5.04 105.19 105.35 1a05 n GLY 337 Ca 0.14 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1a05 n GLY 337 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a05 s THR 338 N -2.00 5.21 0.37 2.61 2.01 -0.54 -5.07 115.64 118.22 1a05 s THR 338 Ca 0.00 -0.53 -0.28 0.00 0.31 0.00 0.00 61.69 61.18 1a05 s THR 338 Cb 0.00 -3.57 -0.11 0.00 0.01 0.00 0.00 72.50 68.83 1a05 s THR 338 CO 0.00 0.08 1.48 -2.84 -0.69 0.00 0.00 174.62 172.65 1a05 s PRO 339 N -2.66 4.13 -0.06 4.92 0.02 -1.26 -4.86 135.00 135.24 1a05 s PRO 339 Ca 0.34 2.54 0.03 0.00 0.02 0.00 0.00 61.00 63.93 1a05 s PRO 339 Cb -0.12 -2.98 0.01 0.00 0.02 0.00 0.00 34.50 31.42 1a05 s PRO 339 CO 0.27 -0.51 -0.14 0.08 -0.33 0.00 0.00 177.00 176.37 1a05 s VAL 340 N -1.04 1.24 0.24 3.83 1.01 -1.26 -4.29 120.40 120.13 1a05 s VAL 340 Ca 0.53 -0.57 0.09 0.00 0.00 0.00 0.00 61.98 62.03 1a05 s VAL 340 Cb -0.46 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 1a05 s VAL 340 CO 0.61 0.37 -0.03 0.27 0.00 0.00 0.00 175.10 176.32 1a05 s ILE 341 N 0.39 3.39 1.01 2.22 -4.36 0.55 -4.97 121.20 119.44 1a05 s ILE 341 Ca -0.10 -1.81 -0.17 0.00 -0.26 0.00 0.00 60.65 58.31 1a05 s ILE 341 Cb -0.14 -2.77 0.23 0.00 1.25 0.00 0.00 42.46 41.04 1a05 s ILE 341 CO 0.03 -0.28 1.35 -0.83 0.24 0.00 0.00 174.94 175.45 1a05 s GLY 342 N -3.38 1.81 0.06 6.27 0.00 -1.26 -4.21 107.32 106.62 1a05 s GLY 342 Ca 0.29 -1.32 -0.29 0.00 0.00 0.00 0.00 44.72 43.40 1a05 s GLY 342 CO 0.18 -0.48 1.58 -0.84 0.00 0.00 0.00 173.10 173.54 1a05 h THR 343 N -1.84 0.53 -0.27 0.90 2.02 -1.03 -1.69 112.91 111.53 1a05 h THR 343 Ca -0.44 -0.11 0.03 0.00 0.77 0.00 0.00 66.41 66.67 1a05 h THR 343 Cb 1.21 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 68.17 1a05 h THR 343 CO 0.31 0.02 0.07 0.50 0.37 0.00 0.00 175.52 176.79 1a05 h LYS 344 N -0.70 0.17 -0.76 6.66 3.64 -1.88 -1.82 116.57 121.87 1a05 h LYS 344 Ca -0.07 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 1a05 h LYS 344 Cb 0.52 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.27 1a05 h LYS 344 CO 0.11 0.11 0.41 0.00 -2.27 0.00 0.00 179.45 177.81 1a05 h ALA 345 N 1.19 0.97 -0.41 5.00 0.00 -1.94 -1.69 119.26 122.37 1a05 h ALA 345 Ca 0.12 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1a05 h ALA 345 Cb 0.11 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1a05 h ALA 345 CO -0.15 0.49 0.14 1.98 0.00 0.00 0.00 179.25 181.71 1a05 h MET 346 N 1.05 0.60 -0.34 0.00 1.85 -0.96 0.12 114.93 117.24 1a05 h MET 346 Ca 0.26 -0.09 -0.15 0.00 -0.61 0.00 0.00 59.70 59.11 1a05 h MET 346 Cb 0.05 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 31.96 1a05 h MET 346 CO -0.04 0.52 -0.40 0.78 -0.40 0.00 0.00 176.91 177.37 1a05 h GLY 347 N 0.77 0.91 1.40 1.39 0.00 -0.68 -2.60 103.07 104.26 1a05 h GLY 347 Ca 0.14 -0.93 -0.13 0.00 0.00 0.00 0.00 47.33 46.41 1a05 h GLY 347 CO -0.01 0.84 -0.36 0.00 0.00 0.00 0.00 176.54 177.01 1a05 h ALA 348 N 0.86 0.81 -0.74 3.60 0.00 -0.74 -2.50 119.26 120.56 1a05 h ALA 348 Ca 0.05 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1a05 h ALA 348 Cb 0.97 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1a05 h ALA 348 CO 0.09 0.65 0.47 0.00 0.00 0.00 0.00 179.25 180.45 1a05 h ALA 349 N 1.04 0.94 -0.31 0.00 0.00 -0.67 0.14 119.26 120.41 1a05 h ALA 349 Ca 0.06 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1a05 h ALA 349 Cb 0.88 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1a05 h ALA 349 CO 0.08 0.38 0.03 0.28 0.00 0.00 0.00 179.25 180.02 1a05 h VAL 350 N 1.00 1.24 -0.70 0.00 2.07 -1.32 0.50 116.25 119.05 1a05 h VAL 350 Ca 0.27 -0.86 0.01 0.00 0.82 0.00 0.00 66.70 66.94 1a05 h VAL 350 Cb -0.07 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 1a05 h VAL 350 CO -0.05 0.28 0.46 0.58 0.02 0.00 0.00 177.57 178.85 1a05 h VAL 351 N 0.33 1.16 -0.38 2.57 2.07 -1.06 -1.66 116.25 119.29 1a05 h VAL 351 Ca 0.09 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 1a05 h VAL 351 Cb 0.38 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1a05 h VAL 351 CO 0.01 0.17 -0.05 0.78 0.02 0.00 0.00 177.57 178.50 1a05 h ASN 352 N 0.93 0.71 0.10 0.57 -0.26 -0.48 -2.52 115.58 114.62 1a05 h ASN 352 Ca 0.26 -0.34 0.00 0.00 -0.56 0.00 0.00 56.30 55.66 1a05 h ASN 352 Cb -0.09 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 36.98 1a05 h ASN 352 CO -0.06 0.88 0.00 0.00 -1.06 0.00 0.00 177.43 177.19 1a05 n ALA 353 N -2.42 1.64 0.46 -0.83 0.00 0.17 -1.22 120.51 118.31 1a05 n ALA 353 Ca -0.01 -0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.51 1a05 n ALA 353 Cb 0.32 -1.13 0.40 0.00 0.00 0.00 0.00 19.45 19.05 1a05 n ALA 353 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1a05 h LEU 354 N 0.00 0.00 -2.13 0.00 -0.00 -0.87 -3.42 115.31 108.90 1a05 h LEU 354 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.88 57.46 1a05 h LEU 354 Cb 0.05 0.00 0.06 0.00 -0.00 0.00 0.00 40.66 40.77 1a05 h LEU 354 CO 0.00 0.00 -0.86 0.59 -0.00 0.00 0.00 178.44 178.17 1a05 n ASN 355 N -2.51 -2.25 -1.70 -0.43 3.02 -0.36 -5.01 115.26 106.02 1a05 n ASN 355 Ca 0.04 -0.87 0.00 0.00 -0.03 0.00 0.00 54.58 53.72 1a05 n ASN 355 Cb 0.40 -3.88 0.00 0.00 -0.61 0.00 0.00 39.78 35.68 1a05 n ASN 355 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1a05 n LEU 356 N -4.19 0.00 0.00 3.41 4.77 -1.26 -5.18 117.00 114.54 1a05 n LEU 356 Ca -0.25 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1a05 n LEU 356 Cb 0.66 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1a05 n LEU 356 CO 0.68 -0.04 0.00 1.17 -1.33 0.00 0.00 177.39 177.87