#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qee n SER 2 N 0.00 -5.08 -4.49 1.45 7.64 -1.26 -4.75 113.62 107.13 2qee n SER 2 Ca 0.00 0.96 -0.43 0.00 1.01 0.00 0.00 58.87 60.41 2qee n SER 2 Cb 0.00 -3.78 -0.07 0.00 -1.01 0.00 0.00 64.21 59.35 2qee n SER 2 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2qee s ILE 3 N -4.61 4.85 -0.07 0.44 1.01 -1.26 -4.85 121.20 116.71 2qee s ILE 3 Ca 0.00 -0.10 0.12 0.00 0.00 0.00 0.00 60.65 60.67 2qee s ILE 3 Cb 0.00 -4.23 0.22 0.00 0.01 0.00 0.00 42.46 38.46 2qee s ILE 3 CO 0.00 -0.66 1.10 -0.46 0.00 0.00 0.00 174.94 174.93 2qee n ASN 4 N 6.22 1.10 -3.63 3.58 6.94 -1.26 -4.76 115.26 123.45 2qee n ASN 4 Ca -0.03 -2.58 -0.10 0.00 -0.02 0.00 0.00 54.58 51.84 2qee n ASN 4 Cb 0.47 -0.33 -0.04 0.00 -2.36 0.00 0.00 39.78 37.52 2qee n ASN 4 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2qee s SER 5 N -2.03 -0.31 0.31 0.53 1.04 -1.26 -5.02 113.70 106.96 2qee s SER 5 Ca 0.20 -0.31 0.03 0.00 0.48 0.00 0.00 55.95 56.35 2qee s SER 5 Cb 0.20 0.54 0.61 0.00 0.10 0.00 0.00 66.02 67.46 2qee s SER 5 CO -0.03 -0.95 1.88 -0.09 0.98 0.00 0.00 173.24 175.04 2qee h ARG 6 N 2.23 0.91 -0.46 4.02 2.43 -1.97 -1.02 114.38 120.51 2qee h ARG 6 Ca -0.32 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 58.76 2qee h ARG 6 Cb 1.27 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 2qee h ARG 6 CO 0.42 0.60 0.16 1.49 -1.51 0.00 0.00 179.97 181.13 2qee h GLU 7 N 0.93 0.71 -0.46 0.20 4.81 -2.00 0.06 114.58 118.83 2qee h GLU 7 Ca 0.43 -0.14 -0.12 0.00 -0.13 0.00 0.00 59.36 59.39 2qee h GLU 7 Cb 0.39 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2qee h GLU 7 CO -0.19 0.66 -0.19 0.28 -0.73 0.00 0.00 179.01 178.84 2qee h VAL 8 N 0.61 1.27 -0.81 0.32 2.07 -1.89 -2.80 116.25 115.03 2qee h VAL 8 Ca 0.15 -1.35 0.05 0.00 0.82 0.00 0.00 66.70 66.38 2qee h VAL 8 Cb 0.23 1.15 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 2qee h VAL 8 CO -0.01 0.46 0.50 0.25 0.02 0.00 0.00 177.57 178.79 2qee h LEU 9 N 0.79 0.80 -0.69 2.57 5.85 -0.84 -1.26 115.31 122.53 2qee h LEU 9 Ca 0.11 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2qee h LEU 9 Cb 0.76 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 2qee h LEU 9 CO 0.06 0.53 0.45 0.00 -0.34 0.00 0.00 178.44 179.13 2qee h ALA 10 N 1.37 0.88 0.05 1.25 0.00 -0.77 0.25 119.26 122.29 2qee h ALA 10 Ca 0.34 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2qee h ALA 10 Cb 0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2qee h ALA 10 CO -0.15 0.32 -0.06 0.93 0.00 0.00 0.00 179.25 180.28 2qee h GLU 11 N 0.94 -0.13 -0.42 0.00 5.08 -1.16 -1.72 114.58 117.16 2qee h GLU 11 Ca 0.25 0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.49 2qee h GLU 11 Cb -0.09 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2qee h GLU 11 CO -0.05 -0.09 -0.25 0.87 -1.00 0.00 0.00 179.01 178.49 2qee h LYS 12 N -0.14 0.91 -0.34 2.33 1.79 -0.49 -1.95 116.57 118.68 2qee h LYS 12 Ca 0.01 -0.42 -0.04 0.00 -2.18 0.00 0.00 60.65 58.02 2qee h LYS 12 Cb 0.14 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2qee h LYS 12 CO -0.03 1.07 0.06 0.28 -1.08 0.00 0.00 179.45 179.75 2qee h VAL 13 N 0.74 1.23 -0.75 0.50 2.07 -0.49 -0.68 116.25 118.88 2qee h VAL 13 Ca 0.09 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 2qee h VAL 13 Cb 0.83 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 2qee h VAL 13 CO 0.07 0.27 0.42 0.11 0.02 0.00 0.00 177.57 178.46 2qee h LYS 14 N 0.39 1.04 -0.15 1.57 1.57 -1.21 0.13 116.57 119.91 2qee h LYS 14 Ca 0.10 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2qee h LYS 14 Cb 0.34 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2qee h LYS 14 CO 0.01 0.76 0.10 -0.91 -0.57 0.00 0.00 179.45 178.84 2qee h ASN 15 N 1.03 0.17 -0.05 0.86 2.35 -1.23 0.18 115.58 118.89 2qee h ASN 15 Ca 0.26 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 2qee h ASN 15 Cb 0.02 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 2qee h ASN 15 CO -0.04 0.13 0.03 0.00 -1.65 0.00 0.00 177.43 175.89 2qee h ALA 16 N 1.05 0.06 -0.27 -0.83 0.00 -0.54 -0.40 119.26 118.34 2qee h ALA 16 Ca 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2qee h ALA 16 Cb -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2qee h ALA 16 CO -0.01 -0.43 0.14 0.28 0.00 0.00 0.00 179.25 179.22 2qee h VAL 17 N 0.05 1.14 -0.86 0.00 2.07 -0.57 -0.91 116.25 117.17 2qee h VAL 17 Ca 0.02 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 2qee h VAL 17 Cb 0.01 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 2qee h VAL 17 CO -0.00 0.14 0.51 0.78 0.02 0.00 0.00 177.57 179.01 2qee h ASN 18 N 0.31 1.05 1.68 0.57 2.35 -0.54 -3.16 115.58 117.85 2qee h ASN 18 Ca 0.09 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2qee h ASN 18 Cb 0.10 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.21 2qee h ASN 18 CO -0.01 0.81 -0.26 0.78 -1.65 0.00 0.00 177.43 177.10 2qee h ASN 19 N 1.20 0.00 -2.75 5.81 -0.26 -0.85 -3.46 115.58 115.27 2qee h ASN 19 Ca 0.31 -0.01 -0.56 0.00 -0.56 0.00 0.00 56.30 55.48 2qee h ASN 19 Cb -0.03 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.21 2qee h ASN 19 CO -0.06 0.00 1.01 -1.58 -1.06 0.00 0.00 177.43 175.75 2qee s GLN 20 N -3.24 4.18 0.29 0.81 2.00 -0.37 -4.98 119.66 118.36 2qee s GLN 20 Ca 0.05 1.93 -0.30 0.00 -2.00 0.00 0.00 55.36 55.05 2qee s GLN 20 Cb 0.07 -3.89 -0.11 0.00 0.80 0.00 0.00 33.01 29.88 2qee s GLN 20 CO 0.69 -0.81 1.47 -2.14 -0.50 0.00 0.00 175.29 174.00 2qee s PRO 21 N 3.84 4.22 -0.09 1.67 0.02 -1.26 -4.93 135.00 138.47 2qee s PRO 21 Ca 0.65 2.40 -0.15 0.00 0.02 0.00 0.00 61.00 63.92 2qee s PRO 21 Cb -0.28 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 31.13 2qee s PRO 21 CO 0.23 -0.46 0.37 0.08 -0.33 0.00 0.00 177.00 176.89 2qee s VAL 22 N -0.31 5.19 -0.26 3.83 1.01 0.95 -4.65 120.40 126.16 2qee s VAL 22 Ca 0.58 0.73 -0.15 0.00 0.00 0.00 0.00 61.98 63.14 2qee s VAL 22 Cb -0.44 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 2qee s VAL 22 CO 0.48 0.46 0.39 -0.89 0.00 0.00 0.00 175.10 175.55 2qee s THR 23 N -0.19 5.17 -0.53 3.92 2.01 -0.65 -0.28 115.64 125.09 2qee s THR 23 Ca 0.21 0.63 -0.17 0.00 0.31 0.00 0.00 61.69 62.67 2qee s THR 23 Cb -0.15 -3.72 0.10 0.00 0.01 0.00 0.00 72.50 68.75 2qee s THR 23 CO 0.09 0.17 0.52 -0.62 -0.69 0.00 0.00 174.62 174.08 2qee s ASP 24 N 1.51 6.18 0.00 3.53 -1.08 -0.12 -4.68 116.67 122.00 2qee s ASP 24 Ca 0.16 -1.52 0.24 0.00 -0.52 0.00 0.00 52.55 50.92 2qee s ASP 24 Cb -0.16 -2.23 1.11 0.00 -1.46 0.00 0.00 42.92 40.19 2qee s ASP 24 CO 0.09 -0.84 1.76 1.15 0.52 0.00 0.00 175.17 177.84 2qee n MET 25 N 5.50 1.41 -3.38 4.34 0.00 -1.26 -0.84 117.12 122.88 2qee n MET 25 Ca -0.12 -0.60 -0.05 0.00 0.00 0.00 0.00 57.70 56.92 2qee n MET 25 Cb 0.42 -1.41 -0.06 0.00 0.00 0.00 0.00 33.22 32.17 2qee n MET 25 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 2qee s HIS 26 N -1.93 -1.04 0.33 3.17 5.65 -1.26 -4.71 115.29 115.49 2qee s HIS 26 Ca 0.35 1.29 0.05 0.00 0.25 0.00 0.00 55.06 57.00 2qee s HIS 26 Cb 0.18 0.26 -0.03 0.00 -1.18 0.00 0.00 32.58 31.81 2qee s HIS 26 CO 0.29 -0.71 0.22 0.95 -0.65 0.00 0.00 174.74 174.84 2qee s THR 27 N 2.66 0.14 -0.26 0.89 -4.23 -0.13 -1.39 115.64 113.32 2qee s THR 27 Ca 0.11 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.70 2qee s THR 27 Cb -0.14 -2.47 0.44 0.00 1.34 0.00 0.00 72.50 71.67 2qee s THR 27 CO -0.17 0.00 1.20 1.41 -0.54 0.00 0.00 174.62 176.53 2qee n HIS 28 N -0.63 1.56 -3.30 3.99 8.25 0.93 -2.55 115.22 123.47 2qee n HIS 28 Ca 0.04 -1.91 -0.21 0.00 -0.26 0.00 0.00 57.72 55.38 2qee n HIS 28 Cb 0.63 -0.30 -0.00 0.00 1.12 0.00 0.00 29.99 31.44 2qee n HIS 28 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2qee s LEU 29 N -3.44 3.88 0.03 2.41 1.43 -1.18 -4.61 118.68 117.19 2qee s LEU 29 Ca 0.45 0.13 0.02 0.00 -1.03 0.00 0.00 54.13 53.70 2qee s LEU 29 Cb 0.39 -3.01 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 2qee s LEU 29 CO -0.01 -0.49 -0.08 -0.36 0.23 0.00 0.00 176.35 175.64 2qee s PHE 30 N -2.33 0.68 0.20 0.29 0.08 -1.26 -4.38 117.98 111.26 2qee s PHE 30 Ca 0.45 -0.36 -0.32 0.00 0.12 0.00 0.00 56.93 56.82 2qee s PHE 30 Cb -0.10 -0.41 -0.15 0.00 -0.57 0.00 0.00 43.02 41.79 2qee s PHE 30 CO 0.34 -0.05 1.20 0.45 -0.10 0.00 0.00 175.22 177.07 2qee n SER 31 N 1.95 1.67 0.30 1.36 2.88 -1.26 -4.77 113.62 115.75 2qee n SER 31 Ca -0.19 1.15 0.17 0.00 -1.33 0.00 0.00 58.87 58.67 2qee n SER 31 Cb 0.56 -1.28 0.96 0.00 -0.75 0.00 0.00 64.21 63.70 2qee n SER 31 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2qee h PRO 32 N 3.38 0.00 0.00 -1.46 0.13 -1.93 0.48 132.00 132.59 2qee h PRO 32 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2qee h PRO 32 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2qee h PRO 32 CO 0.70 0.02 0.00 0.27 -0.23 0.00 0.00 178.00 178.76 2qee n ASN 33 N -3.54 0.00 0.00 1.44 6.94 -1.26 -1.29 115.26 117.55 2qee n ASN 33 Ca -0.03 0.23 0.13 0.00 -0.02 0.00 0.00 54.58 54.90 2qee n ASN 33 Cb 0.12 -0.36 0.62 0.00 -2.36 0.00 0.00 39.78 37.80 2qee n ASN 33 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2qee n PHE 34 N -1.36 0.00 -3.37 -2.53 3.01 0.16 -5.03 117.46 108.34 2qee n PHE 34 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.52 2qee n PHE 34 Cb 0.13 -0.42 0.00 0.00 -0.01 0.00 0.00 39.48 39.18 2qee n PHE 34 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qee n GLY 35 N 1.21 0.14 0.29 1.37 0.00 -0.41 -4.40 105.19 103.40 2qee n GLY 35 Ca 0.09 -1.12 0.18 0.00 0.00 0.00 0.00 46.02 45.18 2qee n GLY 35 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qee h GLU 36 N 0.00 0.00 0.00 1.61 4.39 -1.96 -1.85 114.58 116.78 2qee h GLU 36 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2qee h GLU 36 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2qee h GLU 36 CO 0.00 0.01 0.00 -0.84 -1.16 0.00 0.00 179.01 177.02 2qee h ILE 37 N 0.00 0.00 -2.97 3.13 3.07 -1.98 -3.37 117.51 115.39 2qee h ILE 37 Ca -0.00 -0.16 -0.56 0.00 1.55 0.00 0.00 64.86 65.69 2qee h ILE 37 Cb 0.37 1.16 -0.05 0.00 -0.27 0.00 0.00 36.82 38.03 2qee h ILE 37 CO 0.00 0.00 1.14 -0.22 -1.05 0.00 0.00 178.15 178.02 2qee s LEU 38 N -6.14 3.51 -0.02 0.16 2.96 -0.70 -4.78 118.68 113.67 2qee s LEU 38 Ca -0.03 0.75 -0.23 0.00 -0.22 0.00 0.00 54.13 54.40 2qee s LEU 38 Cb 0.12 -3.35 -0.04 0.00 0.50 0.00 0.00 46.19 43.41 2qee s LEU 38 CO 0.45 -1.62 0.70 -0.76 -1.32 0.00 0.00 176.35 173.80 2qee s LEU 39 N 6.11 4.37 0.18 -0.68 1.43 -1.26 -5.01 118.68 123.82 2qee s LEU 39 Ca 0.63 1.26 -0.19 0.00 -1.03 0.00 0.00 54.13 54.80 2qee s LEU 39 Cb -0.14 -3.09 0.04 0.00 0.03 0.00 0.00 46.19 43.02 2qee s LEU 39 CO 0.30 -0.04 0.52 -1.66 0.23 0.00 0.00 176.35 175.71 2qee s TRP 40 N 0.37 -0.23 0.00 0.29 1.48 -1.26 -0.46 118.94 119.13 2qee s TRP 40 Ca 0.37 -0.09 0.00 0.00 -1.06 0.00 0.00 56.10 55.32 2qee s TRP 40 Cb -0.19 0.42 0.00 0.00 -1.16 0.00 0.00 33.47 32.54 2qee s TRP 40 CO 0.19 -0.88 0.00 -0.40 -4.06 0.00 0.00 176.95 171.81 2qee n ASP 41 N -0.33 0.00 -0.08 -2.66 5.68 -1.26 -4.61 116.55 113.29 2qee n ASP 41 Ca -0.12 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.17 2qee n ASP 41 Cb 0.63 0.00 0.29 0.00 -1.14 0.00 0.00 41.12 40.90 2qee n ASP 41 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2qee h ILE 42 N 0.00 1.18 -0.34 2.12 6.09 -1.95 0.50 117.51 125.11 2qee h ILE 42 Ca 0.00 -0.55 -0.12 0.00 -1.37 0.00 0.00 64.86 62.82 2qee h ILE 42 Cb 0.00 0.57 -0.01 0.00 0.47 0.00 0.00 36.82 37.84 2qee h ILE 42 CO 0.00 0.22 -0.28 0.44 -3.07 0.00 0.00 178.15 175.46 2qee h ASP 43 N 0.71 0.71 -0.44 2.19 3.32 -1.95 -0.11 116.42 120.86 2qee h ASP 43 Ca 0.17 -0.27 -0.12 0.00 0.02 0.00 0.00 57.03 56.83 2qee h ASP 43 Cb 0.12 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2qee h ASP 43 CO -0.02 0.95 -0.21 -0.33 -1.72 0.00 0.00 179.24 177.91 2qee h GLU 44 N 0.60 0.92 -0.34 3.56 4.39 -1.68 -1.71 114.58 120.31 2qee h GLU 44 Ca 0.08 -0.40 0.04 0.00 0.34 0.00 0.00 59.36 59.42 2qee h GLU 44 Cb 0.78 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.36 2qee h GLU 44 CO 0.06 1.06 0.09 -0.07 -1.16 0.00 0.00 179.01 178.99 2qee h LEU 45 N 0.75 0.07 -1.07 1.33 3.38 -0.51 -2.21 115.31 117.05 2qee h LEU 45 Ca 0.10 0.05 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 2qee h LEU 45 Cb 0.78 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2qee h LEU 45 CO 0.06 0.07 -0.41 -0.07 0.09 0.00 0.00 178.44 178.19 2qee h LEU 46 N 0.22 0.00 -2.66 1.67 3.38 -0.91 -3.08 115.31 113.94 2qee h LEU 46 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2qee h LEU 46 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2qee h LEU 46 CO -0.19 0.41 0.00 0.35 0.09 0.00 0.00 178.44 179.10 2qee n THR 47 N -3.74 0.89 -1.48 0.22 -2.24 -0.66 -4.67 114.28 102.59 2qee n THR 47 Ca -0.01 -0.94 -0.44 0.00 -2.27 0.00 0.00 64.05 60.39 2qee n THR 47 Cb 0.48 0.61 -0.01 0.00 -2.10 0.00 0.00 70.33 69.32 2qee n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qee n TYR 48 N 1.64 0.09 0.27 4.78 9.36 -0.85 -4.67 117.16 127.77 2qee n TYR 48 Ca 0.24 0.73 0.11 0.00 3.32 0.00 0.00 57.90 62.29 2qee n TYR 48 Cb 0.63 -2.07 0.74 0.00 -0.63 0.00 0.00 39.34 38.01 2qee n TYR 48 CO 0.00 0.00 0.00 1.12 0.22 0.00 0.00 176.86 178.20 2qee h HIS 49 N 1.25 0.00 -1.01 2.98 2.07 -1.92 -0.40 115.15 118.12 2qee h HIS 49 Ca -0.37 0.00 0.05 0.00 -2.85 0.00 0.00 60.37 57.20 2qee h HIS 49 Cb 1.39 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 31.31 2qee h HIS 49 CO 0.41 0.05 0.66 1.88 -3.07 0.00 0.00 177.93 177.86 2qee h TYR 50 N 0.00 1.23 0.00 6.12 -1.99 -1.94 -1.87 116.97 118.51 2qee h TYR 50 Ca -0.00 0.03 -0.17 0.00 2.00 0.00 0.00 58.73 60.59 2qee h TYR 50 Cb 0.11 -0.41 -0.02 0.00 2.00 0.00 0.00 36.73 38.41 2qee h TYR 50 CO 0.00 0.68 -0.82 -0.07 -0.00 0.00 0.00 178.16 177.94 2qee h LEU 51 N 1.24 0.00 -0.54 3.88 3.38 -1.38 -2.88 115.31 119.00 2qee h LEU 51 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 2qee h LEU 51 Cb 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2qee h LEU 51 CO -0.15 0.82 0.34 0.58 0.09 0.00 0.00 178.44 180.13 2qee h VAL 52 N 0.00 1.15 -0.65 1.22 2.07 -0.96 0.22 116.25 119.29 2qee h VAL 52 Ca -0.01 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.21 2qee h VAL 52 Cb 1.61 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 2qee h VAL 52 CO 0.11 0.15 0.43 0.00 0.02 0.00 0.00 177.57 178.28 2qee h ALA 53 N 1.18 0.83 -0.44 1.67 0.00 -1.34 -2.29 119.26 118.86 2qee h ALA 53 Ca 0.20 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 2qee h ALA 53 Cb -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2qee h ALA 53 CO -0.04 0.25 -0.29 0.93 0.00 0.00 0.00 179.25 180.10 2qee h GLU 54 N 0.88 0.98 -0.27 0.00 5.08 -1.26 -2.92 114.58 117.07 2qee h GLU 54 Ca 0.24 -0.46 -0.08 0.00 -1.00 0.00 0.00 59.36 58.06 2qee h GLU 54 Cb -0.10 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2qee h GLU 54 CO -0.05 1.13 -0.20 -0.24 -1.00 0.00 0.00 179.01 178.65 2qee h VAL 55 N 0.83 1.25 0.00 3.13 3.04 -0.76 -2.34 116.25 121.40 2qee h VAL 55 Ca 0.09 -1.16 0.00 0.00 -1.01 0.00 0.00 66.70 64.62 2qee h VAL 55 Cb 0.88 1.26 0.00 0.00 -2.01 0.00 0.00 31.29 31.42 2qee h VAL 55 CO 0.08 0.37 0.00 0.24 -1.01 0.00 0.00 177.57 177.25 2qee h MET 56 N 0.44 0.00 0.00 4.17 2.86 -1.22 -0.05 114.93 121.13 2qee h MET 56 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2qee h MET 56 Cb 0.59 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.25 2qee h MET 56 CO 0.04 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.01 2qee h ARG 57 N 0.00 0.00 0.00 1.72 3.08 -1.37 -3.38 114.38 114.43 2qee h ARG 57 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 2qee h ARG 57 Cb 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2qee h ARG 57 CO 0.00 0.00 -1.44 0.91 -1.07 0.00 0.00 179.97 178.37 2qee n TRP 58 N -2.39 0.00 -2.10 3.04 7.02 -0.34 -5.08 117.44 117.59 2qee n TRP 58 Ca 0.04 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.19 2qee n TRP 58 Cb 0.39 -0.29 0.01 0.00 -2.42 0.00 0.00 31.31 29.00 2qee n TRP 58 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 2qee s THR 59 N -2.15 3.51 -0.64 -0.99 -1.32 -0.18 -4.96 115.64 108.90 2qee s THR 59 Ca -0.11 0.79 0.25 0.00 -1.21 0.00 0.00 61.69 61.42 2qee s THR 59 Cb 0.03 -3.30 0.17 0.00 -1.51 0.00 0.00 72.50 67.89 2qee s THR 59 CO 0.17 -0.34 1.51 0.44 -2.21 0.00 0.00 174.62 174.19 2qee h ASP 60 N 0.68 0.00 -2.69 8.08 3.32 -1.94 -3.47 116.42 120.40 2qee h ASP 60 Ca -0.48 -0.10 -0.53 0.00 0.02 0.00 0.00 57.03 55.94 2qee h ASP 60 Cb 1.24 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.83 2qee h ASP 60 CO 0.57 0.05 0.99 -0.69 -1.72 0.00 0.00 179.24 178.43 2qee s VAL 61 N -3.15 2.59 0.78 -1.35 1.01 -1.26 -4.97 120.40 114.05 2qee s VAL 61 Ca 0.08 0.28 -0.11 0.00 0.00 0.00 0.00 61.98 62.23 2qee s VAL 61 Cb 0.12 -3.18 0.06 0.00 0.00 0.00 0.00 36.38 33.38 2qee s VAL 61 CO 0.67 0.01 1.10 -0.94 0.00 0.00 0.00 175.10 175.94 2qee s SER 62 N 1.81 4.33 0.21 3.32 1.04 -1.26 -4.81 113.70 118.33 2qee s SER 62 Ca 0.74 1.89 -0.10 0.00 0.48 0.00 0.00 55.95 58.96 2qee s SER 62 Cb -0.44 -2.53 0.17 0.00 0.10 0.00 0.00 66.02 63.31 2qee s SER 62 CO 0.33 -2.15 1.86 -0.29 0.98 0.00 0.00 173.24 173.96 2qee h ILE 63 N -1.13 1.13 -0.04 -1.02 6.09 -1.98 0.14 117.51 120.71 2qee h ILE 63 Ca -0.44 -0.31 0.03 0.00 -1.37 0.00 0.00 64.86 62.77 2qee h ILE 63 Cb 1.24 0.14 -0.03 0.00 0.47 0.00 0.00 36.82 38.64 2qee h ILE 63 CO 0.50 0.17 -0.12 -0.33 -3.07 0.00 0.00 178.15 175.30 2qee h GLU 64 N 0.91 -0.17 -0.97 2.19 3.07 -1.94 -1.11 114.58 116.56 2qee h GLU 64 Ca 0.27 0.01 0.07 0.00 -0.50 0.00 0.00 59.36 59.21 2qee h GLU 64 Cb -0.04 0.04 -0.06 0.00 -0.84 0.00 0.00 28.75 27.85 2qee h GLU 64 CO -0.09 -0.11 0.63 0.00 -1.40 0.00 0.00 179.01 178.04 2qee h ALA 65 N 0.83 1.46 -0.00 3.43 0.00 -1.86 -1.29 119.26 121.83 2qee h ALA 65 Ca 0.06 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2qee h ALA 65 Cb 0.25 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2qee h ALA 65 CO -0.15 0.39 -0.07 0.35 0.00 0.00 0.00 179.25 179.77 2qee h PHE 66 N 1.11 -0.18 0.00 0.00 3.57 -0.31 -2.08 116.94 119.05 2qee h PHE 66 Ca 0.42 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.93 2qee h PHE 66 Cb 0.20 0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.02 2qee h PHE 66 CO -0.00 -0.11 0.00 -1.49 -2.23 0.00 0.00 178.31 174.48 2qee h TRP 67 N -0.13 0.00 0.00 0.41 -0.00 -0.76 -1.94 115.95 113.53 2qee h TRP 67 Ca 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.91 2qee h TRP 67 Cb 0.16 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.32 2qee h TRP 67 CO -0.14 0.00 -0.06 0.00 -0.00 0.00 0.00 178.44 178.24 2qee h ALA 68 N 2.02 0.97 -2.38 1.49 0.00 -0.60 -3.46 119.26 117.30 2qee h ALA 68 Ca 0.00 -0.06 -0.50 0.00 0.00 0.00 0.00 54.91 54.35 2qee h ALA 68 Cb 0.51 -0.01 0.09 0.00 0.00 0.00 0.00 17.79 18.38 2qee h ALA 68 CO 0.00 0.08 0.37 -1.64 0.00 0.00 0.00 179.25 178.06 2qee s MET 69 N -3.35 2.97 0.84 0.00 -1.94 -0.73 -5.04 119.30 112.05 2qee s MET 69 Ca 0.05 1.23 -0.11 0.00 -1.71 0.00 0.00 55.69 55.14 2qee s MET 69 Cb 0.07 -1.98 0.10 0.00 2.01 0.00 0.00 34.83 35.02 2qee s MET 69 CO 0.64 -1.09 1.09 -1.54 -0.01 0.00 0.00 175.02 174.11 2qee s SER 70 N -2.93 4.02 0.20 3.03 1.04 -1.26 -4.76 113.70 113.04 2qee s SER 70 Ca 0.64 1.45 -0.11 0.00 0.48 0.00 0.00 55.95 58.41 2qee s SER 70 Cb -0.17 -2.16 0.25 0.00 0.10 0.00 0.00 66.02 64.04 2qee s SER 70 CO 0.43 -2.29 1.73 0.50 0.98 0.00 0.00 173.24 174.59 2qee h LYS 71 N -1.31 0.31 -0.81 4.02 3.64 -1.96 0.20 116.57 120.68 2qee h LYS 71 Ca -0.48 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 58.91 2qee h LYS 71 Cb 1.27 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.97 2qee h LYS 71 CO 0.56 0.21 0.52 -0.09 -2.27 0.00 0.00 179.45 178.38 2qee h ARG 72 N 0.32 1.01 -0.24 1.90 2.43 -1.93 0.29 114.38 118.16 2qee h ARG 72 Ca 0.29 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.38 2qee h ARG 72 Cb 0.38 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2qee h ARG 72 CO -0.33 0.67 0.06 0.93 -1.51 0.00 0.00 179.97 179.78 2qee h GLU 73 N 1.04 0.38 0.10 0.20 5.08 -1.78 0.15 114.58 119.75 2qee h GLU 73 Ca 0.31 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.60 2qee h GLU 73 Cb -0.04 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 2qee h GLU 73 CO -0.10 0.49 -0.26 1.96 -1.00 0.00 0.00 179.01 180.10 2qee h GLN 74 N 0.21 -0.44 -0.96 2.33 4.20 -0.26 -1.41 115.11 118.78 2qee h GLN 74 Ca 0.08 0.03 0.08 0.00 0.06 0.00 0.00 58.65 58.90 2qee h GLN 74 Cb 0.28 0.10 -0.07 0.00 0.30 0.00 0.00 27.48 28.09 2qee h GLN 74 CO 0.00 -0.30 0.60 0.00 -0.67 0.00 0.00 178.83 178.47 2qee h ALA 75 N 0.29 1.36 -0.54 3.87 0.00 -0.33 -1.13 119.26 122.77 2qee h ALA 75 Ca 0.04 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2qee h ALA 75 Cb 0.50 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2qee h ALA 75 CO -0.16 0.32 0.29 -0.44 0.00 0.00 0.00 179.25 179.26 2qee h ASP 76 N 1.05 0.44 -0.11 0.00 3.32 -0.34 -1.64 116.42 119.13 2qee h ASP 76 Ca 0.43 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.49 2qee h ASP 76 Cb 0.27 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 2qee h ASP 76 CO -0.21 0.31 0.03 0.25 -1.72 0.00 0.00 179.24 177.90 2qee h LEU 77 N 0.57 0.18 -0.97 1.55 5.85 -0.74 -1.72 115.31 120.02 2qee h LEU 77 Ca 0.23 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2qee h LEU 77 Cb 0.10 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 2qee h LEU 77 CO -0.14 0.37 0.48 0.40 -0.34 0.00 0.00 178.44 179.22 2qee h ILE 78 N -0.03 1.25 0.09 4.05 2.04 -1.15 -0.11 117.51 123.65 2qee h ILE 78 Ca 0.04 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 2qee h ILE 78 Cb 0.26 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 2qee h ILE 78 CO 0.00 0.28 -0.04 -0.25 0.00 0.00 0.00 178.15 178.13 2qee h TRP 79 N 1.21 -0.11 -0.25 1.37 2.91 -1.14 -0.56 115.95 119.38 2qee h TRP 79 Ca 0.31 -0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.34 2qee h TRP 79 Cb 0.01 0.04 -0.02 0.00 -0.51 0.00 0.00 29.16 28.68 2qee h TRP 79 CO 0.01 -0.00 0.11 1.49 -1.03 0.00 0.00 178.44 179.01 2qee h GLU 80 N -0.20 0.23 0.03 2.65 4.57 -0.94 -0.85 114.58 120.07 2qee h GLU 80 Ca -0.01 -0.01 -0.23 0.00 -1.18 0.00 0.00 59.36 57.92 2qee h GLU 80 Cb 0.16 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 2qee h GLU 80 CO 0.02 0.15 -1.00 0.93 -1.18 0.00 0.00 179.01 177.93 2qee h GLU 81 N 0.23 0.34 0.00 1.92 4.39 -0.93 -0.31 114.58 120.22 2qee h GLU 81 Ca 0.10 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.40 2qee h GLU 81 Cb 0.05 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 2qee h GLU 81 CO -0.09 1.11 -1.57 1.28 -1.16 0.00 0.00 179.01 178.58 2qee n LEU 82 N -3.68 0.27 -0.02 1.33 4.77 -0.23 -3.89 117.00 115.54 2qee n LEU 82 Ca -0.07 -0.15 -0.03 0.00 -0.03 0.00 0.00 56.01 55.73 2qee n LEU 82 Cb 0.87 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.94 2qee n LEU 82 CO 0.51 0.07 -0.65 0.49 -1.33 0.00 0.00 177.39 176.48 2qee n PHE 83 N -1.94 0.00 -0.10 -1.77 3.72 -0.36 -3.15 117.46 113.85 2qee n PHE 83 Ca -0.01 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.16 2qee n PHE 83 Cb 0.43 -0.19 -0.11 0.00 -0.94 0.00 0.00 39.48 38.67 2qee n PHE 83 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 2qee n ILE 84 N -2.54 1.54 0.14 4.37 2.08 -0.96 -4.40 119.36 119.58 2qee n ILE 84 Ca -0.08 -0.05 0.02 0.00 0.56 0.00 0.00 62.75 63.20 2qee n ILE 84 Cb 0.60 -2.03 0.05 0.00 -0.75 0.00 0.00 39.64 37.50 2qee n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2qee h LYS 85 N -0.99 0.00 -4.70 0.38 1.57 -1.25 -3.44 116.57 108.14 2qee h LYS 85 Ca -0.37 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.14 2qee h LYS 85 Cb 1.33 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.45 2qee h LYS 85 CO -0.22 0.51 -0.73 1.03 -0.57 0.00 0.00 179.45 179.48 2qee s ARG 86 N -3.00 0.68 0.28 3.15 3.00 -1.25 -5.06 118.95 116.74 2qee s ARG 86 Ca 0.04 -0.99 -0.29 0.00 0.00 0.00 0.00 55.73 54.48 2qee s ARG 86 Cb 0.08 -0.34 -0.10 0.00 0.00 0.00 0.00 34.95 34.59 2qee s ARG 86 CO 0.74 0.04 1.34 -1.12 0.00 0.00 0.00 175.30 176.30 2qee s SER 87 N -2.12 6.79 -1.35 0.23 0.01 -1.26 -3.39 113.70 112.61 2qee s SER 87 Ca -0.01 2.60 -0.08 0.00 1.31 0.00 0.00 55.95 59.76 2qee s SER 87 Cb -0.05 -2.63 -0.08 0.00 0.21 0.00 0.00 66.02 63.47 2qee s SER 87 CO -0.01 -0.56 2.72 -0.81 0.41 0.00 0.00 173.24 174.99 2qee n PRO 88 N 1.65 3.14 0.05 12.44 -0.04 -1.19 -4.60 135.00 146.45 2qee n PRO 88 Ca 0.03 -1.92 0.12 0.00 -0.04 0.00 0.00 63.50 61.69 2qee n PRO 88 Cb 0.42 -2.66 0.25 0.00 -0.04 0.00 0.00 33.50 31.47 2qee n PRO 88 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2qee n VAL 89 N 3.73 0.29 -1.04 0.52 0.24 -1.26 -3.14 118.33 117.65 2qee n VAL 89 Ca 0.67 -0.20 -0.32 0.00 -2.04 0.00 0.00 64.34 62.45 2qee n VAL 89 Cb 0.22 -0.14 0.13 0.00 -1.47 0.00 0.00 33.84 32.58 2qee n VAL 89 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2qee s SER 90 N -3.92 3.71 0.20 -1.34 1.04 -1.26 -4.71 113.70 107.42 2qee s SER 90 Ca 0.08 2.10 -0.10 0.00 0.48 0.00 0.00 55.95 58.51 2qee s SER 90 Cb 0.14 -2.56 0.21 0.00 0.10 0.00 0.00 66.02 63.92 2qee s SER 90 CO 0.69 -2.57 1.80 -0.08 0.98 0.00 0.00 173.24 174.06 2qee h GLU 91 N -1.29 0.63 -0.37 4.02 4.57 -1.97 0.12 114.58 120.30 2qee h GLU 91 Ca -0.44 -0.04 -0.13 0.00 -1.18 0.00 0.00 59.36 57.57 2qee h GLU 91 Cb 1.26 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 2qee h GLU 91 CO 0.46 0.42 -0.27 0.00 -1.18 0.00 0.00 179.01 178.44 2qee h ALA 92 N 1.33 0.53 -0.25 2.92 0.00 -1.95 -0.23 119.26 121.61 2qee h ALA 92 Ca 0.28 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2qee h ALA 92 Cb 0.16 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2qee h ALA 92 CO -0.17 0.54 0.03 0.00 0.00 0.00 0.00 179.25 179.65 2qee h ARG 94 N 0.22 0.65 -0.76 0.00 2.43 -0.64 -1.87 114.38 114.41 2qee h ARG 94 Ca 0.07 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.24 2qee h ARG 94 Cb 0.35 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.71 2qee h ARG 94 CO 0.01 0.43 0.48 0.78 -1.51 0.00 0.00 179.97 180.15 2qee h GLY 95 N 0.67 1.10 0.57 2.80 0.00 -0.66 -0.88 103.07 106.66 2qee h GLY 95 Ca 0.47 -0.36 0.07 0.00 0.00 0.00 0.00 47.33 47.52 2qee h GLY 95 CO -0.35 0.29 0.32 -2.08 0.00 0.00 0.00 176.54 174.72 2qee h VAL 96 N 0.92 0.89 -0.37 4.60 2.07 -1.00 -1.28 116.25 122.08 2qee h VAL 96 Ca 0.31 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 2qee h VAL 96 Cb 0.04 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 2qee h VAL 96 CO -0.12 0.10 0.15 -0.07 0.02 0.00 0.00 177.57 177.66 2qee h LEU 97 N 0.57 0.51 -1.25 2.57 3.38 -1.16 -1.45 115.31 118.48 2qee h LEU 97 Ca 0.30 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 58.14 2qee h LEU 97 Cb 0.27 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2qee h LEU 97 CO -0.23 0.53 0.52 0.74 0.09 0.00 0.00 178.44 180.09 2qee h THR 98 N 0.46 1.16 0.11 0.22 2.02 -0.59 -0.48 112.91 115.80 2qee h THR 98 Ca 0.12 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 2qee h THR 98 Cb 0.18 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.65 2qee h THR 98 CO -0.01 0.18 -0.05 0.00 0.37 0.00 0.00 175.52 176.01 2qee h LEU 100 N -0.34 -0.23 -0.77 0.00 3.38 -0.81 -1.50 115.31 115.04 2qee h LEU 100 Ca -0.02 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2qee h LEU 100 Cb 0.28 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 2qee h LEU 100 CO 0.03 -0.08 0.35 -0.61 0.09 0.00 0.00 178.44 178.22 2qee h GLN 101 N 0.09 1.12 -0.08 1.13 4.15 -1.03 -1.45 115.11 119.04 2qee h GLN 101 Ca 0.22 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.41 2qee h GLN 101 Cb 0.33 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.81 2qee h GLN 101 CO -0.39 0.88 -0.21 0.78 -1.93 0.00 0.00 178.83 177.96 2qee h GLY 102 N 1.09 0.13 1.37 2.39 0.00 -0.14 -1.24 103.07 106.67 2qee h GLY 102 Ca 0.26 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2qee h GLY 102 CO -0.03 0.08 0.00 1.04 0.00 0.00 0.00 176.54 177.63 2qee n LEU 103 N -4.24 0.00 0.00 3.11 4.77 -0.72 -4.89 117.00 115.04 2qee n LEU 103 Ca -0.01 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 2qee n LEU 103 Cb 0.30 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2qee n LEU 103 CO 0.38 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2qee n GLY 104 N 1.15 0.75 3.86 -0.72 0.00 -0.47 -5.07 105.19 104.70 2qee n GLY 104 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2qee n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qee s LEU 105 N 0.00 3.36 -0.39 0.99 1.43 -0.59 -5.00 118.68 118.48 2qee s LEU 105 Ca 0.00 1.46 -0.05 0.00 -1.03 0.00 0.00 54.13 54.52 2qee s LEU 105 Cb 0.00 -4.48 0.08 0.00 0.03 0.00 0.00 46.19 41.83 2qee s LEU 105 CO 0.00 -0.78 0.17 -0.62 0.23 0.00 0.00 176.35 175.36 2qee s ASP 106 N -3.82 5.31 0.64 2.29 -1.08 -1.26 -3.90 116.67 114.85 2qee s ASP 106 Ca 0.56 -1.66 0.39 0.00 -0.52 0.00 0.00 52.55 51.32 2qee s ASP 106 Cb -0.11 -1.86 2.18 0.00 -1.46 0.00 0.00 42.92 41.68 2qee s ASP 106 CO 0.47 -0.47 2.31 -0.65 0.52 0.00 0.00 175.17 177.34 2qee h PRO 107 N 8.16 0.00 -0.59 4.34 0.11 -1.90 -2.86 132.00 139.26 2qee h PRO 107 Ca -0.18 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.00 2qee h PRO 107 Cb 1.06 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 2qee h PRO 107 CO 0.68 0.00 0.40 0.00 -0.21 0.00 0.00 178.00 178.86 2qee h ALA 108 N 1.96 1.87 0.00 -0.75 0.00 -2.01 -2.19 119.26 118.13 2qee h ALA 108 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2qee h ALA 108 Cb 0.05 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2qee h ALA 108 CO -0.00 0.02 -0.12 1.79 0.00 0.00 0.00 179.25 180.94 2qee h THR 109 N 0.53 0.27 -2.59 0.00 1.35 -1.94 -3.47 112.91 107.06 2qee h THR 109 Ca 0.26 -0.96 -0.37 0.00 -0.55 0.00 0.00 66.41 64.79 2qee h THR 109 Cb 0.35 1.77 -0.06 0.00 -1.73 0.00 0.00 68.15 68.48 2qee h THR 109 CO -0.08 0.12 -0.42 0.54 -0.25 0.00 0.00 175.52 175.43 2qee n ARG 110 N -3.21 -1.71 -3.09 4.72 1.74 -0.83 -4.89 116.66 109.39 2qee n ARG 110 Ca 0.01 0.94 -0.44 0.00 -0.77 0.00 0.00 57.85 57.59 2qee n ARG 110 Cb 0.43 -5.49 -0.00 0.00 -1.02 0.00 0.00 32.46 26.38 2qee n ARG 110 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2qee s ASP 111 N -2.20 7.14 0.31 0.55 -1.08 -1.26 -4.83 116.67 115.30 2qee s ASP 111 Ca 0.00 -3.17 -0.00 0.00 -0.52 0.00 0.00 52.55 48.86 2qee s ASP 111 Cb 0.00 -2.33 0.50 0.00 -1.46 0.00 0.00 42.92 39.63 2qee s ASP 111 CO 0.00 -0.60 1.95 0.25 0.52 0.00 0.00 175.17 177.30 2qee h LEU 112 N 8.67 0.84 -0.48 -1.34 5.85 -1.98 -1.05 115.31 125.81 2qee h LEU 112 Ca 0.26 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 2qee h LEU 112 Cb 0.88 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 2qee h LEU 112 CO 1.15 0.65 0.30 1.56 -0.34 0.00 0.00 178.44 181.76 2qee h GLN 113 N 0.97 0.65 0.01 1.25 1.08 -2.00 0.08 115.11 117.14 2qee h GLN 113 Ca 0.25 -0.05 0.01 0.00 -1.45 0.00 0.00 58.65 57.41 2qee h GLN 113 Cb -0.03 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.24 2qee h GLN 113 CO -0.05 0.46 -0.07 0.28 -0.95 0.00 0.00 178.83 178.50 2qee h VAL 114 N 0.64 0.81 -0.72 -0.54 2.07 -1.78 -2.19 116.25 114.55 2qee h VAL 114 Ca 0.17 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.85 2qee h VAL 114 Cb -0.02 0.81 -0.11 0.00 -1.52 0.00 0.00 31.29 30.45 2qee h VAL 114 CO -0.03 0.00 0.15 1.88 0.02 0.00 0.00 177.57 179.58 2qee h TYR 115 N -0.13 0.22 -0.72 1.57 0.05 -0.92 -1.38 116.97 115.66 2qee h TYR 115 Ca 0.03 0.04 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 2qee h TYR 115 Cb 0.17 0.01 -0.03 0.00 1.01 0.00 0.00 36.73 37.88 2qee h TYR 115 CO -0.14 -0.10 0.43 0.00 -1.05 0.00 0.00 178.16 177.31 2qee h ARG 116 N 0.24 0.96 -0.82 4.88 3.08 -0.59 -2.56 114.38 119.58 2qee h ARG 116 Ca 0.40 -0.08 0.05 0.00 0.07 0.00 0.00 59.98 60.42 2qee h ARG 116 Cb 0.68 -0.21 -0.05 0.00 0.08 0.00 0.00 29.97 30.47 2qee h ARG 116 CO -0.51 0.67 0.54 0.93 -1.07 0.00 0.00 179.97 180.53 2qee h GLU 117 N 0.98 0.93 -0.79 0.04 5.08 -0.64 -1.82 114.58 118.36 2qee h GLU 117 Ca 0.26 -0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.69 2qee h GLU 117 Cb -0.05 -0.21 -0.09 0.00 0.50 0.00 0.00 28.75 28.91 2qee h GLU 117 CO -0.05 0.62 0.39 -0.92 -1.00 0.00 0.00 179.01 178.04 2qee h TYR 118 N 0.96 0.68 0.00 4.33 3.20 -1.24 -2.90 116.97 122.00 2qee h TYR 118 Ca 0.34 0.03 -0.25 0.00 3.14 0.00 0.00 58.73 61.99 2qee h TYR 118 Cb 0.12 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.17 2qee h TYR 118 CO -0.00 0.18 -1.42 0.74 -1.64 0.00 0.00 178.16 176.03 2qee h PHE 119 N 0.59 0.00 -0.06 -3.82 0.04 -1.44 -3.31 116.94 108.94 2qee h PHE 119 Ca 0.41 0.00 0.02 0.00 2.80 0.00 0.00 57.97 61.20 2qee h PHE 119 Cb 0.54 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.69 2qee h PHE 119 CO -0.11 0.96 0.17 0.00 -0.60 0.00 0.00 178.31 178.74 2qee h ALA 120 N 1.04 1.36 -0.19 2.45 0.00 -1.26 -2.17 119.26 120.48 2qee h ALA 120 Ca -0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2qee h ALA 120 Cb 1.89 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.69 2qee h ALA 120 CO 0.09 -0.20 0.00 1.63 0.00 0.00 0.00 179.25 180.77 2qee n LYS 121 N -3.24 2.16 -4.32 0.00 5.02 -1.24 -4.97 118.16 111.58 2qee n LYS 121 Ca -0.01 -1.73 -0.22 0.00 -2.02 0.00 0.00 58.31 54.33 2qee n LYS 121 Cb 0.25 -1.47 -0.11 0.00 -0.02 0.00 0.00 35.03 33.68 2qee n LYS 121 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2qee s LYS 122 N -1.77 1.25 0.59 1.97 1.02 -0.82 -5.15 119.74 116.84 2qee s LYS 122 Ca 0.34 -1.38 -0.03 0.00 0.02 0.00 0.00 55.97 54.92 2qee s LYS 122 Cb 0.21 -1.31 0.03 0.00 -0.52 0.00 0.00 37.83 36.24 2qee s LYS 122 CO 0.30 0.27 0.87 0.95 -0.92 0.00 0.00 175.35 176.82 2qee s THR 123 N -1.99 3.06 0.16 2.17 -4.23 -1.26 -4.97 115.64 108.58 2qee s THR 123 Ca 0.15 -0.32 -0.16 0.00 -1.18 0.00 0.00 61.69 60.18 2qee s THR 123 Cb -0.06 -3.21 0.03 0.00 1.34 0.00 0.00 72.50 70.59 2qee s THR 123 CO 0.06 -0.20 1.75 0.28 -0.54 0.00 0.00 174.62 175.98 2qee h SER 124 N -0.15 0.14 -0.80 3.99 0.02 -1.97 -1.84 113.55 112.94 2qee h SER 124 Ca -0.44 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.53 2qee h SER 124 Cb 1.28 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.81 2qee h SER 124 CO 0.58 0.12 0.45 -0.33 -1.14 0.00 0.00 176.83 176.50 2qee h GLU 125 N 0.28 1.10 -0.49 3.45 3.07 -1.94 0.46 114.58 120.52 2qee h GLU 125 Ca 0.17 -0.12 -0.07 0.00 -0.50 0.00 0.00 59.36 58.84 2qee h GLU 125 Cb 0.14 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 27.81 2qee h GLU 125 CO -0.17 0.80 0.05 0.93 -1.40 0.00 0.00 179.01 179.22 2qee h GLU 126 N 1.10 0.83 -0.13 2.33 5.08 -1.90 -1.99 114.58 119.89 2qee h GLU 126 Ca 0.28 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 2qee h GLU 126 Cb 0.01 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2qee h GLU 126 CO -0.05 0.85 -0.40 0.37 -1.00 0.00 0.00 179.01 178.78 2qee h GLN 127 N 0.69 0.30 -0.43 2.33 5.75 -0.93 -0.56 115.11 122.26 2qee h GLN 127 Ca 0.14 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.49 2qee h GLN 127 Cb 0.44 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.97 2qee h GLN 127 CO 0.02 0.65 0.20 0.28 -2.65 0.00 0.00 178.83 177.33 2qee h VAL 128 N 0.25 1.18 -0.50 2.39 2.07 -0.82 0.57 116.25 121.39 2qee h VAL 128 Ca 0.02 -0.53 0.02 0.00 0.82 0.00 0.00 66.70 67.03 2qee h VAL 128 Cb 0.82 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 2qee h VAL 128 CO 0.06 0.20 0.31 0.44 0.02 0.00 0.00 177.57 178.61 2qee h ASP 129 N 0.56 0.51 0.13 0.57 3.32 -0.84 -1.36 116.42 119.31 2qee h ASP 129 Ca 0.15 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 2qee h ASP 129 Cb 0.13 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2qee h ASP 129 CO -0.02 0.36 -0.06 0.74 -1.72 0.00 0.00 179.24 178.55 2qee h THR 130 N 0.62 0.92 -0.08 0.35 2.02 -0.88 -2.46 112.91 113.40 2qee h THR 130 Ca 0.19 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 2qee h THR 130 Cb -0.01 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2qee h THR 130 CO -0.07 0.04 0.01 0.58 0.37 0.00 0.00 175.52 176.45 2qee h VAL 131 N -0.25 1.21 -0.09 3.16 2.07 -0.76 0.65 116.25 122.23 2qee h VAL 131 Ca -0.02 -0.66 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 2qee h VAL 131 Cb 0.20 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 2qee h VAL 131 CO 0.03 0.18 0.05 -0.07 0.02 0.00 0.00 177.57 177.78 2qee h LEU 132 N -0.11 0.11 0.03 2.57 3.38 -1.29 0.11 115.31 120.11 2qee h LEU 132 Ca 0.02 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2qee h LEU 132 Cb 0.28 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2qee h LEU 132 CO 0.00 0.10 -0.02 -0.61 0.09 0.00 0.00 178.44 178.00 2qee h GLN 133 N 0.13 -0.04 -0.73 1.13 -0.00 -1.11 -0.50 115.11 113.99 2qee h GLN 133 Ca 0.03 0.00 0.01 0.00 -0.00 0.00 0.00 58.65 58.70 2qee h GLN 133 Cb 0.01 0.01 -0.04 0.00 0.00 0.00 0.00 27.48 27.47 2qee h GLN 133 CO -0.01 0.54 0.48 -0.07 0.00 0.00 0.00 178.83 179.77 2qee h LEU 134 N -0.66 0.83 -0.07 -2.39 3.38 -0.42 -2.24 115.31 113.74 2qee h LEU 134 Ca -0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qee h LEU 134 Cb 0.60 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2qee h LEU 134 CO 0.01 0.60 -0.05 0.00 0.09 0.00 0.00 178.44 179.08 2qee n ALA 135 N -2.30 2.59 -3.84 1.53 0.00 0.33 -4.95 120.51 113.87 2qee n ALA 135 Ca 0.07 -0.18 -0.24 0.00 0.00 0.00 0.00 53.44 53.08 2qee n ALA 135 Cb 0.03 -1.43 0.01 0.00 0.00 0.00 0.00 19.45 18.06 2qee n ALA 135 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2qee n ASN 136 N -1.21 -1.31 -4.45 0.00 5.15 -0.56 -4.81 115.26 108.07 2qee n ASN 136 Ca 0.14 -0.89 -0.36 0.00 -0.60 0.00 0.00 54.58 52.86 2qee n ASN 136 Cb 0.26 -3.60 -0.12 0.00 -0.53 0.00 0.00 39.78 35.78 2qee n ASN 136 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2qee s VAL 137 N -3.73 4.18 -0.05 3.44 1.01 -0.30 -0.03 120.40 124.93 2qee s VAL 137 Ca 0.10 -0.22 0.11 0.00 0.00 0.00 0.00 61.98 61.97 2qee s VAL 137 Cb -0.05 -2.93 -0.23 0.00 0.00 0.00 0.00 36.38 33.17 2qee s VAL 137 CO 0.85 0.38 0.65 0.77 0.00 0.00 0.00 175.10 177.75 2qee h SER 138 N 7.86 0.04 -3.54 3.32 4.64 -0.93 -3.44 113.55 121.50 2qee h SER 138 Ca -0.38 -0.08 -0.18 0.00 -0.47 0.00 0.00 61.79 60.68 2qee h SER 138 Cb 1.17 -0.01 -0.28 0.00 -0.31 0.00 0.00 62.40 62.97 2qee h SER 138 CO 0.60 1.07 -0.46 -1.81 -0.87 0.00 0.00 176.83 175.36 2qee s ASP 139 N -6.18 -0.26 -0.13 4.97 1.01 -1.13 -4.71 116.67 110.24 2qee s ASP 139 Ca -0.06 0.52 0.02 0.00 0.71 0.00 0.00 52.55 53.74 2qee s ASP 139 Cb 0.08 0.45 0.01 0.00 1.01 0.00 0.00 42.92 44.47 2qee s ASP 139 CO 0.82 -0.13 -0.19 -0.69 0.21 0.00 0.00 175.17 175.18 2qee s VAL 140 N 0.79 1.86 -0.18 -1.27 1.01 0.52 -0.94 120.40 122.18 2qee s VAL 140 Ca -0.05 -0.86 -0.17 0.00 0.00 0.00 0.00 61.98 60.90 2qee s VAL 140 Cb -0.07 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 2qee s VAL 140 CO -0.05 0.51 0.45 -0.69 0.00 0.00 0.00 175.10 175.32 2qee s VAL 141 N 0.89 5.17 0.67 2.92 1.01 -0.02 -0.44 120.40 130.60 2qee s VAL 141 Ca -0.07 0.83 -0.03 0.00 0.00 0.00 0.00 61.98 62.71 2qee s VAL 141 Cb -0.15 -3.78 0.07 0.00 0.00 0.00 0.00 36.38 32.52 2qee s VAL 141 CO -0.02 0.24 0.95 -0.04 0.00 0.00 0.00 175.10 176.23 2qee s MET 142 N 1.27 2.12 -0.27 2.72 -1.94 0.99 -0.96 119.30 123.22 2qee s MET 142 Ca 0.22 -0.61 -0.02 0.00 -1.71 0.00 0.00 55.69 53.57 2qee s MET 142 Cb -0.15 -2.29 0.04 0.00 2.01 0.00 0.00 34.83 34.44 2qee s MET 142 CO 0.09 -1.18 -0.03 0.99 -0.01 0.00 0.00 175.02 174.88 2qee s THR 143 N -3.10 2.98 -0.22 2.05 2.01 -1.06 -3.25 115.64 115.05 2qee s THR 143 Ca 0.61 -1.17 -0.02 0.00 0.31 0.00 0.00 61.69 61.42 2qee s THR 143 Cb -0.09 -2.60 0.01 0.00 0.01 0.00 0.00 72.50 69.82 2qee s THR 143 CO 0.43 0.05 -0.09 0.20 -0.69 0.00 0.00 174.62 174.52 2qee s ASN 144 N 1.30 3.96 -0.35 3.53 -0.87 0.00 -4.96 114.94 117.55 2qee s ASN 144 Ca -0.02 -0.58 -0.01 0.00 -1.57 0.00 0.00 52.86 50.67 2qee s ASN 144 Cb -0.18 -1.64 0.09 0.00 -0.02 0.00 0.00 41.25 39.49 2qee s ASN 144 CO -0.03 -0.04 0.10 -0.62 -2.57 0.00 0.00 177.10 173.94 2qee s ASP 145 N 1.39 5.03 0.00 -1.22 2.15 -1.26 -0.99 116.67 121.77 2qee s ASP 145 Ca 0.04 -1.76 0.19 0.00 0.43 0.00 0.00 52.55 51.45 2qee s ASP 145 Cb -0.14 -1.75 1.08 0.00 -0.30 0.00 0.00 42.92 41.80 2qee s ASP 145 CO -0.06 -0.41 1.58 -0.81 -0.17 0.00 0.00 175.17 175.30 2qee n PRO 146 N 4.54 0.45 0.05 4.34 -0.04 -1.26 -1.48 135.00 141.60 2qee n PRO 146 Ca -0.05 0.05 0.12 0.00 -0.04 0.00 0.00 63.50 63.58 2qee n PRO 146 Cb 0.42 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.66 2qee n PRO 146 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2qee n PHE 147 N -1.14 0.42 -3.03 0.54 3.72 -1.26 -4.75 117.46 111.96 2qee n PHE 147 Ca 0.12 0.12 -0.41 0.00 -0.05 0.00 0.00 57.45 57.23 2qee n PHE 147 Cb 0.11 -0.58 -0.06 0.00 -0.94 0.00 0.00 39.48 38.01 2qee n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2qee s ASP 148 N -3.84 6.68 0.18 4.37 2.15 -0.55 -4.96 116.67 120.69 2qee s ASP 148 Ca 0.09 0.83 -0.14 0.00 0.43 0.00 0.00 52.55 53.77 2qee s ASP 148 Cb 0.15 -2.37 0.07 0.00 -0.30 0.00 0.00 42.92 40.47 2qee s ASP 148 CO 0.68 -0.42 1.83 0.44 -0.17 0.00 0.00 175.17 177.53 2qee h ASP 149 N 7.81 0.65 0.15 -0.34 3.32 -1.87 0.75 116.42 126.89 2qee h ASP 149 Ca -0.25 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.77 2qee h ASP 149 Cb 1.11 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.49 2qee h ASP 149 CO 0.81 0.48 -0.12 -1.13 -1.72 0.00 0.00 179.24 177.56 2qee h ASN 150 N 0.75 -0.32 -0.73 6.45 -1.24 -1.95 -2.88 115.58 115.66 2qee h ASN 150 Ca 0.20 0.03 0.04 0.00 0.71 0.00 0.00 56.30 57.28 2qee h ASN 150 Cb -0.07 0.11 -0.05 0.00 0.73 0.00 0.00 38.32 39.04 2qee h ASN 150 CO -0.04 -0.19 0.45 -0.33 -1.29 0.00 0.00 177.43 176.03 2qee h GLU 151 N -0.29 0.84 -0.60 6.67 5.08 -1.74 -2.51 114.58 122.04 2qee h GLU 151 Ca -0.00 -0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.41 2qee h GLU 151 Cb 0.26 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 2qee h GLU 151 CO -0.02 0.56 0.40 -0.09 -1.00 0.00 0.00 179.01 178.86 2qee h ARG 152 N 0.87 0.37 0.68 2.33 2.43 -0.73 -2.83 114.38 117.50 2qee h ARG 152 Ca 0.30 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.42 2qee h ARG 152 Cb 0.06 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 2qee h ARG 152 CO -0.13 0.25 -0.47 0.82 -1.51 0.00 0.00 179.97 178.93 2qee h ILE 153 N 0.38 0.06 -0.97 1.20 2.04 -1.23 -0.08 117.51 118.91 2qee h ILE 153 Ca 0.28 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.27 2qee h ILE 153 Cb 0.58 0.06 -0.09 0.00 -0.74 0.00 0.00 36.82 36.63 2qee h ILE 153 CO -0.07 0.00 0.59 0.77 0.00 0.00 0.00 178.15 179.44 2qee h SER 154 N -1.10 0.84 -0.42 1.72 4.64 -1.61 0.26 113.55 117.89 2qee h SER 154 Ca -0.09 0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 2qee h SER 154 Cb 0.90 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 2qee h SER 154 CO 0.05 0.42 0.09 -0.50 -0.87 0.00 0.00 176.83 176.02 2qee h TRP 155 N 0.90 0.72 -0.13 4.77 4.06 -1.47 -1.22 115.95 123.57 2qee h TRP 155 Ca 0.50 -0.09 -0.13 0.00 2.06 0.00 0.00 58.89 61.23 2qee h TRP 155 Cb 0.56 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.51 2qee h TRP 155 CO -0.02 0.69 -0.48 -0.07 -3.56 0.00 0.00 178.44 175.00 2qee h LEU 156 N 0.54 0.36 -0.51 -4.49 3.38 0.09 -2.13 115.31 112.55 2qee h LEU 156 Ca 0.13 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2qee h LEU 156 Cb 0.34 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2qee h LEU 156 CO 0.00 0.78 0.00 -0.62 0.09 0.00 0.00 178.44 178.70 2qee n GLU 157 N -3.97 0.80 -1.29 1.13 1.02 0.81 -4.87 120.64 114.27 2qee n GLU 157 Ca -0.02 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.02 2qee n GLU 157 Cb 0.54 -1.20 -0.04 0.00 -0.02 0.00 0.00 31.44 30.71 2qee n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qee n GLY 158 N 0.20 1.04 3.73 0.62 0.00 -0.80 -4.98 105.19 105.00 2qee n GLY 158 Ca 0.00 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 2qee n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qee s LYS 159 N -2.71 4.26 0.02 1.61 1.02 -0.47 -5.02 119.74 118.43 2qee s LYS 159 Ca 0.00 2.28 0.04 0.00 0.02 0.00 0.00 55.97 58.31 2qee s LYS 159 Cb 0.00 -3.15 -0.03 0.00 -0.52 0.00 0.00 37.83 34.12 2qee s LYS 159 CO 0.00 -0.50 -0.06 -0.65 -0.92 0.00 0.00 175.35 173.21 2qee s GLN 160 N 0.56 2.52 0.57 1.68 -1.52 -1.26 -4.63 119.66 117.58 2qee s GLN 160 Ca 0.65 -0.75 -0.19 0.00 -1.95 0.00 0.00 55.36 53.12 2qee s GLN 160 Cb -0.42 -2.49 -0.05 0.00 -0.22 0.00 0.00 33.01 29.83 2qee s GLN 160 CO 0.35 0.59 1.17 -1.25 -0.25 0.00 0.00 175.29 175.90 2qee s PRO 161 N -1.54 3.18 0.36 2.91 0.04 -1.26 -4.99 135.00 133.70 2qee s PRO 161 Ca 0.18 1.72 -0.24 0.00 0.04 0.00 0.00 61.00 62.70 2qee s PRO 161 Cb -0.11 -1.98 -0.14 0.00 0.04 0.00 0.00 34.50 32.31 2qee s PRO 161 CO 0.09 -1.01 0.49 -3.47 0.04 0.00 0.00 177.00 173.13 2qee n ASP 162 N -1.42 -1.16 0.08 6.66 -0.08 -1.26 -4.86 116.55 114.52 2qee n ASP 162 Ca 0.13 0.96 0.08 0.00 -1.51 0.00 0.00 54.79 54.44 2qee n ASP 162 Cb 0.50 -1.05 0.37 0.00 2.34 0.00 0.00 41.12 43.28 2qee n ASP 162 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2qee n SER 163 N 1.64 0.35 0.02 1.67 3.41 -1.26 -0.92 113.62 118.52 2qee n SER 163 Ca 0.12 0.63 0.13 0.00 -0.26 0.00 0.00 58.87 59.49 2qee n SER 163 Cb 0.36 -0.68 0.49 0.00 -0.26 0.00 0.00 64.21 64.11 2qee n SER 163 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qee n ARG 164 N -1.93 0.06 -4.98 4.33 1.74 -1.26 -4.84 116.66 109.78 2qee n ARG 164 Ca 0.01 0.04 -0.32 0.00 -0.77 0.00 0.00 57.85 56.80 2qee n ARG 164 Cb 0.10 -1.56 -0.14 0.00 -1.02 0.00 0.00 32.46 29.84 2qee n ARG 164 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2qee s PHE 165 N -3.03 2.64 0.03 -1.55 0.08 -0.10 -0.35 117.98 115.71 2qee s PHE 165 Ca 0.12 -0.44 0.08 0.00 0.12 0.00 0.00 56.93 56.82 2qee s PHE 165 Cb 0.17 -1.67 -0.03 0.00 -0.57 0.00 0.00 43.02 40.93 2qee s PHE 165 CO 0.58 -0.03 -0.23 -1.01 -0.10 0.00 0.00 175.22 174.43 2qee s HIS 166 N -0.31 2.06 0.35 0.36 3.76 0.42 -4.69 115.29 117.24 2qee s HIS 166 Ca 0.02 -0.39 -0.16 0.00 -0.15 0.00 0.00 55.06 54.38 2qee s HIS 166 Cb -0.13 -1.25 -0.09 0.00 1.11 0.00 0.00 32.58 32.22 2qee s HIS 166 CO 0.03 0.08 0.79 0.00 -0.85 0.00 0.00 174.74 174.78 2qee s ALA 167 N -0.75 3.26 -0.03 -1.40 0.00 -1.26 -0.00 121.76 121.57 2qee s ALA 167 Ca 0.09 0.11 0.01 0.00 0.00 0.00 0.00 51.96 52.17 2qee s ALA 167 Cb -0.09 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 20.20 2qee s ALA 167 CO 0.01 0.26 -0.03 0.00 0.00 0.00 0.00 175.76 176.00 2qee s ALA 168 N -2.06 0.52 -0.49 0.00 0.00 -1.20 -0.96 121.76 117.57 2qee s ALA 168 Ca 0.56 0.00 -0.25 0.00 0.00 0.00 0.00 51.96 52.27 2qee s ALA 168 Cb -0.10 -0.34 0.03 0.00 0.00 0.00 0.00 23.12 22.71 2qee s ALA 168 CO 0.17 -0.01 0.93 -1.17 0.00 0.00 0.00 175.76 175.68 2qee s LEU 169 N 0.81 4.04 -0.10 0.00 2.96 -0.68 -0.82 118.68 124.88 2qee s LEU 169 Ca -0.10 -0.04 -0.28 0.00 -0.22 0.00 0.00 54.13 53.49 2qee s LEU 169 Cb -0.13 -3.07 -0.02 0.00 0.50 0.00 0.00 46.19 43.48 2qee s LEU 169 CO -0.00 -1.10 0.94 -0.60 -1.32 0.00 0.00 176.35 174.26 2qee s ARG 170 N 3.81 4.41 -0.04 1.98 3.52 -0.16 -0.56 118.95 131.90 2qee s ARG 170 Ca 0.35 1.27 0.07 0.00 -0.13 0.00 0.00 55.73 57.29 2qee s ARG 170 Cb -0.11 -3.53 0.16 0.00 -1.56 0.00 0.00 34.95 29.91 2qee s ARG 170 CO 0.24 -0.25 1.11 1.28 -0.81 0.00 0.00 175.30 176.87 2qee n LEU 171 N 4.82 2.38 -0.21 -0.88 4.77 0.34 -4.51 117.00 123.71 2qee n LEU 171 Ca 0.07 -2.31 0.01 0.00 -0.03 0.00 0.00 56.01 53.75 2qee n LEU 171 Cb 0.49 -0.18 0.11 0.00 -2.33 0.00 0.00 43.42 41.52 2qee n LEU 171 CO 0.51 0.60 0.87 0.44 -1.33 0.00 0.00 177.39 178.47 2qee h ASP 172 N 0.49 -0.17 -0.57 -1.43 5.19 -1.93 -1.84 116.42 116.17 2qee h ASP 172 Ca 0.00 0.14 -0.00 0.00 -0.62 0.00 0.00 57.03 56.55 2qee h ASP 172 Cb 0.72 0.23 -0.03 0.00 0.18 0.00 0.00 39.33 40.44 2qee h ASP 172 CO 0.02 -0.08 0.35 -0.65 -3.12 0.00 0.00 179.24 175.76 2qee h PRO 173 N 0.17 0.78 -0.10 3.56 0.11 -1.94 0.50 132.00 135.07 2qee h PRO 173 Ca 0.33 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.35 2qee h PRO 173 Cb 0.53 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.47 2qee h PRO 173 CO -0.49 0.55 -0.05 1.25 -0.21 0.00 0.00 178.00 179.04 2qee h LEU 174 N 0.79 0.23 0.19 2.35 5.85 -1.66 -2.14 115.31 120.92 2qee h LEU 174 Ca 0.21 -0.42 -0.33 0.00 0.84 0.00 0.00 57.88 58.18 2qee h LEU 174 Cb -0.03 -0.06 0.02 0.00 0.37 0.00 0.00 40.66 40.96 2qee h LEU 174 CO -0.04 0.59 -1.53 -0.07 -0.34 0.00 0.00 178.44 177.05 2qee h LEU 175 N -0.14 0.64 0.00 2.25 4.07 -1.24 -3.24 115.31 117.66 2qee h LEU 175 Ca 0.02 -0.79 -0.04 0.00 0.08 0.00 0.00 57.88 57.16 2qee h LEU 175 Cb 0.51 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.03 2qee h LEU 175 CO 0.02 1.64 -1.44 0.59 -1.08 0.00 0.00 178.44 178.16 2qee n ASN 176 N -3.61 0.54 -1.88 -0.43 3.02 0.15 -3.56 115.26 109.50 2qee n ASN 176 Ca -0.18 0.22 -0.03 0.00 -0.03 0.00 0.00 54.58 54.56 2qee n ASN 176 Cb 1.08 0.92 0.06 0.00 -0.61 0.00 0.00 39.78 41.23 2qee n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2qee n GLU 177 N -2.58 1.59 -0.32 3.52 1.02 -0.81 -4.93 120.64 118.12 2qee n GLU 177 Ca -0.04 -3.17 0.06 0.00 -0.02 0.00 0.00 57.16 53.99 2qee n GLU 177 Cb 0.63 -1.28 0.21 0.00 -0.02 0.00 0.00 31.44 30.98 2qee n GLU 177 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2qee h TYR 178 N 1.76 0.94 -0.96 -0.32 3.20 -1.56 0.79 116.97 120.83 2qee h TYR 178 Ca -0.04 0.03 0.07 0.00 3.14 0.00 0.00 58.73 61.93 2qee h TYR 178 Cb 1.46 -0.29 -0.06 0.00 1.54 0.00 0.00 36.73 39.38 2qee h TYR 178 CO 0.53 0.34 0.62 0.93 -1.64 0.00 0.00 178.16 178.93 2qee h GLU 179 N 0.82 1.07 0.14 1.82 4.39 -1.90 0.19 114.58 121.11 2qee h GLU 179 Ca 0.46 -0.06 -0.30 0.00 0.34 0.00 0.00 59.36 59.79 2qee h GLU 179 Cb 0.51 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 2qee h GLU 179 CO -0.29 0.71 -1.47 1.96 -1.16 0.00 0.00 179.01 178.76 2qee h GLN 180 N 1.11 0.30 0.00 2.33 7.50 -1.69 -3.35 115.11 121.30 2qee h GLN 180 Ca 0.42 -0.51 -0.10 0.00 0.50 0.00 0.00 58.65 58.96 2qee h GLN 180 Cb 0.19 0.19 -0.01 0.00 0.05 0.00 0.00 27.48 27.90 2qee h GLN 180 CO -0.16 1.19 -0.48 1.15 -1.50 0.00 0.00 178.83 179.03 2qee h THR 181 N 0.08 1.01 -0.52 -0.54 2.02 -0.12 -3.26 112.91 111.58 2qee h THR 181 Ca -0.22 -1.90 0.08 0.00 0.77 0.00 0.00 66.41 65.14 2qee h THR 181 Cb 2.03 2.14 -0.03 0.00 -1.74 0.00 0.00 68.15 70.55 2qee h THR 181 CO 0.19 0.47 0.35 0.07 0.37 0.00 0.00 175.52 176.97 2qee h LYS 182 N 0.00 0.36 -0.67 6.66 2.10 -0.79 -0.60 116.57 123.62 2qee h LYS 182 Ca -0.00 -0.02 -0.07 0.00 -2.00 0.00 0.00 60.65 58.55 2qee h LYS 182 Cb 1.10 -0.08 -0.03 0.00 -0.90 0.00 0.00 32.23 32.32 2qee h LYS 182 CO 0.06 0.24 0.13 0.45 -2.00 0.00 0.00 179.45 178.33 2qee h HIS 183 N 0.37 1.15 -0.35 0.07 3.86 -1.79 0.23 115.15 118.69 2qee h HIS 183 Ca 0.24 -0.15 -0.15 0.00 -1.16 0.00 0.00 60.37 59.14 2qee h HIS 183 Cb 0.45 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 2qee h HIS 183 CO -0.00 0.96 -0.39 0.00 0.86 0.00 0.00 177.93 179.36 2qee h ARG 184 N 1.03 0.86 -0.66 2.45 3.08 -1.32 -1.51 114.38 118.30 2qee h ARG 184 Ca 0.21 -0.45 0.02 0.00 0.07 0.00 0.00 59.98 59.83 2qee h ARG 184 Cb 0.41 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 2qee h ARG 184 CO 0.01 1.09 0.42 -0.07 -1.07 0.00 0.00 179.97 180.35 2qee h LEU 185 N 0.70 0.71 -0.25 3.04 3.38 -0.91 -1.14 115.31 120.82 2qee h LEU 185 Ca 0.06 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2qee h LEU 185 Cb 0.97 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2qee h LEU 185 CO 0.09 0.50 0.15 0.03 0.09 0.00 0.00 178.44 179.29 2qee h ARG 186 N 0.84 0.35 -0.63 1.13 3.08 -0.71 0.29 114.38 118.73 2qee h ARG 186 Ca 0.26 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.34 2qee h ARG 186 Cb -0.03 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 29.91 2qee h ARG 186 CO -0.09 0.30 0.42 -0.44 -1.07 0.00 0.00 179.97 179.09 2qee h ASP 187 N 0.31 0.50 -0.01 7.04 5.19 -0.96 0.21 116.42 128.71 2qee h ASP 187 Ca 0.09 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 2qee h ASP 187 Cb 0.04 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.45 2qee h ASP 187 CO -0.02 0.32 0.00 0.79 -3.12 0.00 0.00 179.24 177.21 2qee n TRP 188 N -4.48 0.02 -0.34 4.55 8.01 -0.46 -4.88 117.44 119.86 2qee n TRP 188 Ca 0.10 -0.01 0.00 0.00 -1.31 0.00 0.00 57.50 56.28 2qee n TRP 188 Cb 0.28 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.58 2qee n TRP 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2qee n GLY 189 N 0.90 0.78 3.41 6.99 0.00 0.75 -5.02 105.19 113.01 2qee n GLY 189 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 2qee n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qee s TYR 190 N -2.23 2.90 -1.34 1.61 2.02 0.91 -4.96 117.35 116.27 2qee s TYR 190 Ca 0.00 -0.88 -0.08 0.00 -0.37 0.00 0.00 57.07 55.74 2qee s TYR 190 Cb 0.00 -4.16 0.12 0.00 -0.40 0.00 0.00 41.96 37.52 2qee s TYR 190 CO 0.00 -1.46 2.21 1.63 -1.57 0.00 0.00 175.55 176.36 2qee n LYS 191 N 6.86 4.00 -1.93 -0.62 4.76 -1.26 -2.96 118.16 127.00 2qee n LYS 191 Ca -0.02 -3.33 -0.38 0.00 -2.87 0.00 0.00 58.31 51.71 2qee n LYS 191 Cb 0.45 -2.81 0.02 0.00 -1.84 0.00 0.00 35.03 30.85 2qee n LYS 191 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2qee s VAL 192 N 0.05 2.39 0.65 -0.18 -7.23 -1.26 -4.74 120.40 110.08 2qee s VAL 192 Ca 0.49 0.30 -0.04 0.00 -1.81 0.00 0.00 61.98 60.92 2qee s VAL 192 Cb 0.14 -3.15 0.05 0.00 0.56 0.00 0.00 36.38 33.98 2qee s VAL 192 CO -0.05 -0.00 0.93 0.20 -0.31 0.00 0.00 175.10 175.87 2qee s ASN 193 N -1.05 4.98 0.20 4.85 0.01 -1.26 -4.97 114.94 117.70 2qee s ASN 193 Ca 0.68 0.30 -0.08 0.00 -0.71 0.00 0.00 52.86 53.06 2qee s ASN 193 Cb -0.37 -1.04 0.12 0.00 0.41 0.00 0.00 41.25 40.38 2qee s ASN 193 CO 0.44 -1.44 1.73 0.44 -1.51 0.00 0.00 177.10 176.76 2qee h ASP 194 N -0.37 1.09 -3.15 -1.22 3.32 -2.03 -3.43 116.42 110.64 2qee h ASP 194 Ca -0.44 -0.22 -0.59 0.00 0.02 0.00 0.00 57.03 55.80 2qee h ASP 194 Cb 1.31 -0.29 -0.05 0.00 0.22 0.00 0.00 39.33 40.53 2qee h ASP 194 CO 0.58 1.02 -0.17 -1.83 -1.72 0.00 0.00 179.24 177.12 2qee s GLU 195 N -5.36 3.90 -0.73 3.56 -1.05 -1.26 -5.00 118.70 112.76 2qee s GLU 195 Ca -0.12 0.37 -0.27 0.00 -0.15 0.00 0.00 54.97 54.80 2qee s GLU 195 Cb 0.15 -3.06 0.02 0.00 -0.44 0.00 0.00 34.13 30.79 2qee s GLU 195 CO 0.85 0.58 1.45 -0.46 0.95 0.00 0.00 175.26 178.63 2qee s TRP 196 N -1.30 2.13 0.19 4.83 -0.11 -1.26 -4.62 118.94 118.79 2qee s TRP 196 Ca 0.31 0.12 0.02 0.00 1.22 0.00 0.00 56.10 57.78 2qee s TRP 196 Cb -0.15 -4.49 -0.01 0.00 -1.50 0.00 0.00 33.47 27.32 2qee s TRP 196 CO 0.17 -2.12 0.20 0.27 -4.62 0.00 0.00 176.95 170.85 2qee n ASN 197 N 10.29 -0.52 0.26 5.86 0.23 -1.26 -5.02 115.26 125.10 2qee n ASN 197 Ca 0.10 -2.15 0.10 0.00 -0.53 0.00 0.00 54.58 52.10 2qee n ASN 197 Cb 0.50 1.09 0.72 0.00 -2.08 0.00 0.00 39.78 40.01 2qee n ASN 197 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2qee h GLU 198 N 0.00 0.00 0.40 -3.83 4.57 -1.99 -0.86 114.58 112.87 2qee h GLU 198 Ca -0.14 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 2qee h GLU 198 Cb 0.66 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 2qee h GLU 198 CO 0.19 0.00 -0.19 0.78 -1.18 0.00 0.00 179.01 178.61 2qee h GLY 199 N 0.00 -0.56 1.01 1.92 0.00 -1.96 -1.60 103.07 101.88 2qee h GLY 199 Ca 0.01 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2qee h GLY 199 CO -0.00 -0.20 0.62 1.76 0.00 0.00 0.00 176.54 178.71 2qee h SER 200 N -0.72 1.14 -0.42 0.19 0.02 -1.50 -2.69 113.55 109.57 2qee h SER 200 Ca -0.06 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.82 2qee h SER 200 Cb 0.51 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 2qee h SER 200 CO 0.09 0.85 0.16 0.40 -1.14 0.00 0.00 176.83 177.19 2qee h ILE 201 N 1.33 1.20 -0.20 3.27 2.04 -1.13 -0.87 117.51 123.15 2qee h ILE 201 Ca 0.35 -0.63 -0.12 0.00 1.00 0.00 0.00 64.86 65.46 2qee h ILE 201 Cb -0.11 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 2qee h ILE 201 CO -0.07 0.23 -0.40 1.56 0.00 0.00 0.00 178.15 179.47 2qee h GLN 202 N 0.53 0.47 -0.26 2.37 1.08 -1.09 -1.42 115.11 116.80 2qee h GLN 202 Ca 0.14 -0.23 -0.19 0.00 -1.45 0.00 0.00 58.65 56.92 2qee h GLN 202 Cb 0.20 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2qee h GLN 202 CO -0.01 0.79 -0.58 0.93 -0.95 0.00 0.00 178.83 179.01 2qee h GLU 203 N 0.39 0.82 -0.53 1.46 4.39 -1.25 -0.08 114.58 119.78 2qee h GLU 203 Ca 0.04 -0.54 -0.06 0.00 0.34 0.00 0.00 59.36 59.13 2qee h GLU 203 Cb 0.87 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.57 2qee h GLU 203 CO 0.07 1.17 0.08 0.28 -1.16 0.00 0.00 179.01 179.45 2qee h VAL 204 N 0.62 1.25 -0.96 3.13 2.07 -1.00 -1.51 116.25 119.86 2qee h VAL 204 Ca 0.00 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.56 2qee h VAL 204 Cb 1.19 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 31.76 2qee h VAL 204 CO 0.13 0.35 0.59 0.11 0.02 0.00 0.00 177.57 178.77 2qee h LYS 205 N 0.77 1.30 -0.65 1.57 1.57 -1.15 -1.45 116.57 118.52 2qee h LYS 205 Ca 0.16 -0.11 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 2qee h LYS 205 Cb 0.41 -0.28 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2qee h LYS 205 CO 0.01 0.90 0.11 -0.09 -0.57 0.00 0.00 179.45 179.81 2qee h ARG 206 N 1.32 1.08 -0.22 3.15 2.43 -0.76 0.11 114.38 121.49 2qee h ARG 206 Ca 0.35 -0.29 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 2qee h ARG 206 Cb -0.08 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.31 2qee h ARG 206 CO -0.07 0.99 0.00 0.35 -1.51 0.00 0.00 179.97 179.74 2qee h PHE 207 N 1.00 -0.00 -0.04 2.20 3.57 -0.68 0.70 116.94 123.69 2qee h PHE 207 Ca 0.20 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.71 2qee h PHE 207 Cb 0.43 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.20 2qee h PHE 207 CO 0.03 -0.03 0.02 -0.07 -2.23 0.00 0.00 178.31 176.04 2qee h LEU 208 N 0.08 0.05 -0.74 0.59 3.38 -0.97 -2.10 115.31 115.59 2qee h LEU 208 Ca 0.10 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.04 2qee h LEU 208 Cb 0.13 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2qee h LEU 208 CO -0.17 0.12 0.44 0.74 0.09 0.00 0.00 178.44 179.66 2qee h THR 209 N -0.03 1.03 -0.75 0.22 2.02 -0.59 0.14 112.91 114.95 2qee h THR 209 Ca 0.01 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.90 2qee h THR 209 Cb 0.08 0.13 -0.04 0.00 -1.74 0.00 0.00 68.15 66.58 2qee h THR 209 CO -0.00 0.15 0.45 0.44 0.37 0.00 0.00 175.52 176.93 2qee h ASP 210 N 0.83 0.91 0.91 4.18 3.32 -0.68 -0.34 116.42 125.54 2qee h ASP 210 Ca 0.32 -0.05 -0.23 0.00 0.02 0.00 0.00 57.03 57.09 2qee h ASP 210 Cb 0.14 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 2qee h ASP 210 CO -0.16 0.70 -1.08 -0.50 -1.72 0.00 0.00 179.24 176.48 2qee h TRP 211 N 1.04 0.07 -0.46 4.55 4.06 -0.76 -1.93 115.95 122.53 2qee h TRP 211 Ca 0.27 -0.05 -0.01 0.00 2.06 0.00 0.00 58.89 61.16 2qee h TRP 211 Cb -0.03 -0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.11 2qee h TRP 211 CO 0.00 1.04 0.25 0.82 -3.56 0.00 0.00 178.44 177.00 2qee h ILE 212 N 0.01 1.16 -0.24 1.49 2.04 -0.78 0.59 117.51 121.78 2qee h ILE 212 Ca -0.05 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.43 2qee h ILE 212 Cb 1.82 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 2qee h ILE 212 CO 0.14 0.17 0.11 -0.33 0.00 0.00 0.00 178.15 178.23 2qee h GLU 213 N 0.60 0.23 -0.38 2.37 4.39 -0.90 0.36 114.58 121.25 2qee h GLU 213 Ca 0.16 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.77 2qee h GLU 213 Cb 0.04 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2qee h GLU 213 CO -0.03 0.15 -0.06 -0.09 -1.16 0.00 0.00 179.01 177.82 2qee h ARG 214 N 0.24 0.71 0.00 2.33 2.43 -1.22 -3.35 114.38 115.52 2qee h ARG 214 Ca 0.10 -0.26 -0.24 0.00 -0.81 0.00 0.00 59.98 58.77 2qee h ARG 214 Cb 0.04 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.50 2qee h ARG 214 CO -0.08 0.85 -1.80 -1.33 -1.51 0.00 0.00 179.97 176.10 2qee n MET 215 N -4.40 0.65 -3.60 0.20 2.81 0.19 -4.99 117.12 107.98 2qee n MET 215 Ca -0.01 0.14 -0.26 0.00 -1.81 0.00 0.00 57.70 55.76 2qee n MET 215 Cb 0.33 -1.70 0.05 0.00 -0.71 0.00 0.00 33.22 31.18 2qee n MET 215 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2qee n ASP 216 N -2.84 -4.78 -4.81 7.83 2.03 0.11 -4.59 116.55 109.49 2qee n ASP 216 Ca -0.17 -0.92 -0.33 0.00 0.52 0.00 0.00 54.79 53.89 2qee n ASP 216 Cb 0.95 -3.88 -0.06 0.00 -0.72 0.00 0.00 41.12 37.41 2qee n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2qee s PRO 217 N -5.65 4.12 0.29 -0.67 0.04 -1.26 -4.58 135.00 127.28 2qee s PRO 217 Ca 0.38 1.19 0.15 0.00 0.04 0.00 0.00 61.00 62.76 2qee s PRO 217 Cb -0.11 -2.16 0.27 0.00 0.04 0.00 0.00 34.50 32.53 2qee s PRO 217 CO 0.83 -0.14 1.53 -0.39 0.04 0.00 0.00 177.00 178.87 2qee h VAL 218 N 1.82 1.06 -3.17 -0.36 -1.51 -1.40 -3.47 116.25 109.22 2qee h VAL 218 Ca -0.49 -2.17 0.00 0.00 -1.23 0.00 0.00 66.70 62.82 2qee h VAL 218 Cb 1.19 2.30 -0.09 0.00 -2.13 0.00 0.00 31.29 32.56 2qee h VAL 218 CO 0.60 0.54 0.12 -0.72 -1.23 0.00 0.00 177.57 176.88 2qee s TYR 219 N -3.20 -0.20 -0.07 5.19 -0.85 -1.26 -4.28 117.35 112.68 2qee s TYR 219 Ca 0.02 -0.15 -0.01 0.00 -0.52 0.00 0.00 57.07 56.40 2qee s TYR 219 Cb 0.10 0.51 -0.03 0.00 0.38 0.00 0.00 41.96 42.91 2qee s TYR 219 CO 0.74 -1.00 0.01 -1.64 -1.52 0.00 0.00 175.55 172.13 2qee s MET 220 N -3.87 2.96 0.09 -3.49 -1.94 -0.72 -1.69 119.30 110.65 2qee s MET 220 Ca 0.09 -0.43 0.05 0.00 -1.71 0.00 0.00 55.69 53.68 2qee s MET 220 Cb -0.02 -2.78 -0.03 0.00 2.01 0.00 0.00 34.83 34.00 2qee s MET 220 CO -0.02 0.69 -0.13 0.00 -0.01 0.00 0.00 175.02 175.56 2qee s ALA 221 N -0.92 1.24 -0.07 3.03 0.00 0.27 0.18 121.76 125.47 2qee s ALA 221 Ca 0.14 -1.14 -0.17 0.00 0.00 0.00 0.00 51.96 50.80 2qee s ALA 221 Cb -0.11 -0.05 0.04 0.00 0.00 0.00 0.00 23.12 22.99 2qee s ALA 221 CO 0.04 0.08 0.40 0.54 0.00 0.00 0.00 175.76 176.82 2qee s VAL 222 N -1.88 0.03 -0.12 0.00 0.11 -0.27 -0.51 120.40 117.76 2qee s VAL 222 Ca 0.03 -0.23 -0.07 0.00 -2.93 0.00 0.00 61.98 58.79 2qee s VAL 222 Cb -0.06 -0.66 -0.04 0.00 -1.53 0.00 0.00 36.38 34.09 2qee s VAL 222 CO 0.02 -0.13 0.12 -0.44 -3.33 0.00 0.00 175.10 171.34 2qee s SER 223 N -0.71 6.22 0.09 3.54 0.01 -1.26 -0.77 113.70 120.82 2qee s SER 223 Ca -0.08 0.41 0.04 0.00 1.31 0.00 0.00 55.95 57.63 2qee s SER 223 Cb -0.04 -2.00 -0.03 0.00 0.21 0.00 0.00 66.02 64.16 2qee s SER 223 CO 0.04 0.39 -0.12 -0.76 0.41 0.00 0.00 173.24 173.19 2qee s LEU 224 N -0.89 2.36 0.73 2.44 1.43 0.73 -4.93 118.68 120.55 2qee s LEU 224 Ca 0.14 -0.74 -0.09 0.00 -1.03 0.00 0.00 54.13 52.41 2qee s LEU 224 Cb -0.12 -0.40 0.05 0.00 0.03 0.00 0.00 46.19 45.76 2qee s LEU 224 CO 0.03 -0.18 1.08 -2.16 0.23 0.00 0.00 176.35 175.35 2qee s PRO 225 N -2.39 2.30 0.61 1.29 0.04 -1.25 -0.63 135.00 134.98 2qee s PRO 225 Ca 0.03 0.04 0.36 0.00 0.04 0.00 0.00 61.00 61.47 2qee s PRO 225 Cb -0.06 -2.07 2.03 0.00 0.04 0.00 0.00 34.50 34.44 2qee s PRO 225 CO 0.01 -1.28 2.27 -1.35 0.04 0.00 0.00 177.00 176.69 2qee h PRO 226 N -0.74 0.00 -0.14 0.56 0.11 -1.78 -1.29 132.00 128.73 2qee h PRO 226 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2qee h PRO 226 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2qee h PRO 226 CO 0.63 0.02 0.00 0.25 -0.21 0.00 0.00 178.00 178.69 2qee n THR 227 N -3.43 0.19 -1.64 -1.15 -2.24 -1.26 -4.01 114.28 100.73 2qee n THR 227 Ca -0.03 -0.22 -0.49 0.00 -2.27 0.00 0.00 64.05 61.04 2qee n THR 227 Cb 0.11 0.10 -0.05 0.00 -2.10 0.00 0.00 70.33 68.39 2qee n THR 227 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2qee n PHE 228 N -0.06 1.94 -4.06 4.78 7.35 -0.49 -4.98 117.46 121.94 2qee n PHE 228 Ca 0.11 0.43 -0.11 0.00 -0.76 0.00 0.00 57.45 57.12 2qee n PHE 228 Cb 0.19 -2.45 -0.11 0.00 0.35 0.00 0.00 39.48 37.45 2qee n PHE 228 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 2qee s SER 229 N 0.99 0.67 -0.28 -2.13 1.04 -1.26 -4.67 113.70 108.05 2qee s SER 229 Ca 0.83 -0.65 -0.19 0.00 0.48 0.00 0.00 55.95 56.42 2qee s SER 229 Cb -0.81 0.08 0.08 0.00 0.10 0.00 0.00 66.02 65.47 2qee s SER 229 CO 0.43 -0.32 0.72 0.12 0.98 0.00 0.00 173.24 175.17 2qee s PHE 230 N -2.03 -0.96 0.80 5.02 2.19 -1.26 -4.44 117.98 117.30 2qee s PHE 230 Ca -0.07 2.03 -0.13 0.00 0.33 0.00 0.00 56.93 59.09 2qee s PHE 230 Cb -0.06 0.53 0.08 0.00 -1.31 0.00 0.00 43.02 42.26 2qee s PHE 230 CO -0.02 -0.47 1.18 -2.14 1.83 0.00 0.00 175.22 175.60 2qee s PRO 231 N 1.27 1.70 -0.18 10.12 0.02 -1.26 -4.14 135.00 142.53 2qee s PRO 231 Ca -0.07 1.67 -0.16 0.00 0.02 0.00 0.00 61.00 62.46 2qee s PRO 231 Cb -0.05 -1.79 0.05 0.00 0.02 0.00 0.00 34.50 32.73 2qee s PRO 231 CO -0.14 -2.15 0.48 -2.00 -0.33 0.00 0.00 177.00 172.86 2qee s GLU 232 N -4.24 0.54 -1.28 5.54 2.12 -1.26 -5.05 118.70 115.07 2qee s GLU 232 Ca 0.71 0.71 -0.16 0.00 0.36 0.00 0.00 54.97 56.59 2qee s GLU 232 Cb -0.27 0.22 0.11 0.00 0.26 0.00 0.00 34.13 34.46 2qee s GLU 232 CO 0.51 -0.08 1.66 0.39 -0.54 0.00 0.00 175.26 177.20 2qee n GLU 233 N 3.10 3.26 -4.13 4.30 -0.58 -1.26 -3.80 120.64 121.52 2qee n GLU 233 Ca -0.15 -3.45 -0.11 0.00 -0.42 0.00 0.00 57.16 53.02 2qee n GLU 233 Cb 0.57 -3.31 -0.08 0.00 -0.57 0.00 0.00 31.44 28.05 2qee n GLU 233 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2qee s SER 234 N 3.56 0.11 0.21 1.62 1.04 -1.26 -4.99 113.70 114.00 2qee s SER 234 Ca 0.49 -1.24 -0.10 0.00 0.48 0.00 0.00 55.95 55.58 2qee s SER 234 Cb 0.02 0.46 0.17 0.00 0.10 0.00 0.00 66.02 66.77 2qee s SER 234 CO 0.04 -0.96 1.88 0.78 0.98 0.00 0.00 173.24 175.96 2qee h ASN 235 N 2.47 0.91 0.10 7.02 2.35 -1.91 0.12 115.58 126.64 2qee h ASN 235 Ca -0.32 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.39 2qee h ASN 235 Cb 1.25 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 39.39 2qee h ASN 235 CO 0.46 0.67 -0.05 -0.09 -1.65 0.00 0.00 177.43 176.77 2qee h ARG 236 N 1.06 -0.14 -0.73 0.81 2.43 -1.91 -1.07 114.38 114.84 2qee h ARG 236 Ca 0.29 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.56 2qee h ARG 236 Cb -0.11 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.40 2qee h ARG 236 CO -0.06 -0.09 0.37 0.78 -1.51 0.00 0.00 179.97 179.45 2qee h GLY 237 N -0.15 1.11 1.00 2.80 0.00 -1.60 -1.93 103.07 104.30 2qee h GLY 237 Ca -0.01 -0.23 -0.15 0.00 0.00 0.00 0.00 47.33 46.95 2qee h GLY 237 CO 0.02 0.05 -0.42 3.21 0.00 0.00 0.00 176.54 179.40 2qee h ARG 238 N 0.61 0.71 -0.51 4.80 3.08 -0.82 -2.23 114.38 120.02 2qee h ARG 238 Ca 0.36 -0.44 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 2qee h ARG 238 Cb 0.40 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2qee h ARG 238 CO -0.28 1.06 0.03 0.82 -1.07 0.00 0.00 179.97 180.53 2qee h ILE 239 N 0.44 1.26 0.05 2.04 2.04 -1.07 0.18 117.51 122.44 2qee h ILE 239 Ca 0.02 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.83 2qee h ILE 239 Cb 1.01 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2qee h ILE 239 CO 0.09 0.37 -0.03 0.40 0.00 0.00 0.00 178.15 178.99 2qee h ILE 240 N 0.76 0.96 -0.04 -0.67 2.04 -1.37 0.40 117.51 119.58 2qee h ILE 240 Ca 0.15 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 2qee h ILE 240 Cb 0.48 0.98 -0.00 0.00 -0.74 0.00 0.00 36.82 37.54 2qee h ILE 240 CO 0.02 0.01 0.01 -0.09 0.00 0.00 0.00 178.15 178.10 2qee h ARG 241 N -0.09 0.07 0.00 2.37 2.43 -1.26 -0.38 114.38 117.51 2qee h ARG 241 Ca -0.01 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 2qee h ARG 241 Cb 0.07 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2qee h ARG 241 CO 0.01 0.24 -1.28 -0.25 -1.51 0.00 0.00 179.97 177.18 2qee n ASP 242 N -4.95 0.70 0.04 -3.80 8.00 0.61 -4.47 116.55 112.68 2qee n ASP 242 Ca -0.07 0.28 -0.00 0.00 0.71 0.00 0.00 54.79 55.71 2qee n ASP 242 Cb 0.12 0.63 -0.00 0.00 -0.02 0.00 0.00 41.12 41.85 2qee n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qee h LEU 244 N -0.01 -0.42 0.08 0.00 6.46 -0.91 -1.69 115.31 118.82 2qee h LEU 244 Ca 0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2qee h LEU 244 Cb 0.01 0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.05 2qee h LEU 244 CO 0.00 -0.28 -0.04 -0.07 -0.62 0.00 0.00 178.44 177.43 2qee h LEU 245 N -0.52 -0.09 -0.82 2.25 3.38 -1.30 0.54 115.31 118.75 2qee h LEU 245 Ca -0.05 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2qee h LEU 245 Cb 0.39 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2qee h LEU 245 CO 0.08 0.06 0.52 -0.65 0.09 0.00 0.00 178.44 178.54 2qee h PRO 246 N -0.24 1.10 -0.40 1.13 0.11 -1.78 -0.20 132.00 131.72 2qee h PRO 246 Ca -0.01 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 2qee h PRO 246 Cb 0.20 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 2qee h PRO 246 CO 0.02 0.75 0.23 0.28 -0.21 0.00 0.00 178.00 179.07 2qee h VAL 247 N 1.12 1.14 -0.73 3.15 2.07 -1.11 -0.87 116.25 121.02 2qee h VAL 247 Ca 0.30 -0.35 0.04 0.00 0.82 0.00 0.00 66.70 67.51 2qee h VAL 247 Cb -0.08 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.29 2qee h VAL 247 CO -0.06 0.15 0.44 0.00 0.02 0.00 0.00 177.57 178.12 2qee h ALA 248 N 1.09 0.97 0.08 1.67 0.00 -0.52 -2.00 119.26 120.54 2qee h ALA 248 Ca 0.14 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2qee h ALA 248 Cb 0.03 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2qee h ALA 248 CO -0.02 0.19 -0.04 1.49 0.00 0.00 0.00 179.25 180.87 2qee h GLU 249 N 0.85 -0.10 -0.88 0.00 4.81 -0.69 0.54 114.58 119.11 2qee h GLU 249 Ca 0.30 0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.66 2qee h GLU 249 Cb 0.09 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.40 2qee h GLU 249 CO -0.14 0.12 0.50 -0.22 -0.73 0.00 0.00 179.01 178.54 2qee h LYS 250 N -0.31 0.75 -0.05 1.92 3.64 -0.97 -0.95 116.57 120.60 2qee h LYS 250 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2qee h LYS 250 Cb 0.26 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2qee h LYS 250 CO 0.02 0.50 0.00 0.72 -2.27 0.00 0.00 179.45 178.41 2qee n HIS 251 N -4.76 0.05 -3.92 1.91 8.25 -0.77 -4.95 115.22 111.02 2qee n HIS 251 Ca 0.16 -0.02 -0.25 0.00 -0.26 0.00 0.00 57.72 57.34 2qee n HIS 251 Cb 0.36 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.46 2qee n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2qee n ASN 252 N 0.37 -0.82 -4.43 0.41 4.05 0.01 -4.97 115.26 109.88 2qee n ASN 252 Ca 0.18 -0.97 -0.34 0.00 0.45 0.00 0.00 54.58 53.91 2qee n ASN 252 Cb 0.39 -3.24 -0.13 0.00 1.23 0.00 0.00 39.78 38.02 2qee n ASN 252 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2qee s ILE 253 N -3.84 3.65 0.74 -1.44 -1.09 -0.22 -4.87 121.20 114.12 2qee s ILE 253 Ca 0.08 -0.43 -0.13 0.00 -2.23 0.00 0.00 60.65 57.93 2qee s ILE 253 Cb -0.04 -2.60 0.04 0.00 -1.58 0.00 0.00 42.46 38.28 2qee s ILE 253 CO 0.88 0.48 1.11 -2.84 -1.23 0.00 0.00 174.94 173.34 2qee s PRO 254 N 0.64 2.36 -0.26 2.79 0.02 -1.26 -4.63 135.00 134.65 2qee s PRO 254 Ca -0.03 1.34 -0.08 0.00 0.02 0.00 0.00 61.00 62.25 2qee s PRO 254 Cb -0.15 -1.90 -0.02 0.00 0.02 0.00 0.00 34.50 32.45 2qee s PRO 254 CO 0.02 -1.59 0.08 0.12 -0.33 0.00 0.00 177.00 175.31 2qee s PHE 255 N -2.58 3.10 -0.21 6.54 5.36 -0.16 -1.75 117.98 128.29 2qee s PHE 255 Ca 0.65 -0.49 -0.14 0.00 -0.96 0.00 0.00 56.93 55.99 2qee s PHE 255 Cb -0.20 -2.26 -0.04 0.00 -0.34 0.00 0.00 43.02 40.18 2qee s PHE 255 CO 0.49 -0.39 0.32 0.00 -1.46 0.00 0.00 175.22 174.19 2qee s ALA 256 N 1.61 3.58 -0.21 11.12 0.00 0.13 -1.40 121.76 136.58 2qee s ALA 256 Ca 0.06 -0.61 -0.02 0.00 0.00 0.00 0.00 51.96 51.38 2qee s ALA 256 Cb -0.16 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.45 2qee s ALA 256 CO 0.04 -0.22 -0.09 -1.64 0.00 0.00 0.00 175.76 173.85 2qee s MET 257 N 1.14 3.20 -0.42 0.00 1.00 0.75 -1.11 119.30 123.86 2qee s MET 257 Ca 0.16 -0.73 -0.07 0.00 0.00 0.00 0.00 55.69 55.05 2qee s MET 257 Cb -0.14 -2.89 0.09 0.00 0.00 0.00 0.00 34.83 31.89 2qee s MET 257 CO 0.06 -0.23 0.24 -1.64 0.00 0.00 0.00 175.02 173.46 2qee s MET 258 N 1.41 2.39 -0.11 2.03 -1.94 0.05 -2.20 119.30 120.92 2qee s MET 258 Ca 0.05 -1.62 -0.01 0.00 -1.71 0.00 0.00 55.69 52.40 2qee s MET 258 Cb -0.14 -3.71 -0.03 0.00 2.01 0.00 0.00 34.83 32.96 2qee s MET 258 CO -0.06 -1.02 -0.06 0.42 -0.01 0.00 0.00 175.02 174.29 2qee s ILE 259 N 1.32 3.72 0.00 2.53 1.01 -0.53 -0.19 121.20 129.05 2qee s ILE 259 Ca 0.04 -0.44 0.00 0.00 0.00 0.00 0.00 60.65 60.25 2qee s ILE 259 Cb -0.23 -2.57 0.00 0.00 0.01 0.00 0.00 42.46 39.66 2qee s ILE 259 CO -0.01 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.09 2qee n GLY 260 N 2.97 0.47 3.69 6.18 0.00 0.19 -0.55 105.19 118.13 2qee n GLY 260 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 2qee n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qee s VAL 261 N -1.39 5.04 -0.44 1.61 0.11 -1.03 -1.72 120.40 122.58 2qee s VAL 261 Ca 0.00 1.27 -0.14 0.00 -2.93 0.00 0.00 61.98 60.18 2qee s VAL 261 Cb 0.00 -3.97 0.06 0.00 -1.53 0.00 0.00 36.38 30.94 2qee s VAL 261 CO 0.00 0.18 0.34 -0.75 -3.33 0.00 0.00 175.10 171.54 2qee s LYS 262 N 1.42 2.92 0.18 1.54 2.20 -0.39 -3.86 119.74 123.76 2qee s LYS 262 Ca 0.32 -1.27 -0.30 0.00 -0.36 0.00 0.00 55.97 54.36 2qee s LYS 262 Cb -0.16 -4.02 -0.08 0.00 -1.51 0.00 0.00 37.83 32.05 2qee s LYS 262 CO 0.13 -0.93 1.19 0.15 -0.36 0.00 0.00 175.35 175.52 2qee s LYS 263 N 1.62 4.50 -1.30 4.03 -0.14 -1.26 -0.33 119.74 126.85 2qee s LYS 263 Ca 0.04 1.86 -0.00 0.00 -1.36 0.00 0.00 55.97 56.51 2qee s LYS 263 Cb -0.23 -3.24 0.00 0.00 -1.68 0.00 0.00 37.83 32.68 2qee s LYS 263 CO 0.07 -0.07 0.73 0.54 -0.76 0.00 0.00 175.35 175.86 2qee n ARG 264 N 2.49 -5.10 0.23 1.68 5.12 -1.21 -4.87 116.66 115.00 2qee n ARG 264 Ca 0.04 0.64 0.10 0.00 -1.93 0.00 0.00 57.85 56.70 2qee n ARG 264 Cb 0.45 -5.25 0.56 0.00 -1.16 0.00 0.00 32.46 27.05 2qee n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 2qee h VAL 265 N -1.88 0.68 -2.83 1.55 -1.51 -1.06 -3.33 116.25 107.87 2qee h VAL 265 Ca -0.61 -0.91 -0.61 0.00 -1.23 0.00 0.00 66.70 63.34 2qee h VAL 265 Cb 1.36 1.58 -0.40 0.00 -2.13 0.00 0.00 31.29 31.69 2qee h VAL 265 CO 0.56 0.21 -0.74 -2.28 -1.23 0.00 0.00 177.57 174.08 2qee s HIS 266 N -3.96 2.40 0.31 5.19 5.65 -0.89 -5.02 115.29 118.98 2qee s HIS 266 Ca -0.01 -2.81 0.07 0.00 0.25 0.00 0.00 55.06 52.56 2qee s HIS 266 Cb 0.12 -1.94 0.76 0.00 -1.18 0.00 0.00 32.58 30.34 2qee s HIS 266 CO 0.63 -0.69 1.78 -1.35 -0.65 0.00 0.00 174.74 174.45 2qee h PRO 267 N 5.79 0.72 0.00 2.88 0.11 -1.84 -1.43 132.00 138.23 2qee h PRO 267 Ca 0.15 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.21 2qee h PRO 267 Cb 0.85 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.79 2qee h PRO 267 CO 0.55 0.48 -0.01 0.00 -0.21 0.00 0.00 178.00 178.81 2qee h ALA 268 N 1.64 1.04 -0.00 -0.75 0.00 -1.95 -0.40 119.26 118.84 2qee h ALA 268 Ca 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2qee h ALA 268 Cb 0.93 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2qee h ALA 268 CO -0.37 0.02 -0.02 1.28 0.00 0.00 0.00 179.25 180.16 2qee n LEU 269 N -3.16 0.05 0.00 0.00 4.77 -0.54 -4.99 117.00 113.13 2qee n LEU 269 Ca -0.02 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 2qee n LEU 269 Cb 0.18 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2qee n LEU 269 CO 0.24 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2qee n GLY 270 N 1.32 3.53 0.47 -0.72 0.00 -0.16 -1.88 105.19 107.75 2qee n GLY 270 Ca 0.13 -0.10 0.29 0.00 0.00 0.00 0.00 46.02 46.33 2qee n GLY 270 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qee h ASP 271 N 0.38 0.00 -0.16 1.61 3.32 -1.94 0.85 116.42 120.49 2qee h ASP 271 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qee h ASP 271 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2qee h ASP 271 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 2qee n ALA 272 N -2.68 2.51 -0.45 3.45 0.00 -0.79 -4.19 120.51 118.37 2qee n ALA 272 Ca 0.18 -0.37 0.10 0.00 0.00 0.00 0.00 53.44 53.36 2qee n ALA 272 Cb 0.97 -1.08 0.32 0.00 0.00 0.00 0.00 19.45 19.67 2qee n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qee n GLY 273 N 0.91 2.64 3.86 0.00 0.00 0.29 -4.85 105.19 108.05 2qee n GLY 273 Ca 0.11 -0.79 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 2qee n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qee s ASP 274 N -0.99 6.65 0.00 1.61 1.01 -1.26 -0.65 116.67 123.03 2qee s ASP 274 Ca 0.48 0.78 0.00 0.00 0.71 0.00 0.00 52.55 54.52 2qee s ASP 274 Cb 0.27 -2.18 0.00 0.00 1.01 0.00 0.00 42.92 42.02 2qee s ASP 274 CO 0.29 0.24 0.00 0.33 0.21 0.00 0.00 175.17 176.24 2qee n PHE 275 N 1.25 -0.20 -4.07 4.23 7.35 0.55 -4.93 117.46 121.64 2qee n PHE 275 Ca -0.11 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.47 2qee n PHE 275 Cb 0.53 0.00 -0.11 0.00 0.35 0.00 0.00 39.48 40.25 2qee n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2qee s VAL 276 N -0.44 0.44 0.01 -2.13 0.11 -1.26 -1.26 120.40 115.88 2qee s VAL 276 Ca 0.00 -1.28 -0.16 0.00 -2.93 0.00 0.00 61.98 57.60 2qee s VAL 276 Cb 0.00 -0.83 0.03 0.00 -1.53 0.00 0.00 36.38 34.04 2qee s VAL 276 CO 0.00 -0.57 0.35 -0.83 -3.33 0.00 0.00 175.10 170.73 2qee s GLY 277 N -1.97 -0.19 0.25 6.54 0.00 -0.70 -4.84 107.32 106.40 2qee s GLY 277 Ca -0.05 0.30 -0.30 0.00 0.00 0.00 0.00 44.72 44.67 2qee s GLY 277 CO -0.02 0.07 1.33 1.25 0.00 0.00 0.00 173.10 175.73 2qee s LYS 278 N -1.87 4.36 0.26 2.90 2.20 -1.26 -4.42 119.74 121.90 2qee s LYS 278 Ca -0.09 2.15 0.07 0.00 -0.36 0.00 0.00 55.97 57.74 2qee s LYS 278 Cb -0.03 -3.14 -0.04 0.00 -1.51 0.00 0.00 37.83 33.11 2qee s LYS 278 CO 0.01 -0.26 0.17 0.00 -0.36 0.00 0.00 175.35 174.92 2qee s ALA 279 N -0.28 3.54 0.36 3.13 0.00 -1.26 -4.78 121.76 122.47 2qee s ALA 279 Ca 0.55 -1.47 -0.26 0.00 0.00 0.00 0.00 51.96 50.78 2qee s ALA 279 Cb -0.38 -1.22 -0.09 0.00 0.00 0.00 0.00 23.12 21.43 2qee s ALA 279 CO 0.43 0.24 1.16 0.45 0.00 0.00 0.00 175.76 178.04 2qee s SER 280 N -3.83 6.74 0.00 0.00 0.15 -1.26 -4.94 113.70 110.56 2qee s SER 280 Ca 0.33 2.34 0.29 0.00 0.70 0.00 0.00 55.95 59.61 2qee s SER 280 Cb -0.08 -2.62 1.31 0.00 -1.71 0.00 0.00 66.02 62.92 2qee s SER 280 CO 0.24 -0.52 1.93 0.23 1.20 0.00 0.00 173.24 176.33 2qee n MET 281 N 0.39 0.31 -0.30 5.44 2.81 -1.26 -4.42 117.12 120.09 2qee n MET 281 Ca 0.03 -0.04 -0.03 0.00 -1.81 0.00 0.00 57.70 55.84 2qee n MET 281 Cb 0.46 -1.50 0.09 0.00 -0.71 0.00 0.00 33.22 31.55 2qee n MET 281 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2qee h ASP 282 N 0.10 0.91 -0.54 7.83 3.32 -1.93 0.05 116.42 126.17 2qee h ASP 282 Ca 0.00 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 2qee h ASP 282 Cb 0.38 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 2qee h ASP 282 CO 0.00 0.65 0.19 1.23 -1.72 0.00 0.00 179.24 179.58 2qee h GLY 283 N 1.07 0.89 1.00 2.75 0.00 -1.77 -0.12 103.07 106.90 2qee h GLY 283 Ca 0.31 -0.51 -0.15 0.00 0.00 0.00 0.00 47.33 46.98 2qee h GLY 283 CO -0.08 0.48 -0.46 -2.08 0.00 0.00 0.00 176.54 174.40 2qee h VAL 284 N 0.74 1.31 -0.47 4.60 2.07 -1.70 -1.53 116.25 121.28 2qee h VAL 284 Ca 0.18 -1.67 0.05 0.00 0.82 0.00 0.00 66.70 66.08 2qee h VAL 284 Cb 0.25 1.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.78 2qee h VAL 284 CO -0.01 0.53 0.19 -0.08 0.02 0.00 0.00 177.57 178.22 2qee h GLU 285 N 0.41 0.37 -0.26 1.57 4.81 -0.90 -1.09 114.58 119.49 2qee h GLU 285 Ca 0.01 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2qee h GLU 285 Cb 1.06 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 2qee h GLU 285 CO 0.10 0.25 0.12 1.25 -0.73 0.00 0.00 179.01 180.00 2qee h HIS 286 N 0.38 0.38 -0.04 0.92 2.76 -0.89 -1.69 115.15 116.98 2qee h HIS 286 Ca 0.22 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2qee h HIS 286 Cb 0.19 -0.12 -0.00 0.00 1.55 0.00 0.00 27.41 29.03 2qee h HIS 286 CO -0.14 0.36 0.02 -0.07 -1.30 0.00 0.00 177.93 176.81 2qee h LEU 287 N 0.29 0.04 -0.46 0.26 3.38 -0.99 0.10 115.31 117.93 2qee h LEU 287 Ca 0.09 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.12 2qee h LEU 287 Cb 0.12 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 2qee h LEU 287 CO -0.01 0.03 0.17 -0.07 0.09 0.00 0.00 178.44 178.65 2qee h LEU 288 N 0.05 0.18 -0.21 1.67 3.38 -1.08 -1.91 115.31 117.40 2qee h LEU 288 Ca 0.01 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 2qee h LEU 288 Cb -0.00 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2qee h LEU 288 CO -0.01 0.14 -0.32 -0.09 0.09 0.00 0.00 178.44 178.25 2qee h ARG 289 N 0.35 0.58 0.00 1.13 2.43 -1.13 -3.34 114.38 114.40 2qee h ARG 289 Ca 0.21 -0.35 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2qee h ARG 289 Cb 0.21 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2qee h ARG 289 CO -0.21 0.95 -0.42 0.39 -1.51 0.00 0.00 179.97 179.17 2qee n GLU 290 N -4.32 0.15 -3.21 0.20 -0.58 0.00 -4.15 120.64 108.74 2qee n GLU 290 Ca -0.05 0.06 -0.25 0.00 -0.42 0.00 0.00 57.16 56.49 2qee n GLU 290 Cb 0.48 -1.61 -0.06 0.00 -0.57 0.00 0.00 31.44 29.68 2qee n GLU 290 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2qee n TYR 291 N -1.84 2.63 0.37 -0.32 4.01 -0.73 -4.94 117.16 116.34 2qee n TYR 291 Ca 0.05 -3.96 0.12 0.00 -0.16 0.00 0.00 57.90 53.94 2qee n TYR 291 Cb 0.39 -0.48 0.51 0.00 -0.31 0.00 0.00 39.34 39.44 2qee n TYR 291 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2qee n PRO 292 N 0.54 0.19 -0.09 -0.72 -0.04 -1.26 -1.27 135.00 132.36 2qee n PRO 292 Ca 0.28 0.45 0.12 0.00 -0.04 0.00 0.00 63.50 64.31 2qee n PRO 292 Cb 0.46 -1.89 0.28 0.00 -0.04 0.00 0.00 33.50 32.30 2qee n PRO 292 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2qee n ASN 293 N -2.26 2.58 -4.86 3.54 5.03 -1.26 -4.87 115.26 113.16 2qee n ASN 293 Ca 0.02 -1.85 -0.32 0.00 0.87 0.00 0.00 54.58 53.30 2qee n ASN 293 Cb 0.21 -0.12 -0.05 0.00 -1.02 0.00 0.00 39.78 38.80 2qee n ASN 293 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 2qee s ASN 294 N -1.70 6.05 -0.06 6.41 0.01 -0.40 -4.77 114.94 120.49 2qee s ASN 294 Ca 0.34 0.20 0.00 0.00 -0.71 0.00 0.00 52.86 52.70 2qee s ASN 294 Cb 0.20 -1.80 -0.03 0.00 0.41 0.00 0.00 41.25 40.03 2qee s ASN 294 CO 0.30 0.21 -0.04 -0.54 -1.51 0.00 0.00 177.10 175.52 2qee s LYS 295 N -2.22 2.80 -0.07 -0.60 1.02 -1.26 -4.86 119.74 114.56 2qee s LYS 295 Ca 0.30 -0.53 0.02 0.00 0.02 0.00 0.00 55.97 55.77 2qee s LYS 295 Cb -0.13 -2.65 0.02 0.00 -0.52 0.00 0.00 37.83 34.55 2qee s LYS 295 CO 0.22 0.66 -0.11 -0.06 -0.92 0.00 0.00 175.35 175.15 2qee s PHE 296 N -0.89 1.37 -0.19 3.18 0.08 -0.06 -0.98 117.98 120.49 2qee s PHE 296 Ca 0.14 -0.53 -0.09 0.00 0.12 0.00 0.00 56.93 56.58 2qee s PHE 296 Cb -0.11 -1.04 -0.04 0.00 -0.57 0.00 0.00 43.02 41.25 2qee s PHE 296 CO 0.04 -0.30 0.09 -0.51 -0.10 0.00 0.00 175.22 174.44 2qee s LEU 297 N 0.85 3.99 -0.01 -0.37 1.43 -0.49 -0.90 118.68 123.17 2qee s LEU 297 Ca -0.11 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.15 2qee s LEU 297 Cb -0.15 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.05 2qee s LEU 297 CO 0.02 0.18 -0.05 -0.69 0.23 0.00 0.00 176.35 176.03 2qee s VAL 298 N 0.37 0.47 0.03 -1.59 1.01 -0.56 -0.18 120.40 119.94 2qee s VAL 298 Ca 0.05 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2qee s VAL 298 Cb -0.12 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.83 2qee s VAL 298 CO -0.01 0.15 -0.07 0.28 0.00 0.00 0.00 175.10 175.45 2qee s THR 299 N 0.07 0.48 0.11 3.92 -1.32 -0.94 -1.91 115.64 116.05 2qee s THR 299 Ca -0.00 -0.77 0.07 0.00 -1.21 0.00 0.00 61.69 59.78 2qee s THR 299 Cb -0.05 -0.51 -0.04 0.00 -1.51 0.00 0.00 72.50 70.40 2qee s THR 299 CO -0.00 -0.20 -0.18 -0.04 -2.21 0.00 0.00 174.62 171.99 2qee s MET 300 N -1.05 1.06 -0.01 7.08 -1.94 -1.26 -1.45 119.30 121.73 2qee s MET 300 Ca -0.06 -1.17 0.16 0.00 -1.71 0.00 0.00 55.69 52.91 2qee s MET 300 Cb -0.07 -1.16 -0.19 0.00 2.01 0.00 0.00 34.83 35.42 2qee s MET 300 CO 0.00 0.25 0.65 -0.11 -0.01 0.00 0.00 175.02 175.81 2qee n LEU 301 N 0.89 0.70 -4.74 -0.03 7.94 0.29 -4.61 117.00 117.43 2qee n LEU 301 Ca -0.18 0.32 -0.41 0.00 -1.11 0.00 0.00 56.01 54.63 2qee n LEU 301 Cb 0.55 0.16 -0.05 0.00 0.53 0.00 0.00 43.42 44.61 2qee n LEU 301 CO 0.24 0.26 0.63 -0.55 -1.11 0.00 0.00 177.39 176.86 2qee s SER 302 N -5.76 7.51 0.37 1.96 0.15 -1.26 -4.52 113.70 112.15 2qee s SER 302 Ca -0.05 1.79 0.09 0.00 0.70 0.00 0.00 55.95 58.48 2qee s SER 302 Cb 0.08 -2.58 0.82 0.00 -1.71 0.00 0.00 66.02 62.64 2qee s SER 302 CO 0.82 0.01 1.91 -0.09 1.20 0.00 0.00 173.24 177.09 2qee h ARG 303 N 5.16 0.66 -0.00 5.44 2.43 -1.95 -2.27 114.38 123.86 2qee h ARG 303 Ca -0.44 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 2qee h ARG 303 Cb 1.21 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 2qee h ARG 303 CO 0.70 0.44 -0.01 0.39 -1.51 0.00 0.00 179.97 179.98 2qee n GLU 304 N -4.52 0.43 0.03 0.20 4.71 -1.26 -2.17 120.64 118.05 2qee n GLU 304 Ca 0.15 -0.01 0.12 0.00 -0.01 0.00 0.00 57.16 57.40 2qee n GLU 304 Cb 0.39 -1.50 0.22 0.00 -1.01 0.00 0.00 31.44 29.54 2qee n GLU 304 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2qee n ASN 305 N -1.27 0.58 -0.07 1.62 5.03 -0.85 -4.69 115.26 115.59 2qee n ASN 305 Ca 0.14 -0.04 -0.13 0.00 0.87 0.00 0.00 54.58 55.43 2qee n ASN 305 Cb 0.25 0.20 -0.06 0.00 -1.02 0.00 0.00 39.78 39.16 2qee n ASN 305 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 2qee h GLN 306 N 0.00 0.49 -0.25 3.52 1.08 -1.52 -1.08 115.11 117.35 2qee h GLN 306 Ca 0.00 -0.24 -0.01 0.00 -1.45 0.00 0.00 58.65 56.95 2qee h GLN 306 Cb 0.63 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.05 2qee h GLN 306 CO 0.00 0.80 0.11 1.25 -0.95 0.00 0.00 178.83 180.04 2qee h HIS 307 N 0.18 0.38 0.00 2.96 2.76 -1.84 -1.97 115.15 117.62 2qee h HIS 307 Ca 0.04 -0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.09 2qee h HIS 307 Cb 0.69 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.52 2qee h HIS 307 CO 0.07 0.39 -0.45 1.05 -1.30 0.00 0.00 177.93 177.68 2qee h GLU 308 N 0.26 0.00 -0.56 5.26 4.11 -1.84 -1.57 114.58 120.24 2qee h GLU 308 Ca 0.09 0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.55 2qee h GLU 308 Cb 0.16 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 2qee h GLU 308 CO -0.01 0.45 0.32 1.25 0.07 0.00 0.00 179.01 181.10 2qee h LEU 309 N 0.00 0.51 -0.86 3.06 5.85 -0.95 -0.18 115.31 122.74 2qee h LEU 309 Ca -0.00 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 2qee h LEU 309 Cb 0.87 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 2qee h LEU 309 CO 0.06 0.35 0.52 0.58 -0.34 0.00 0.00 178.44 179.61 2qee h VAL 310 N 0.63 1.24 -0.55 1.05 2.07 -0.58 -1.28 116.25 118.82 2qee h VAL 310 Ca 0.24 -0.50 -0.06 0.00 0.82 0.00 0.00 66.70 67.19 2qee h VAL 310 Cb 0.08 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 2qee h VAL 310 CO -0.13 0.24 0.09 0.58 0.02 0.00 0.00 177.57 178.38 2qee h VAL 311 N 1.18 1.24 -0.33 2.57 2.07 -1.06 -1.83 116.25 120.09 2qee h VAL 311 Ca 0.31 -0.91 -0.10 0.00 0.82 0.00 0.00 66.70 66.82 2qee h VAL 311 Cb -0.06 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 2qee h VAL 311 CO -0.06 0.33 -0.20 0.25 0.02 0.00 0.00 177.57 177.92 2qee h LEU 312 N 0.83 0.61 -1.37 2.57 5.85 -0.39 -1.10 115.31 122.31 2qee h LEU 312 Ca 0.17 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 2qee h LEU 312 Cb 0.36 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2qee h LEU 312 CO 0.01 0.81 -0.09 0.00 -0.34 0.00 0.00 178.44 178.82 2qee h ALA 313 N 1.24 1.49 -0.21 1.25 0.00 -0.45 -1.15 119.26 121.43 2qee h ALA 313 Ca 0.08 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.86 2qee h ALA 313 Cb 0.64 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2qee h ALA 313 CO 0.05 0.36 0.16 0.00 0.00 0.00 0.00 179.25 179.82 2qee h ARG 314 N 0.29 0.00 0.00 0.00 3.08 -0.59 -3.11 114.38 114.05 2qee h ARG 314 Ca 0.06 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.85 2qee h ARG 314 Cb 0.35 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 2qee h ARG 314 CO 0.02 0.00 -1.47 0.87 -1.07 0.00 0.00 179.97 178.32 2qee h LYS 315 N 0.00 0.00 -3.81 0.04 1.79 -1.05 -3.46 116.57 110.08 2qee h LYS 315 Ca 0.10 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 58.05 2qee h LYS 315 Cb 0.42 0.00 -0.39 0.00 -1.58 0.00 0.00 32.23 30.68 2qee h LYS 315 CO -0.00 0.66 -0.77 -0.06 -1.08 0.00 0.00 179.45 178.19 2qee s PHE 316 N -2.64 1.31 -0.65 -1.35 0.08 -1.04 -5.00 117.98 108.68 2qee s PHE 316 Ca -0.03 -0.93 0.23 0.00 0.12 0.00 0.00 56.93 56.32 2qee s PHE 316 Cb 0.09 -1.13 0.90 0.00 -0.57 0.00 0.00 43.02 42.30 2qee s PHE 316 CO 0.82 -0.60 1.70 -1.13 -0.10 0.00 0.00 175.22 175.91 2qee n SER 317 N 4.97 0.54 -0.56 1.36 3.41 -1.26 -2.14 113.62 119.95 2qee n SER 317 Ca -0.10 0.61 0.05 0.00 -0.26 0.00 0.00 58.87 59.17 2qee n SER 317 Cb 0.47 -0.73 0.13 0.00 -0.26 0.00 0.00 64.21 63.83 2qee n SER 317 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2qee n ASN 318 N -2.07 1.61 -4.48 4.04 6.94 -1.26 -4.72 115.26 115.32 2qee n ASN 318 Ca 0.03 -2.00 -0.35 0.00 -0.02 0.00 0.00 54.58 52.24 2qee n ASN 318 Cb 0.27 -0.20 -0.12 0.00 -2.36 0.00 0.00 39.78 37.36 2qee n ASN 318 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2qee s LEU 319 N -1.00 3.42 -0.19 -4.53 2.96 -0.91 -0.88 118.68 117.56 2qee s LEU 319 Ca 0.20 -0.15 -0.01 0.00 -0.22 0.00 0.00 54.13 53.95 2qee s LEU 319 Cb 0.11 -1.88 -0.00 0.00 0.50 0.00 0.00 46.19 44.91 2qee s LEU 319 CO 0.14 0.06 -0.12 -0.32 -1.32 0.00 0.00 176.35 174.79 2qee s MET 320 N 1.06 3.25 0.11 1.98 -2.45 -0.08 -4.95 119.30 118.23 2qee s MET 320 Ca 0.03 -0.71 -0.03 0.00 -1.25 0.00 0.00 55.69 53.73 2qee s MET 320 Cb -0.14 -2.77 -0.05 0.00 1.25 0.00 0.00 34.83 33.11 2qee s MET 320 CO 0.02 -0.11 0.32 0.96 1.05 0.00 0.00 175.02 177.27 2qee s ILE 321 N 1.15 5.24 -0.06 10.11 -4.36 -1.26 -1.50 121.20 130.52 2qee s ILE 321 Ca 0.01 -0.08 -0.05 0.00 -0.26 0.00 0.00 60.65 60.28 2qee s ILE 321 Cb -0.14 -3.62 0.02 0.00 1.25 0.00 0.00 42.46 39.96 2qee s ILE 321 CO -0.04 0.09 0.15 0.72 0.24 0.00 0.00 174.94 176.09 2qee s PHE 322 N -1.60 -0.16 0.15 1.37 -0.12 -0.80 -1.98 117.98 114.84 2qee s PHE 322 Ca 0.39 0.41 0.00 0.00 -0.05 0.00 0.00 56.93 57.68 2qee s PHE 322 Cb -0.12 0.03 0.00 0.00 -0.63 0.00 0.00 43.02 42.30 2qee s PHE 322 CO 0.25 -0.09 0.00 0.41 -0.05 0.00 0.00 175.22 175.74 2qee n GLY 323 N 3.22 -2.25 2.87 1.99 0.00 -0.08 -4.42 105.19 106.53 2qee n GLY 323 Ca -0.15 -1.38 -0.30 0.00 0.00 0.00 0.00 46.02 44.19 2qee n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qee s TRP 325 N 0.79 3.36 0.00 0.00 -0.00 -1.26 -3.55 118.94 118.28 2qee s TRP 325 Ca 0.13 1.15 0.00 0.00 -0.00 0.00 0.00 56.10 57.38 2qee s TRP 325 Cb -0.21 -3.00 0.00 0.00 -0.00 0.00 0.00 33.47 30.26 2qee s TRP 325 CO -0.10 -0.31 0.00 1.87 -0.00 0.00 0.00 176.95 178.41 2qee n TRP 326 N 5.58 0.00 0.30 5.86 -0.00 -1.26 -0.93 117.44 126.99 2qee n TRP 326 Ca 0.04 0.00 0.10 0.00 -0.00 0.00 0.00 57.50 57.64 2qee n TRP 326 Cb 0.48 0.00 0.44 0.00 -0.00 0.00 0.00 31.31 32.23 2qee n TRP 326 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 2qee n PHE 327 N 0.00 0.57 1.03 5.87 3.72 -1.26 -0.90 117.46 126.49 2qee n PHE 327 Ca 0.00 0.25 0.12 0.00 -0.05 0.00 0.00 57.45 57.77 2qee n PHE 327 Cb 0.00 -0.90 0.26 0.00 -0.94 0.00 0.00 39.48 37.90 2qee n PHE 327 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 2qee n MET 328 N -2.05 0.09 -1.93 -1.08 2.81 -0.10 -4.57 117.12 110.29 2qee n MET 328 Ca 0.01 -0.05 -0.37 0.00 -1.81 0.00 0.00 57.70 55.47 2qee n MET 328 Cb 0.14 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.14 2qee n MET 328 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2qee n ASN 329 N -1.41 7.70 -4.05 7.83 5.15 -0.08 -3.50 115.26 126.90 2qee n ASN 329 Ca 0.06 -3.19 -0.19 0.00 -0.60 0.00 0.00 54.58 50.66 2qee n ASN 329 Cb 0.34 -1.32 -0.14 0.00 -0.53 0.00 0.00 39.78 38.12 2qee n ASN 329 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2qee s ASN 330 N 0.26 1.20 0.29 1.20 0.01 -1.26 -4.94 114.94 111.69 2qee s ASN 330 Ca 0.54 -0.23 -0.02 0.00 -0.71 0.00 0.00 52.86 52.44 2qee s ASN 330 Cb 0.23 -0.12 0.63 0.00 0.41 0.00 0.00 41.25 42.40 2qee s ASN 330 CO -0.13 0.09 1.58 -0.65 -1.51 0.00 0.00 177.10 176.49 2qee h PRO 331 N 5.69 0.03 -0.98 -0.60 0.11 -1.97 0.23 132.00 134.51 2qee h PRO 331 Ca -0.32 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.82 2qee h PRO 331 Cb 1.18 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.23 2qee h PRO 331 CO 0.48 0.02 0.64 1.49 -0.21 0.00 0.00 178.00 180.42 2qee h GLU 332 N 0.03 1.20 0.11 1.05 4.57 -1.97 -0.69 114.58 118.87 2qee h GLU 332 Ca 0.54 -0.07 -0.26 0.00 -1.18 0.00 0.00 59.36 58.38 2qee h GLU 332 Cb 1.02 -0.27 -0.00 0.00 -0.16 0.00 0.00 28.75 29.34 2qee h GLU 332 CO -0.89 0.79 -1.31 0.82 -1.18 0.00 0.00 179.01 177.24 2qee h ILE 333 N 1.23 1.10 -0.82 2.32 1.08 -1.06 -2.88 117.51 118.49 2qee h ILE 333 Ca 0.39 -2.41 0.15 0.00 -0.39 0.00 0.00 64.86 62.60 2qee h ILE 333 Cb -0.00 2.77 -0.10 0.00 -3.07 0.00 0.00 36.82 36.42 2qee h ILE 333 CO -0.12 0.69 0.38 0.40 -0.69 0.00 0.00 178.15 178.81 2qee h ILE 334 N -0.35 0.68 0.15 -0.67 2.04 -0.61 0.54 117.51 119.30 2qee h ILE 334 Ca -0.28 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 2qee h ILE 334 Cb 1.72 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2qee h ILE 334 CO 0.06 0.10 -0.07 -1.13 0.00 0.00 0.00 178.15 177.10 2qee h ASN 335 N 0.53 -0.18 -0.74 1.72 -1.24 -1.16 0.06 115.58 114.57 2qee h ASN 335 Ca 0.45 -0.13 -0.05 0.00 0.71 0.00 0.00 56.30 57.28 2qee h ASN 335 Cb 0.68 0.05 -0.03 0.00 0.73 0.00 0.00 38.32 39.75 2qee h ASN 335 CO -0.39 0.02 0.26 1.05 -1.29 0.00 0.00 177.43 177.08 2qee h GLU 336 N -0.37 1.14 -0.47 6.67 4.11 -1.27 -1.20 114.58 123.19 2qee h GLU 336 Ca -0.02 -0.23 -0.03 0.00 0.07 0.00 0.00 59.36 59.15 2qee h GLU 336 Cb 0.29 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2qee h GLU 336 CO 0.03 0.95 0.18 0.52 0.07 0.00 0.00 179.01 180.77 2qee h MET 337 N 1.09 0.71 -0.29 1.06 2.86 -0.83 -1.44 114.93 118.08 2qee h MET 337 Ca 0.24 -0.13 -0.11 0.00 -2.06 0.00 0.00 59.70 57.64 2qee h MET 337 Cb 0.27 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2qee h MET 337 CO -0.01 0.64 -0.28 1.15 1.06 0.00 0.00 176.91 179.47 2qee h THR 338 N 0.62 1.28 -0.16 2.22 2.02 -0.65 -0.51 112.91 117.72 2qee h THR 338 Ca 0.16 -1.36 -0.03 0.00 0.77 0.00 0.00 66.41 65.94 2qee h THR 338 Cb 0.21 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2qee h THR 338 CO -0.01 0.44 -0.02 0.03 0.37 0.00 0.00 175.52 176.33 2qee h ARG 339 N 0.51 0.30 -0.60 6.66 3.08 -1.12 -0.74 114.38 122.48 2qee h ARG 339 Ca 0.07 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 2qee h ARG 339 Cb 0.74 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 2qee h ARG 339 CO 0.06 0.54 0.37 0.52 -1.07 0.00 0.00 179.97 180.39 2qee h MET 340 N 0.03 0.80 -0.37 0.04 2.86 -1.02 -0.33 114.93 116.94 2qee h MET 340 Ca 0.04 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2qee h MET 340 Cb 0.42 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 2qee h MET 340 CO 0.01 0.56 0.16 0.00 1.06 0.00 0.00 176.91 178.70 2qee h ARG 341 N 0.81 0.54 -0.25 1.72 3.08 -1.02 -2.50 114.38 116.76 2qee h ARG 341 Ca 0.22 -0.09 -0.17 0.00 0.07 0.00 0.00 59.98 60.01 2qee h ARG 341 Cb -0.04 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 2qee h ARG 341 CO -0.04 0.51 -0.53 1.98 -1.07 0.00 0.00 179.97 180.82 2qee h MET 342 N 0.45 0.71 -0.78 0.04 4.05 -0.93 0.15 114.93 118.63 2qee h MET 342 Ca 0.12 -0.44 0.05 0.00 -0.28 0.00 0.00 59.70 59.15 2qee h MET 342 Cb 0.16 0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 30.96 2qee h MET 342 CO -0.01 1.06 0.51 0.93 0.23 0.00 0.00 176.91 179.63 2qee h GLU 343 N 0.55 0.88 0.00 0.39 5.08 -0.97 -0.40 114.58 120.11 2qee h GLU 343 Ca 0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2qee h GLU 343 Cb 1.10 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2qee h GLU 343 CO 0.11 0.58 -1.24 -1.33 -1.00 0.00 0.00 179.01 176.13 2qee n MET 344 N -4.47 1.00 0.00 2.33 2.81 -0.95 -4.57 117.12 113.27 2qee n MET 344 Ca 0.11 -0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 2qee n MET 344 Cb 0.16 -1.35 0.00 0.00 -0.71 0.00 0.00 33.22 31.32 2qee n MET 344 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2qee n LEU 345 N -1.71 0.64 0.00 4.03 4.77 0.53 -4.86 117.00 120.39 2qee n LEU 345 Ca 0.00 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 2qee n LEU 345 Cb 0.35 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2qee n LEU 345 CO 0.36 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 2qee n GLY 346 N -0.02 3.63 1.25 -0.72 0.00 -0.16 -1.38 105.19 107.79 2qee n GLY 346 Ca 0.00 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.05 2qee n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qee n THR 347 N 0.00 1.37 -1.10 2.61 -2.24 -1.26 -4.37 114.28 109.29 2qee n THR 347 Ca 0.00 -1.13 -0.17 0.00 -2.27 0.00 0.00 64.05 60.48 2qee n THR 347 Cb 0.00 0.32 -0.07 0.00 -2.10 0.00 0.00 70.33 68.49 2qee n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qee n SER 348 N 1.08 5.95 -3.79 3.42 3.41 -0.48 -4.71 113.62 118.51 2qee n SER 348 Ca 0.22 -2.86 -0.08 0.00 -0.26 0.00 0.00 58.87 55.89 2qee n SER 348 Cb 0.69 -1.25 -0.03 0.00 -0.26 0.00 0.00 64.21 63.37 2qee n SER 348 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2qee s PHE 349 N -0.68 0.11 -0.41 7.33 -0.12 -1.26 -4.81 117.98 118.14 2qee s PHE 349 Ca 0.49 -0.54 -0.06 0.00 -0.05 0.00 0.00 56.93 56.77 2qee s PHE 349 Cb 0.29 0.49 0.10 0.00 -0.63 0.00 0.00 43.02 43.26 2qee s PHE 349 CO -0.09 -1.17 0.23 0.42 -0.05 0.00 0.00 175.22 174.56 2qee s ILE 350 N -3.76 3.72 0.41 -4.49 1.01 -0.84 -4.68 121.20 112.57 2qee s ILE 350 Ca 0.17 -1.76 0.11 0.00 0.00 0.00 0.00 60.65 59.17 2qee s ILE 350 Cb -0.04 -3.41 0.18 0.00 0.01 0.00 0.00 42.46 39.20 2qee s ILE 350 CO 0.09 -0.61 1.96 1.55 0.00 0.00 0.00 174.94 177.93 2qee h PRO 351 N 8.23 0.19 -3.04 2.79 0.13 -1.86 -0.17 132.00 138.27 2qee h PRO 351 Ca -0.18 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 64.83 2qee h PRO 351 Cb 1.06 -0.03 -0.17 0.00 0.13 0.00 0.00 31.00 31.99 2qee h PRO 351 CO 0.73 0.31 -0.13 -1.14 -0.23 0.00 0.00 178.00 177.54 2qee s GLN 352 N -4.78 0.88 0.07 0.86 2.00 -1.26 -3.46 119.66 113.97 2qee s GLN 352 Ca -0.05 -0.35 -0.01 0.00 -2.00 0.00 0.00 55.36 52.95 2qee s GLN 352 Cb 0.16 0.39 -0.04 0.00 0.80 0.00 0.00 33.01 34.32 2qee s GLN 352 CO 0.72 -0.29 -0.01 -3.38 -0.50 0.00 0.00 175.29 171.83 2qee s HIS 353 N -2.32 0.62 -0.05 1.67 -3.43 -1.26 -4.64 115.29 105.87 2qee s HIS 353 Ca -0.06 -1.12 0.12 0.00 -0.80 0.00 0.00 55.06 53.20 2qee s HIS 353 Cb -0.01 -0.41 -0.23 0.00 -1.43 0.00 0.00 32.58 30.49 2qee s HIS 353 CO -0.01 -0.42 0.64 -1.13 -2.00 0.00 0.00 174.74 171.81 2qee n SER 354 N 0.05 0.91 -2.48 7.38 3.41 -1.25 -4.72 113.62 116.93 2qee n SER 354 Ca -0.12 0.40 -0.13 0.00 -0.26 0.00 0.00 58.87 58.76 2qee n SER 354 Cb 0.62 -0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.48 2qee n SER 354 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qee n ASP 355 N -3.06 -3.97 -4.70 4.04 2.03 -0.48 -4.87 116.55 105.54 2qee n ASP 355 Ca -0.18 0.17 -0.43 0.00 0.52 0.00 0.00 54.79 54.87 2qee n ASP 355 Cb 1.05 -3.37 -0.03 0.00 -0.72 0.00 0.00 41.12 38.05 2qee n ASP 355 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qee n ALA 356 N -2.27 2.42 0.00 -1.67 0.00 -1.26 -4.43 120.51 113.30 2qee n ALA 356 Ca -0.14 0.39 0.08 0.00 0.00 0.00 0.00 53.44 53.77 2qee n ALA 356 Cb 0.61 -2.50 -0.14 0.00 0.00 0.00 0.00 19.45 17.42 2qee n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qee n ARG 357 N 4.17 0.65 -4.67 0.00 1.74 -1.26 -0.05 116.66 117.24 2qee n ARG 357 Ca 0.17 -0.10 -0.28 0.00 -0.77 0.00 0.00 57.85 56.87 2qee n ARG 357 Cb 0.34 -1.59 -0.17 0.00 -1.02 0.00 0.00 32.46 30.03 2qee n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2qee s VAL 358 N -3.34 1.47 0.24 1.55 1.01 -1.26 -4.37 120.40 115.70 2qee s VAL 358 Ca -0.07 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 2qee s VAL 358 Cb 0.12 -1.33 0.29 0.00 0.00 0.00 0.00 36.38 35.47 2qee s VAL 358 CO 0.88 0.43 1.61 0.25 0.00 0.00 0.00 175.10 178.27 2qee h LEU 359 N 7.10 -0.58 -2.22 3.92 5.85 -1.13 -0.78 115.31 127.47 2qee h LEU 359 Ca -0.28 0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2qee h LEU 359 Cb 1.19 0.42 -0.00 0.00 0.37 0.00 0.00 40.66 42.65 2qee h LEU 359 CO 0.48 -0.23 -0.00 -0.33 -0.34 0.00 0.00 178.44 178.02 2qee h GLU 360 N 0.03 0.00 -0.01 1.25 3.07 -1.93 -2.52 114.58 114.46 2qee h GLU 360 Ca 0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 2qee h GLU 360 Cb 0.61 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.52 2qee h GLU 360 CO -0.73 0.00 0.02 1.96 -1.40 0.00 0.00 179.01 178.85 2qee h GLN 361 N 0.00 0.00 -0.93 2.33 4.20 -1.55 -0.59 115.11 118.58 2qee h GLN 361 Ca -0.00 0.00 0.17 0.00 0.06 0.00 0.00 58.65 58.88 2qee h GLN 361 Cb 0.26 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.96 2qee h GLN 361 CO 0.00 0.00 0.59 -0.07 -0.67 0.00 0.00 178.83 178.68 2qee h LEU 362 N 0.00 0.62 0.67 1.46 3.38 -1.62 0.98 115.31 120.81 2qee h LEU 362 Ca 0.01 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2qee h LEU 362 Cb 0.04 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.73 2qee h LEU 362 CO -0.00 0.27 -0.32 0.40 0.09 0.00 0.00 178.44 178.88 2qee h ILE 363 N 0.64 0.34 -0.04 1.22 2.04 -1.34 -2.48 117.51 117.88 2qee h ILE 363 Ca 0.49 0.00 -0.22 0.00 1.00 0.00 0.00 64.86 66.13 2qee h ILE 363 Cb 0.89 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 2qee h ILE 363 CO -0.24 0.00 -0.88 0.10 0.00 0.00 0.00 178.15 177.13 2qee h TYR 364 N -0.90 0.73 -0.60 1.37 -0.00 -1.56 -1.50 116.97 114.51 2qee h TYR 364 Ca -0.09 -0.37 -0.01 0.00 0.00 0.00 0.00 58.73 58.25 2qee h TYR 364 Cb 0.69 -0.10 -0.03 0.00 0.00 0.00 0.00 36.73 37.30 2qee h TYR 364 CO -0.03 1.18 0.32 0.87 -0.00 0.00 0.00 178.16 180.50 2qee h LYS 365 N 0.32 0.85 0.01 0.10 1.79 -0.85 0.21 116.57 119.01 2qee h LYS 365 Ca -0.07 -0.11 -0.26 0.00 -2.18 0.00 0.00 60.65 58.03 2qee h LYS 365 Cb 1.50 -0.16 0.02 0.00 -1.58 0.00 0.00 32.23 32.01 2qee h LYS 365 CO 0.16 0.66 -1.05 -1.49 -1.08 0.00 0.00 179.45 176.65 2qee h TRP 366 N 0.82 0.94 -0.09 -1.35 4.06 -1.50 -2.39 115.95 116.44 2qee h TRP 366 Ca 0.21 -0.52 -0.01 0.00 2.06 0.00 0.00 58.89 60.63 2qee h TRP 366 Cb 0.07 -0.10 -0.00 0.00 -1.00 0.00 0.00 29.16 28.12 2qee h TRP 366 CO -0.01 1.36 0.04 1.25 -3.56 0.00 0.00 178.44 177.52 2qee h HIS 367 N 0.34 0.14 -0.56 0.49 2.76 -1.05 0.18 115.15 117.45 2qee h HIS 367 Ca -0.13 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 57.99 2qee h HIS 367 Cb 1.70 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 30.59 2qee h HIS 367 CO 0.09 0.25 0.18 0.45 -1.30 0.00 0.00 177.93 177.60 2qee h HIS 368 N -0.01 0.89 -0.18 5.26 3.86 -1.05 -2.71 115.15 121.21 2qee h HIS 368 Ca 0.03 -0.09 -0.16 0.00 -1.16 0.00 0.00 60.37 59.00 2qee h HIS 368 Cb 0.17 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.38 2qee h HIS 368 CO -0.02 0.75 -0.51 0.77 0.86 0.00 0.00 177.93 179.78 2qee h SER 369 N 0.78 0.76 -0.98 2.45 0.02 -1.34 -3.22 113.55 112.02 2qee h SER 369 Ca 0.18 -0.58 0.09 0.00 -0.84 0.00 0.00 61.79 60.64 2qee h SER 369 Cb 0.27 -0.22 -0.07 0.00 0.14 0.00 0.00 62.40 62.51 2qee h SER 369 CO -0.01 1.21 0.63 0.11 -1.14 0.00 0.00 176.83 177.63 2qee h LYS 370 N 0.35 1.02 -0.53 3.45 1.57 -0.59 -0.18 116.57 121.66 2qee h LYS 370 Ca -0.01 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.62 2qee h LYS 370 Cb 1.12 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.18 2qee h LYS 370 CO 0.11 0.67 -0.01 0.66 -0.57 0.00 0.00 179.45 180.31 2qee h SER 371 N 1.05 0.88 -0.06 0.86 4.64 -1.50 0.13 113.55 119.55 2qee h SER 371 Ca 0.45 -0.23 -0.02 0.00 -0.47 0.00 0.00 61.79 61.52 2qee h SER 371 Cb 0.34 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2qee h SER 371 CO -0.21 0.95 -0.03 0.40 -0.87 0.00 0.00 176.83 177.07 2qee h ILE 372 N 0.84 1.33 -0.94 0.95 2.04 -1.50 -2.04 117.51 118.19 2qee h ILE 372 Ca 0.15 -1.05 0.01 0.00 1.00 0.00 0.00 64.86 64.97 2qee h ILE 372 Cb 0.51 1.92 -0.05 0.00 -0.74 0.00 0.00 36.82 38.47 2qee h ILE 372 CO 0.03 0.29 0.62 0.40 0.00 0.00 0.00 178.15 179.49 2qee h ILE 373 N -0.28 1.24 -0.46 -0.67 2.04 -0.85 -1.19 117.51 117.36 2qee h ILE 373 Ca 0.01 -0.45 0.02 0.00 1.00 0.00 0.00 64.86 65.44 2qee h ILE 373 Cb 0.48 -0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 2qee h ILE 373 CO 0.01 0.24 0.27 0.00 0.00 0.00 0.00 178.15 178.67 2qee h ALA 374 N 1.34 0.58 -0.77 1.87 0.00 -0.67 -0.68 119.26 120.93 2qee h ALA 374 Ca 0.35 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 2qee h ALA 374 Cb -0.14 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 2qee h ALA 374 CO -0.07 -0.04 0.31 1.49 0.00 0.00 0.00 179.25 180.93 2qee h GLU 375 N 0.54 1.14 -0.50 0.00 4.57 -0.71 0.47 114.58 120.10 2qee h GLU 375 Ca 0.18 -0.20 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 2qee h GLU 375 Cb 0.01 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 28.39 2qee h GLU 375 CO -0.08 0.92 0.22 0.28 -1.18 0.00 0.00 179.01 179.17 2qee h VAL 376 N 1.12 1.20 -0.71 0.32 2.07 -0.86 -1.55 116.25 117.84 2qee h VAL 376 Ca 0.26 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 2qee h VAL 376 Cb 0.20 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 2qee h VAL 376 CO -0.02 0.23 0.44 -0.07 0.02 0.00 0.00 177.57 178.17 2qee h LEU 377 N 0.66 0.85 -0.45 2.57 3.38 -0.68 -1.45 115.31 120.19 2qee h LEU 377 Ca 0.17 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2qee h LEU 377 Cb 0.17 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2qee h LEU 377 CO -0.02 0.65 0.26 0.40 0.09 0.00 0.00 178.44 179.83 2qee h ILE 378 N 0.97 1.15 -0.43 1.22 2.04 -0.50 0.14 117.51 122.10 2qee h ILE 378 Ca 0.26 -0.34 0.05 0.00 1.00 0.00 0.00 64.86 65.83 2qee h ILE 378 Cb -0.05 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 36.55 2qee h ILE 378 CO -0.05 0.15 0.15 0.44 0.00 0.00 0.00 178.15 178.84 2qee h ASP 379 N 0.59 0.15 -0.32 1.72 3.32 -0.92 0.12 116.42 121.08 2qee h ASP 379 Ca 0.16 0.05 -0.14 0.00 0.02 0.00 0.00 57.03 57.11 2qee h ASP 379 Cb 0.01 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2qee h ASP 379 CO -0.03 0.12 -0.34 0.11 -1.72 0.00 0.00 179.24 177.38 2qee h LYS 380 N 0.31 0.86 -0.20 3.56 6.56 -0.82 -1.21 116.57 125.63 2qee h LYS 380 Ca 0.20 -0.42 -0.15 0.00 -1.06 0.00 0.00 60.65 59.22 2qee h LYS 380 Cb 0.19 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.84 2qee h LYS 380 CO -0.20 1.06 -0.49 1.88 -2.06 0.00 0.00 179.45 179.64 2qee h TYR 381 N 0.71 0.67 -0.60 -1.35 0.05 -0.67 -3.01 116.97 112.78 2qee h TYR 381 Ca 0.07 -0.22 -0.06 0.00 0.05 0.00 0.00 58.73 58.57 2qee h TYR 381 Cb 0.91 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.49 2qee h TYR 381 CO 0.05 0.93 0.14 0.22 -1.05 0.00 0.00 178.16 178.45 2qee h ASP 382 N 0.43 0.91 -0.88 3.88 3.58 -0.53 0.85 116.42 124.67 2qee h ASP 382 Ca 0.02 -0.24 0.05 0.00 0.42 0.00 0.00 57.03 57.28 2qee h ASP 382 Cb 1.01 -0.24 -0.05 0.00 1.72 0.00 0.00 39.33 41.77 2qee h ASP 382 CO 0.09 0.92 0.57 0.44 -2.88 0.00 0.00 179.24 178.38 2qee h ASP 383 N 0.87 0.91 0.72 2.28 3.32 -1.12 0.30 116.42 123.70 2qee h ASP 383 Ca 0.19 -0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.98 2qee h ASP 383 Cb 0.37 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2qee h ASP 383 CO 0.00 0.60 -1.25 0.16 -1.72 0.00 0.00 179.24 177.04 2qee h ILE 384 N 1.04 1.45 -0.26 0.35 3.07 -1.35 -2.75 117.51 119.06 2qee h ILE 384 Ca 0.36 -3.12 0.04 0.00 1.55 0.00 0.00 64.86 63.69 2qee h ILE 384 Cb 0.11 2.82 -0.03 0.00 -0.27 0.00 0.00 36.82 39.45 2qee h ILE 384 CO -0.12 0.87 0.05 0.25 -1.05 0.00 0.00 178.15 178.16 2qee h LEU 385 N 0.04 0.02 -1.64 0.16 6.46 -0.38 -0.76 115.31 119.21 2qee h LEU 385 Ca -0.12 0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 57.63 2qee h LEU 385 Cb 1.91 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 41.88 2qee h LEU 385 CO 0.16 0.04 -0.20 1.56 -0.62 0.00 0.00 178.44 179.37 2qee h GLN 386 N 0.15 0.00 -0.02 1.25 1.08 -0.44 -0.75 115.11 116.39 2qee h GLN 386 Ca 0.12 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 2qee h GLN 386 Cb 0.12 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 2qee h GLN 386 CO -0.16 0.20 0.00 0.00 -0.95 0.00 0.00 178.83 177.93 2qee n ALA 387 N -2.39 2.64 0.00 3.87 0.00 -0.75 -4.90 120.51 118.98 2qee n ALA 387 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2qee n ALA 387 Cb 0.29 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2qee n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qee n GLY 388 N 0.99 0.55 3.76 0.00 0.00 -0.29 -5.06 105.19 105.14 2qee n GLY 388 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2qee n GLY 388 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2qee s TRP 389 N -2.00 3.37 -0.46 1.61 -0.11 -0.37 -4.99 118.94 115.99 2qee s TRP 389 Ca 0.00 1.55 -0.21 0.00 1.22 0.00 0.00 56.10 58.67 2qee s TRP 389 Cb 0.00 -3.45 0.03 0.00 -1.50 0.00 0.00 33.47 28.55 2qee s TRP 389 CO 0.00 -1.13 0.66 -2.00 -4.62 0.00 0.00 176.95 169.86 2qee s GLU 390 N -1.37 3.25 -0.19 5.86 2.12 -1.26 -4.22 118.70 122.88 2qee s GLU 390 Ca 0.47 -0.47 -0.13 0.00 0.36 0.00 0.00 54.97 55.20 2qee s GLU 390 Cb -0.35 -3.99 -0.05 0.00 0.26 0.00 0.00 34.13 30.01 2qee s GLU 390 CO 0.44 -1.08 0.25 0.14 -0.54 0.00 0.00 175.26 174.47 2qee s VAL 391 N 2.85 5.32 0.24 3.70 -7.23 -1.26 -5.09 120.40 118.93 2qee s VAL 391 Ca 0.21 0.43 0.01 0.00 -1.81 0.00 0.00 61.98 60.82 2qee s VAL 391 Cb -0.15 -3.59 -0.04 0.00 0.56 0.00 0.00 36.38 33.17 2qee s VAL 391 CO 0.18 0.37 0.42 0.42 -0.31 0.00 0.00 175.10 176.17 2qee s THR 392 N 0.68 5.20 0.34 5.32 -4.23 -1.26 -4.56 115.64 117.12 2qee s THR 392 Ca 0.13 -0.56 0.04 0.00 -1.18 0.00 0.00 61.69 60.12 2qee s THR 392 Cb -0.13 -3.80 0.17 0.00 1.34 0.00 0.00 72.50 70.09 2qee s THR 392 CO 0.03 -0.30 1.89 -0.08 -0.54 0.00 0.00 174.62 175.62 2qee h GLU 393 N 1.50 0.56 -0.30 3.99 4.81 -1.99 -1.46 114.58 121.69 2qee h GLU 393 Ca -0.49 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 58.54 2qee h GLU 393 Cb 1.21 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 2qee h GLU 393 CO 0.65 0.55 -0.21 0.93 -0.73 0.00 0.00 179.01 180.19 2qee h GLU 394 N 0.54 0.56 -0.40 1.92 4.39 -1.99 0.43 114.58 120.03 2qee h GLU 394 Ca 0.12 -0.20 -0.07 0.00 0.34 0.00 0.00 59.36 59.55 2qee h GLU 394 Cb 0.28 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2qee h GLU 394 CO 0.00 0.74 -0.01 0.93 -1.16 0.00 0.00 179.01 179.51 2qee h GLU 395 N 0.50 0.72 -0.38 2.33 5.08 -1.86 -1.18 114.58 119.78 2qee h GLU 395 Ca 0.08 -0.23 0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2qee h GLU 395 Cb 0.64 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 2qee h GLU 395 CO 0.05 0.81 0.12 0.82 -1.00 0.00 0.00 179.01 179.80 2qee h ILE 396 N 0.54 0.86 -0.39 3.13 2.04 -0.96 -0.65 117.51 122.09 2qee h ILE 396 Ca 0.11 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.85 2qee h ILE 396 Cb 0.49 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 2qee h ILE 396 CO 0.02 0.05 0.08 0.11 0.00 0.00 0.00 178.15 178.41 2qee h LYS 397 N 0.26 0.57 -0.03 2.37 1.57 -0.68 -0.71 116.57 119.93 2qee h LYS 397 Ca 0.18 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 2qee h LYS 397 Cb 0.17 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 2qee h LYS 397 CO -0.20 0.54 -0.00 -0.09 -0.57 0.00 0.00 179.45 179.13 2qee h ARG 398 N 0.56 0.05 -0.56 3.15 2.43 -0.84 -1.34 114.38 117.84 2qee h ARG 398 Ca 0.13 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 2qee h ARG 398 Cb 0.24 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 2qee h ARG 398 CO -0.00 0.39 0.27 -0.44 -1.51 0.00 0.00 179.97 178.68 2qee h ASP 399 N -0.29 0.73 -0.82 -3.80 3.32 -0.70 -0.07 116.42 114.80 2qee h ASP 399 Ca 0.01 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 2qee h ASP 399 Cb 0.37 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.69 2qee h ASP 399 CO 0.00 0.65 0.51 0.58 -1.72 0.00 0.00 179.24 179.26 2qee h VAL 400 N 0.76 1.23 -0.37 -1.35 2.07 -1.12 -1.47 116.25 115.99 2qee h VAL 400 Ca 0.19 -0.48 -0.10 0.00 0.82 0.00 0.00 66.70 67.14 2qee h VAL 400 Cb 0.11 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 2qee h VAL 400 CO -0.02 0.23 -0.17 0.00 0.02 0.00 0.00 177.57 177.63 2qee h ALA 401 N 1.43 1.00 -0.21 1.67 0.00 -0.70 -1.38 119.26 121.06 2qee h ALA 401 Ca 0.30 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qee h ALA 401 Cb -0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2qee h ALA 401 CO -0.06 0.59 0.12 -0.44 0.00 0.00 0.00 179.25 179.47 2qee h ASP 402 N 0.62 0.26 -0.41 0.00 3.32 -0.47 0.93 116.42 120.67 2qee h ASP 402 Ca 0.10 -0.07 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 2qee h ASP 402 Cb 0.64 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 2qee h ASP 402 CO 0.05 0.26 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.70 2qee h LEU 403 N 0.25 0.76 0.00 1.55 3.38 -1.01 0.28 115.31 120.53 2qee h LEU 403 Ca 0.08 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2qee h LEU 403 Cb 0.05 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2qee h LEU 403 CO -0.01 0.92 -0.79 0.49 0.09 0.00 0.00 178.44 179.14 2qee n PHE 404 N -4.37 0.19 0.10 1.13 3.72 -0.54 -4.21 117.46 113.48 2qee n PHE 404 Ca -0.01 0.05 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2qee n PHE 404 Cb 0.34 -0.36 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 2qee n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2qee n SER 405 N -1.78 -1.17 0.04 4.37 2.88 -0.45 -1.63 113.62 115.89 2qee n SER 405 Ca 0.04 0.37 -0.04 0.00 -1.33 0.00 0.00 58.87 57.90 2qee n SER 405 Cb 0.39 1.26 0.17 0.00 -0.75 0.00 0.00 64.21 65.28 2qee n SER 405 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2qee h ARG 406 N 0.00 0.41 -0.57 -1.46 3.08 -0.85 -2.71 114.38 112.28 2qee h ARG 406 Ca 0.00 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 59.82 2qee h ARG 406 Cb 0.00 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 2qee h ARG 406 CO 0.00 0.74 0.20 -0.91 -1.07 0.00 0.00 179.97 178.93 2qee h ASN 407 N 0.34 0.77 0.29 7.04 2.35 -1.15 -0.18 115.58 125.05 2qee h ASN 407 Ca 0.03 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 2qee h ASN 407 Cb 0.84 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.01 2qee h ASN 407 CO 0.07 0.71 -0.14 0.15 -1.65 0.00 0.00 177.43 176.57 2qee h PHE 408 N 0.82 -0.36 -0.50 1.19 3.57 -1.71 -2.18 116.94 117.77 2qee h PHE 408 Ca 0.19 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 2qee h PHE 408 Cb 0.20 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 2qee h PHE 408 CO 0.01 -0.06 0.10 -1.49 -2.23 0.00 0.00 178.31 174.64 2qee h TRP 409 N -0.67 0.80 -0.54 0.41 4.06 -1.33 -1.26 115.95 117.43 2qee h TRP 409 Ca -0.04 -0.08 0.01 0.00 2.06 0.00 0.00 58.89 60.84 2qee h TRP 409 Cb 0.47 -0.23 -0.03 0.00 -1.00 0.00 0.00 29.16 28.37 2qee h TRP 409 CO 0.01 0.70 0.35 -0.09 -3.56 0.00 0.00 178.44 175.85 2qee h ARG 410 N 0.75 0.70 -0.30 0.49 2.43 -1.04 -0.94 114.38 116.45 2qee h ARG 410 Ca 0.16 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 59.13 2qee h ARG 410 Cb 0.32 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2qee h ARG 410 CO 0.00 0.46 -0.42 0.35 -1.51 0.00 0.00 179.97 178.85 2qee h PHE 411 N 0.72 1.01 0.00 2.20 3.57 -0.63 -2.88 116.94 120.92 2qee h PHE 411 Ca 0.20 -0.33 0.00 0.00 3.53 0.00 0.00 57.97 61.37 2qee h PHE 411 Cb -0.07 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.47 2qee h PHE 411 CO -0.04 1.14 0.00 1.33 -2.23 0.00 0.00 178.31 178.50 2qee n VAL 412 N -4.12 0.52 -2.80 1.41 0.24 -0.57 -4.91 118.33 108.10 2qee n VAL 412 Ca -0.04 -0.15 -0.06 0.00 -2.04 0.00 0.00 64.34 62.05 2qee n VAL 412 Cb 0.56 -0.65 0.02 0.00 -1.47 0.00 0.00 33.84 32.30 2qee n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qee n GLY 413 N 1.15 0.55 0.00 7.63 0.00 -0.44 -4.81 105.19 109.27 2qee n GLY 413 Ca 0.05 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2qee n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qee n ARG 414 N -1.71 0.00 0.00 1.61 1.74 -0.72 -5.06 116.66 112.52 2qee n ARG 414 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2qee n ARG 414 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 2qee n ARG 414 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40