#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qee s SER 2 N 0.00 5.89 -0.39 1.45 1.04 -1.26 -4.97 113.70 115.46 2qee s SER 2 Ca 0.00 2.55 -0.27 0.00 0.48 0.00 0.00 55.95 58.72 2qee s SER 2 Cb 0.00 -2.62 0.02 0.00 0.10 0.00 0.00 66.02 63.52 2qee s SER 2 CO 0.00 -1.13 0.97 -0.63 0.98 0.00 0.00 173.24 173.44 2qee s ILE 3 N -1.39 4.51 -0.07 -1.02 1.01 -1.26 -4.92 121.20 118.06 2qee s ILE 3 Ca 0.65 1.20 0.10 0.00 0.00 0.00 0.00 60.65 62.59 2qee s ILE 3 Cb -0.35 -4.40 0.15 0.00 0.01 0.00 0.00 42.46 37.87 2qee s ILE 3 CO 0.43 -0.64 1.06 -0.46 0.00 0.00 0.00 174.94 175.33 2qee n ASN 4 N 6.99 2.07 -3.59 3.58 6.94 -1.26 -4.84 115.26 125.15 2qee n ASN 4 Ca 0.08 -2.53 -0.15 0.00 -0.02 0.00 0.00 54.58 51.96 2qee n ASN 4 Cb 0.48 -0.23 -0.06 0.00 -2.36 0.00 0.00 39.78 37.61 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 -1.94 -0.45 0.24 0.53 1.04 -1.26 -5.04 113.70 106.82 2qee s SER 5 Ca 0.16 0.29 -0.04 0.00 0.48 0.00 0.00 55.95 56.84 2qee s SER 5 Cb 0.14 0.48 0.43 0.00 0.10 0.00 0.00 66.02 67.17 2qee s SER 5 CO 0.02 -0.65 1.76 -0.09 0.98 0.00 0.00 173.24 175.25 2qee h ARG 6 N 2.99 0.55 -0.26 4.02 2.43 -1.98 -1.55 114.38 120.59 2qee h ARG 6 Ca -0.30 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 58.90 2qee h ARG 6 Cb 1.19 -0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 30.56 2qee h ARG 6 CO 0.41 0.36 -0.14 1.49 -1.51 0.00 0.00 179.97 180.58 2qee h GLU 7 N 0.56 -0.11 -0.32 0.20 4.81 -1.99 0.16 114.58 117.89 2qee h GLU 7 Ca 0.40 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.58 2qee h GLU 7 Cb 0.53 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 2qee h GLU 7 CO -0.34 -0.07 -0.03 0.28 -0.73 0.00 0.00 179.01 178.12 2qee h VAL 8 N -0.11 1.27 -0.25 0.32 2.07 -1.93 -2.93 116.25 114.68 2qee h VAL 8 Ca 0.14 -1.03 0.06 0.00 0.82 0.00 0.00 66.70 66.69 2qee h VAL 8 Cb 0.32 1.30 -0.07 0.00 -1.52 0.00 0.00 31.29 31.33 2qee h VAL 8 CO -0.33 0.33 -0.19 0.25 0.02 0.00 0.00 177.57 177.65 2qee h LEU 9 N 0.37 -0.62 -0.66 2.57 5.85 -1.07 -2.22 115.31 119.53 2qee h LEU 9 Ca 0.09 0.12 0.11 0.00 0.84 0.00 0.00 57.88 59.04 2qee h LEU 9 Cb 0.50 0.31 -0.08 0.00 0.37 0.00 0.00 40.66 41.75 2qee h LEU 9 CO 0.02 -0.23 0.26 0.00 -0.34 0.00 0.00 178.44 178.15 2qee h ALA 10 N 0.94 0.88 -0.47 1.25 0.00 -0.57 0.78 119.26 122.07 2qee h ALA 10 Ca 0.14 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2qee h ALA 10 Cb 0.40 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2qee h ALA 10 CO -0.36 -0.18 0.22 1.49 0.00 0.00 0.00 179.25 180.42 2qee h GLU 11 N 0.44 0.69 -0.30 0.00 4.57 -1.33 -0.37 114.58 118.28 2qee h GLU 11 Ca 0.34 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.40 2qee h GLU 11 Cb 0.44 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 2qee h GLU 11 CO -0.33 0.59 0.12 0.87 -1.18 0.00 0.00 179.01 179.08 2qee h LYS 12 N 0.62 0.45 -0.23 1.92 1.79 -0.70 -1.25 116.57 119.17 2qee h LYS 12 Ca 0.16 -0.08 -0.04 0.00 -2.18 0.00 0.00 60.65 58.51 2qee h LYS 12 Cb 0.14 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 2qee h LYS 12 CO -0.02 0.46 -0.01 0.28 -1.08 0.00 0.00 179.45 179.08 2qee h VAL 13 N 0.33 1.26 -0.86 0.50 2.07 -0.80 -1.37 116.25 117.38 2qee h VAL 13 Ca 0.10 -0.92 0.02 0.00 0.82 0.00 0.00 66.70 66.71 2qee h VAL 13 Cb 0.19 1.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.33 2qee h VAL 13 CO -0.01 0.29 0.56 0.11 0.02 0.00 0.00 177.57 178.54 2qee h LYS 14 N 0.17 1.10 -0.22 1.57 1.57 -1.02 -1.03 116.57 118.71 2qee h LYS 14 Ca 0.06 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2qee h LYS 14 Cb 0.43 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2qee h LYS 14 CO 0.01 0.73 0.13 -0.91 -0.57 0.00 0.00 179.45 178.85 2qee h ASN 15 N 1.14 0.27 -0.26 0.86 -0.26 -1.17 0.15 115.58 116.31 2qee h ASN 15 Ca 0.32 -0.06 0.04 0.00 -0.56 0.00 0.00 56.30 56.04 2qee h ASN 15 Cb -0.09 -0.07 -0.03 0.00 -1.06 0.00 0.00 38.32 37.06 2qee h ASN 15 CO -0.08 0.25 0.04 0.00 -1.06 0.00 0.00 177.43 176.58 2qee h ALA 16 N 1.03 0.26 -0.00 -0.83 0.00 -0.91 -0.23 119.26 118.58 2qee h ALA 16 Ca 0.08 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2qee h ALA 16 Cb 0.03 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2qee h ALA 16 CO -0.01 -0.38 0.00 0.28 0.00 0.00 0.00 179.25 179.14 2qee h VAL 17 N 0.13 1.11 -0.70 0.00 2.07 -1.11 -1.47 116.25 116.29 2qee h VAL 17 Ca 0.12 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.32 2qee h VAL 17 Cb 0.13 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 2qee h VAL 17 CO -0.16 0.09 0.46 0.78 0.02 0.00 0.00 177.57 178.76 2qee h ASN 18 N -0.14 0.78 1.09 0.57 2.35 -0.88 -3.13 115.58 116.23 2qee h ASN 18 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 2qee h ASN 18 Cb 0.14 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2qee h ASN 18 CO -0.00 0.56 -0.36 0.59 -1.65 0.00 0.00 177.43 176.57 2qee n ASN 19 N -4.44 0.72 -4.67 5.81 3.02 -0.10 -4.84 115.26 110.75 2qee n ASN 19 Ca 0.08 0.29 -0.43 0.00 -0.03 0.00 0.00 54.58 54.49 2qee n ASN 19 Cb 0.06 -0.23 -0.02 0.00 -0.61 0.00 0.00 39.78 38.98 2qee n ASN 19 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2qee s GLN 20 N -3.13 4.28 0.26 3.52 2.00 -0.59 -4.99 119.66 121.02 2qee s GLN 20 Ca 0.08 1.61 -0.30 0.00 -2.00 0.00 0.00 55.36 54.75 2qee s GLN 20 Cb 0.13 -3.68 -0.10 0.00 0.80 0.00 0.00 33.01 30.16 2qee s GLN 20 CO 0.67 -0.61 1.47 -2.14 -0.50 0.00 0.00 175.29 174.18 2qee s PRO 21 N 3.04 4.23 -0.11 1.67 0.02 -1.26 -4.92 135.00 137.66 2qee s PRO 21 Ca 0.53 2.37 -0.09 0.00 0.02 0.00 0.00 61.00 63.84 2qee s PRO 21 Cb -0.21 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.18 2qee s PRO 21 CO 0.15 -0.47 0.19 0.08 -0.33 0.00 0.00 177.00 176.63 2qee s VAL 22 N -0.07 5.41 -0.26 3.83 1.01 0.89 -4.68 120.40 126.54 2qee s VAL 22 Ca 0.60 0.32 -0.13 0.00 0.00 0.00 0.00 61.98 62.77 2qee s VAL 22 Cb -0.43 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 2qee s VAL 22 CO 0.45 0.58 0.27 -0.89 0.00 0.00 0.00 175.10 175.52 2qee s THR 23 N -0.79 5.26 -0.58 3.92 2.01 -0.60 -0.49 115.64 124.36 2qee s THR 23 Ca 0.16 0.37 -0.16 0.00 0.31 0.00 0.00 61.69 62.37 2qee s THR 23 Cb -0.13 -3.61 0.14 0.00 0.01 0.00 0.00 72.50 68.91 2qee s THR 23 CO 0.05 0.23 0.55 -0.62 -0.69 0.00 0.00 174.62 174.14 2qee s ASP 24 N 1.53 6.26 0.00 3.53 -1.08 0.19 -4.72 116.67 122.38 2qee s ASP 24 Ca 0.11 -1.86 0.18 0.00 -0.52 0.00 0.00 52.55 50.46 2qee s ASP 24 Cb -0.15 -2.22 0.92 0.00 -1.46 0.00 0.00 42.92 40.00 2qee s ASP 24 CO 0.09 -0.85 1.61 1.15 0.52 0.00 0.00 175.17 177.69 2qee n MET 25 N 5.21 1.26 -3.26 4.34 0.00 -1.26 -0.77 117.12 122.64 2qee n MET 25 Ca -0.10 -0.39 -0.03 0.00 0.00 0.00 0.00 57.70 57.18 2qee n MET 25 Cb 0.41 -1.31 -0.05 0.00 0.00 0.00 0.00 33.22 32.27 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 -1.92 -1.19 0.29 3.17 5.65 -1.26 -4.68 115.29 115.35 2qee s HIS 26 Ca 0.28 1.26 0.03 0.00 0.25 0.00 0.00 55.06 56.87 2qee s HIS 26 Cb 0.14 0.28 -0.04 0.00 -1.18 0.00 0.00 32.58 31.78 2qee s HIS 26 CO 0.22 -0.79 0.18 0.95 -0.65 0.00 0.00 174.74 174.64 2qee s THR 27 N 2.69 0.19 -0.32 0.89 -4.23 -0.07 -0.87 115.64 113.92 2qee s THR 27 Ca 0.16 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.74 2qee s THR 27 Cb -0.15 -2.51 0.46 0.00 1.34 0.00 0.00 72.50 71.64 2qee s THR 27 CO -0.18 0.00 1.37 1.41 -0.54 0.00 0.00 174.62 176.67 2qee n HIS 28 N -0.52 1.89 -3.96 3.99 8.25 0.77 -2.40 115.22 123.23 2qee n HIS 28 Ca 0.03 -2.03 -0.22 0.00 -0.26 0.00 0.00 57.72 55.23 2qee n HIS 28 Cb 0.65 -0.50 -0.02 0.00 1.12 0.00 0.00 29.99 31.24 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 -3.48 4.32 0.07 2.41 1.43 -1.20 -4.60 118.68 117.64 2qee s LEU 29 Ca 0.49 0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.72 2qee s LEU 29 Cb 0.41 -2.87 -0.03 0.00 0.03 0.00 0.00 46.19 43.73 2qee s LEU 29 CO 0.00 -0.05 -0.11 -0.36 0.23 0.00 0.00 176.35 176.07 2qee s PHE 30 N -1.94 1.00 0.19 0.29 0.08 -1.26 -4.40 117.98 111.95 2qee s PHE 30 Ca 0.34 -0.56 -0.32 0.00 0.12 0.00 0.00 56.93 56.51 2qee s PHE 30 Cb -0.09 -0.56 -0.15 0.00 -0.57 0.00 0.00 43.02 41.64 2qee s PHE 30 CO 0.29 -0.01 1.23 0.45 -0.10 0.00 0.00 175.22 177.09 2qee n SER 31 N 1.02 1.74 0.27 1.36 2.88 -1.26 -4.75 113.62 114.88 2qee n SER 31 Ca -0.19 1.14 0.12 0.00 -1.33 0.00 0.00 58.87 58.61 2qee n SER 31 Cb 0.56 -1.27 0.77 0.00 -0.75 0.00 0.00 64.21 63.51 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 3.63 0.00 0.00 -1.46 0.13 -1.93 0.52 132.00 132.88 2qee h PRO 32 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2qee h PRO 32 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2qee h PRO 32 CO 0.72 0.06 0.00 0.27 -0.23 0.00 0.00 178.00 178.82 2qee n ASN 33 N -3.96 0.33 0.00 1.44 6.94 -1.26 -0.89 115.26 117.86 2qee n ASN 33 Ca -0.03 0.61 0.12 0.00 -0.02 0.00 0.00 54.58 55.26 2qee n ASN 33 Cb 0.15 -0.67 0.54 0.00 -2.36 0.00 0.00 39.78 37.43 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 -1.90 0.00 -1.86 -2.53 3.01 0.17 -5.00 117.46 109.36 2qee n PHE 34 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 2qee n PHE 34 Cb 0.12 -0.46 0.00 0.00 -0.01 0.00 0.00 39.48 39.13 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 0.96 0.41 0.18 1.37 0.00 -0.07 -4.44 105.19 103.61 2qee n GLY 35 Ca 0.07 -1.37 0.14 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.94 -2.55 114.58 116.09 2qee h GLU 36 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 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 0.00 -0.04 -0.84 -1.16 0.00 0.00 179.01 176.97 2qee h ILE 37 N 0.00 0.28 -3.03 3.13 3.07 -1.96 -3.37 117.51 115.63 2qee h ILE 37 Ca 0.00 -0.24 -0.56 0.00 1.55 0.00 0.00 64.86 65.61 2qee h ILE 37 Cb 0.32 1.18 -0.05 0.00 -0.27 0.00 0.00 36.82 38.00 2qee h ILE 37 CO 0.00 0.04 1.12 -0.22 -1.05 0.00 0.00 178.15 178.03 2qee s LEU 38 N -6.81 3.51 0.03 0.16 2.96 -0.96 -4.77 118.68 112.80 2qee s LEU 38 Ca -0.03 0.72 -0.21 0.00 -0.22 0.00 0.00 54.13 54.39 2qee s LEU 38 Cb 0.13 -3.37 -0.06 0.00 0.50 0.00 0.00 46.19 43.39 2qee s LEU 38 CO 0.51 -1.59 0.61 -0.76 -1.32 0.00 0.00 176.35 173.80 2qee s LEU 39 N 5.95 4.46 0.00 -0.68 1.43 -1.26 -5.01 118.68 123.58 2qee s LEU 39 Ca 0.62 1.23 -0.29 0.00 -1.03 0.00 0.00 54.13 54.66 2qee s LEU 39 Cb -0.14 -2.95 0.07 0.00 0.03 0.00 0.00 46.19 43.20 2qee s LEU 39 CO 0.30 0.15 0.66 -1.66 0.23 0.00 0.00 176.35 176.03 2qee s TRP 40 N -0.50 -0.63 0.00 0.29 1.48 -1.26 -0.53 118.94 117.79 2qee s TRP 40 Ca 0.31 0.93 0.00 0.00 -1.06 0.00 0.00 56.10 56.28 2qee s TRP 40 Cb -0.19 0.44 0.00 0.00 -1.16 0.00 0.00 33.47 32.56 2qee s TRP 40 CO 0.19 -0.67 0.00 -0.40 -4.06 0.00 0.00 176.95 172.01 2qee n ASP 41 N 0.60 0.00 -0.15 -2.66 5.68 -1.26 -4.61 116.55 114.15 2qee n ASP 41 Ca -0.19 0.00 -0.04 0.00 -0.50 0.00 0.00 54.79 54.06 2qee n ASP 41 Cb 0.59 0.00 0.15 0.00 -1.14 0.00 0.00 41.12 40.72 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 1.24 -0.62 2.12 6.09 -1.95 0.42 117.51 124.80 2qee h ILE 42 Ca 0.00 -0.89 -0.07 0.00 -1.37 0.00 0.00 64.86 62.54 2qee h ILE 42 Cb 0.00 0.68 -0.03 0.00 0.47 0.00 0.00 36.82 37.94 2qee h ILE 42 CO 0.00 0.33 0.12 0.44 -3.07 0.00 0.00 178.15 175.97 2qee h ASP 43 N 0.85 0.94 -0.42 2.19 3.32 -1.95 -0.69 116.42 120.65 2qee h ASP 43 Ca 0.18 -0.20 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 2qee h ASP 43 Cb 0.34 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2qee h ASP 43 CO 0.00 0.92 -0.09 -0.33 -1.72 0.00 0.00 179.24 178.02 2qee h GLU 44 N 0.94 0.81 -0.31 3.56 4.39 -1.66 -1.78 114.58 120.53 2qee h GLU 44 Ca 0.19 -0.31 0.04 0.00 0.34 0.00 0.00 59.36 59.63 2qee h GLU 44 Cb 0.38 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.94 2qee h GLU 44 CO 0.01 0.93 0.08 -0.07 -1.16 0.00 0.00 179.01 178.80 2qee h LEU 45 N 0.64 0.06 -1.16 1.33 3.38 -0.71 -1.62 115.31 117.23 2qee h LEU 45 Ca 0.11 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 2qee h LEU 45 Cb 0.62 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2qee h LEU 45 CO 0.04 0.07 -0.29 -0.07 0.09 0.00 0.00 178.44 178.28 2qee h LEU 46 N 0.21 0.00 -2.30 1.67 3.38 -1.06 -3.02 115.31 114.18 2qee h LEU 46 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2qee h LEU 46 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2qee h LEU 46 CO -0.17 0.29 0.00 0.35 0.09 0.00 0.00 178.44 179.00 2qee n THR 47 N -3.55 0.50 -1.33 0.22 -2.24 -0.67 -4.68 114.28 102.53 2qee n THR 47 Ca -0.00 -0.75 -0.47 0.00 -2.27 0.00 0.00 64.05 60.55 2qee n THR 47 Cb 0.44 0.97 -0.04 0.00 -2.10 0.00 0.00 70.33 69.59 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 1.30 -0.21 0.29 4.78 9.36 -0.64 -4.68 117.16 127.37 2qee n TYR 48 Ca 0.17 0.93 0.15 0.00 3.32 0.00 0.00 57.90 62.47 2qee n TYR 48 Cb 0.56 -1.86 0.89 0.00 -0.63 0.00 0.00 39.34 38.29 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 1.37 0.00 -0.31 2.98 2.07 -1.91 0.49 115.15 119.84 2qee h HIS 49 Ca -0.31 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.18 2qee h HIS 49 Cb 1.35 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.31 2qee h HIS 49 CO 0.43 0.03 0.07 1.88 -3.07 0.00 0.00 177.93 177.27 2qee h TYR 50 N 0.00 0.45 0.00 6.12 -1.99 -1.94 -2.07 116.97 117.53 2qee h TYR 50 Ca -0.00 -0.02 -0.23 0.00 2.00 0.00 0.00 58.73 60.48 2qee h TYR 50 Cb 0.08 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 38.64 2qee h TYR 50 CO 0.00 0.40 -1.21 -0.07 -0.00 0.00 0.00 178.16 177.28 2qee h LEU 51 N 0.44 0.00 -0.20 3.88 3.38 -1.21 -2.90 115.31 118.70 2qee h LEU 51 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2qee h LEU 51 Cb 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2qee h LEU 51 CO -0.00 0.95 0.12 0.58 0.09 0.00 0.00 178.44 180.18 2qee h VAL 52 N 0.00 1.07 -0.30 1.22 2.07 -0.96 0.22 116.25 119.57 2qee h VAL 52 Ca -0.10 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 67.32 2qee h VAL 52 Cb 1.82 0.82 -0.07 0.00 -1.52 0.00 0.00 31.29 32.34 2qee h VAL 52 CO 0.11 0.07 -0.16 0.00 0.02 0.00 0.00 177.57 177.60 2qee h ALA 53 N 1.05 0.06 -0.33 1.67 0.00 -1.40 -1.98 119.26 118.32 2qee h ALA 53 Ca 0.07 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2qee h ALA 53 Cb 0.00 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2qee h ALA 53 CO -0.01 -0.56 0.16 0.93 0.00 0.00 0.00 179.25 179.77 2qee h GLU 54 N -0.12 0.47 -0.39 0.00 5.08 -1.28 -2.64 114.58 115.70 2qee h GLU 54 Ca 0.16 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2qee h GLU 54 Cb 0.36 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2qee h GLU 54 CO -0.38 0.43 0.15 -0.24 -1.00 0.00 0.00 179.01 177.97 2qee h VAL 55 N 0.40 1.15 0.00 3.13 3.04 -0.80 -2.43 116.25 120.75 2qee h VAL 55 Ca 0.11 -0.49 -0.01 0.00 -1.01 0.00 0.00 66.70 65.31 2qee h VAL 55 Cb 0.10 0.70 -0.00 0.00 -2.01 0.00 0.00 31.29 30.08 2qee h VAL 55 CO -0.02 0.19 -0.05 0.24 -1.01 0.00 0.00 177.57 176.92 2qee h MET 56 N 0.55 0.00 0.00 4.17 2.86 -0.99 -0.45 114.93 121.07 2qee h MET 56 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 2qee h MET 56 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 2qee h MET 56 CO -0.01 0.05 0.00 0.00 1.06 0.00 0.00 176.91 178.00 2qee h ARG 57 N 0.00 0.00 0.00 1.72 3.08 -1.32 -3.37 114.38 114.50 2qee h ARG 57 Ca -0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 2qee h ARG 57 Cb 0.52 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 2qee h ARG 57 CO 0.01 0.00 -1.48 0.91 -1.07 0.00 0.00 179.97 178.34 2qee n TRP 58 N -2.75 0.00 -2.36 3.04 7.02 -0.45 -5.08 117.44 116.85 2qee n TRP 58 Ca 0.01 0.00 -0.35 0.00 -1.02 0.00 0.00 57.50 56.14 2qee n TRP 58 Cb 0.28 -0.32 -0.01 0.00 -2.42 0.00 0.00 31.31 28.84 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 -2.16 3.38 -0.69 -0.99 -1.32 -0.30 -4.94 115.64 108.61 2qee s THR 59 Ca -0.11 0.87 0.26 0.00 -1.21 0.00 0.00 61.69 61.50 2qee s THR 59 Cb 0.03 -3.36 0.28 0.00 -1.51 0.00 0.00 72.50 67.95 2qee s THR 59 CO 0.18 -0.17 1.77 0.47 -2.21 0.00 0.00 174.62 174.65 2qee n ASP 60 N -1.12 0.80 -4.71 8.08 8.00 -1.26 -4.88 116.55 121.45 2qee n ASP 60 Ca 0.10 0.59 -0.42 0.00 0.71 0.00 0.00 54.79 55.77 2qee n ASP 60 Cb 0.51 -0.80 -0.03 0.00 -0.02 0.00 0.00 41.12 40.78 2qee n ASP 60 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qee s VAL 61 N -3.13 3.66 0.74 2.53 1.01 -1.26 -4.99 120.40 118.95 2qee s VAL 61 Ca 0.10 1.16 -0.14 0.00 0.00 0.00 0.00 61.98 63.10 2qee s VAL 61 Cb 0.12 -3.75 0.04 0.00 0.00 0.00 0.00 36.38 32.80 2qee s VAL 61 CO 0.57 0.07 1.16 -0.94 0.00 0.00 0.00 175.10 175.96 2qee s SER 62 N 1.25 4.30 0.28 3.32 1.04 -1.26 -4.81 113.70 117.82 2qee s SER 62 Ca 0.62 2.18 -0.03 0.00 0.48 0.00 0.00 55.95 59.20 2qee s SER 62 Cb -0.33 -2.57 0.38 0.00 0.10 0.00 0.00 66.02 63.61 2qee s SER 62 CO 0.29 -2.18 1.90 -0.29 0.98 0.00 0.00 173.24 173.94 2qee h ILE 63 N -0.50 1.22 0.15 -1.02 6.09 -1.98 -0.56 117.51 120.92 2qee h ILE 63 Ca -0.46 -0.56 0.00 0.00 -1.37 0.00 0.00 64.86 62.47 2qee h ILE 63 Cb 1.27 0.20 -0.01 0.00 0.47 0.00 0.00 36.82 38.75 2qee h ILE 63 CO 0.50 0.25 -0.14 -0.33 -3.07 0.00 0.00 178.15 175.36 2qee h GLU 64 N 1.06 -0.30 -0.75 2.19 3.07 -1.94 -1.81 114.58 116.09 2qee h GLU 64 Ca 0.27 0.02 0.09 0.00 -0.50 0.00 0.00 59.36 59.24 2qee h GLU 64 Cb 0.02 0.07 -0.07 0.00 -0.84 0.00 0.00 28.75 27.93 2qee h GLU 64 CO -0.04 -0.20 0.41 0.00 -1.40 0.00 0.00 179.01 177.77 2qee h ALA 65 N 0.50 1.05 -0.23 3.43 0.00 -1.85 -1.62 119.26 120.55 2qee h ALA 65 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2qee h ALA 65 Cb 0.30 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2qee h ALA 65 CO -0.03 0.02 0.12 0.35 0.00 0.00 0.00 179.25 179.71 2qee h PHE 66 N 0.69 0.22 0.00 0.00 3.57 -0.87 -2.14 116.94 118.41 2qee h PHE 66 Ca 0.36 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.83 2qee h PHE 66 Cb 0.35 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2qee h PHE 66 CO -0.08 0.13 -0.22 -1.49 -2.23 0.00 0.00 178.31 174.41 2qee h TRP 67 N 0.25 0.00 0.00 0.41 -0.00 -1.00 -2.50 115.95 113.12 2qee h TRP 67 Ca 0.09 0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 58.96 2qee h TRP 67 Cb 0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.17 2qee h TRP 67 CO -0.09 0.22 -0.11 0.00 -0.00 0.00 0.00 178.44 178.46 2qee h ALA 68 N 1.78 0.97 -2.47 1.49 0.00 -0.98 -3.45 119.26 116.60 2qee h ALA 68 Ca -0.00 -0.10 -0.51 0.00 0.00 0.00 0.00 54.91 54.30 2qee h ALA 68 Cb 0.63 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 18.50 2qee h ALA 68 CO 0.03 0.14 0.38 -1.64 0.00 0.00 0.00 179.25 178.16 2qee s MET 69 N -3.46 2.87 0.91 0.00 -1.94 -0.83 -5.04 119.30 111.81 2qee s MET 69 Ca 0.03 1.41 -0.12 0.00 -1.71 0.00 0.00 55.69 55.30 2qee s MET 69 Cb 0.08 -1.96 0.14 0.00 2.01 0.00 0.00 34.83 35.10 2qee s MET 69 CO 0.63 -1.20 1.10 -1.54 -0.01 0.00 0.00 175.02 174.00 2qee s SER 70 N -2.49 3.45 0.23 3.03 1.04 -1.26 -4.80 113.70 112.90 2qee s SER 70 Ca 0.68 1.24 -0.07 0.00 0.48 0.00 0.00 55.95 58.28 2qee s SER 70 Cb -0.21 -1.91 0.25 0.00 0.10 0.00 0.00 66.02 64.25 2qee s SER 70 CO 0.40 -2.62 1.89 0.50 0.98 0.00 0.00 173.24 174.39 2qee h LYS 71 N -1.54 1.11 -0.63 4.02 3.64 -1.96 -0.14 116.57 121.07 2qee h LYS 71 Ca -0.51 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 58.74 2qee h LYS 71 Cb 1.30 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 32.85 2qee h LYS 71 CO 0.58 0.73 0.13 -0.09 -2.27 0.00 0.00 179.45 178.54 2qee h ARG 72 N 1.14 1.01 -0.59 1.90 2.43 -1.93 -0.16 114.38 118.18 2qee h ARG 72 Ca 0.34 -0.24 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 2qee h ARG 72 Cb -0.05 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 2qee h ARG 72 CO -0.10 0.91 0.03 0.93 -1.51 0.00 0.00 179.97 180.23 2qee h GLU 73 N 0.96 0.99 0.08 0.20 5.08 -1.78 -0.80 114.58 119.31 2qee h GLU 73 Ca 0.20 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2qee h GLU 73 Cb 0.37 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2qee h GLU 73 CO 0.00 0.96 -0.04 1.96 -1.00 0.00 0.00 179.01 180.89 2qee h GLN 74 N 0.92 -0.11 -0.53 2.33 4.20 -0.65 -1.48 115.11 119.79 2qee h GLN 74 Ca 0.17 0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.97 2qee h GLN 74 Cb 0.49 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.23 2qee h GLN 74 CO 0.02 0.05 0.16 0.00 -0.67 0.00 0.00 178.83 178.39 2qee h ALA 75 N 0.66 0.64 -0.43 3.87 0.00 -0.97 -0.33 119.26 122.71 2qee h ALA 75 Ca -0.01 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2qee h ALA 75 Cb 0.21 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2qee h ALA 75 CO 0.02 -0.25 0.19 -0.44 0.00 0.00 0.00 179.25 178.77 2qee h ASP 76 N 0.31 0.26 -0.40 0.00 3.32 -0.95 -0.16 116.42 118.81 2qee h ASP 76 Ca 0.26 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 2qee h ASP 76 Cb 0.33 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 2qee h ASP 76 CO -0.30 0.19 0.24 0.25 -1.72 0.00 0.00 179.24 177.90 2qee h LEU 77 N 0.39 0.48 -0.37 1.55 5.85 -0.71 -1.61 115.31 120.89 2qee h LEU 77 Ca 0.19 -0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 2qee h LEU 77 Cb 0.13 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2qee h LEU 77 CO -0.16 0.39 0.10 0.40 -0.34 0.00 0.00 178.44 178.84 2qee h ILE 78 N 0.52 1.22 -0.04 4.05 2.04 -0.76 0.48 117.51 125.01 2qee h ILE 78 Ca 0.14 -0.74 0.02 0.00 1.00 0.00 0.00 64.86 65.28 2qee h ILE 78 Cb 0.00 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2qee h ILE 78 CO -0.03 0.25 -0.07 -0.25 0.00 0.00 0.00 178.15 178.06 2qee h TRP 79 N 0.45 -0.17 -0.42 1.37 2.91 -0.90 0.14 115.95 119.32 2qee h TRP 79 Ca 0.12 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.14 2qee h TRP 79 Cb 0.28 0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 29.00 2qee h TRP 79 CO 0.01 -0.11 0.22 1.49 -1.03 0.00 0.00 178.44 179.03 2qee h GLU 80 N -0.10 0.60 -0.00 2.65 4.57 -1.04 -0.96 114.58 120.29 2qee h GLU 80 Ca 0.04 -0.08 -0.23 0.00 -1.18 0.00 0.00 59.36 57.91 2qee h GLU 80 Cb 0.16 -0.11 0.01 0.00 -0.16 0.00 0.00 28.75 28.64 2qee h GLU 80 CO -0.10 0.49 -0.96 0.93 -1.18 0.00 0.00 179.01 178.19 2qee h GLU 81 N 0.55 0.48 0.00 1.92 4.39 -0.68 -0.54 114.58 120.70 2qee h GLU 81 Ca 0.15 -0.51 0.00 0.00 0.34 0.00 0.00 59.36 59.34 2qee h GLU 81 Cb 0.08 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2qee h GLU 81 CO -0.02 1.15 -1.35 1.28 -1.16 0.00 0.00 179.01 178.91 2qee n LEU 82 N -3.77 0.42 -0.02 1.33 4.77 0.46 -3.92 117.00 116.27 2qee n LEU 82 Ca -0.08 -0.25 -0.02 0.00 -0.03 0.00 0.00 56.01 55.63 2qee n LEU 82 Cb 0.84 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.91 2qee n LEU 82 CO 0.52 0.11 -0.62 0.49 -1.33 0.00 0.00 177.39 176.55 2qee n PHE 83 N -1.79 0.00 -0.10 -1.77 3.72 -0.42 -3.25 117.46 113.86 2qee n PHE 83 Ca -0.00 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.17 2qee n PHE 83 Cb 0.38 -0.16 -0.12 0.00 -0.94 0.00 0.00 39.48 38.65 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 -2.46 1.58 0.17 4.37 2.08 -0.90 -4.40 119.36 119.80 2qee n ILE 84 Ca -0.07 -0.38 0.07 0.00 0.56 0.00 0.00 62.75 62.94 2qee n ILE 84 Cb 0.59 -1.80 0.08 0.00 -0.75 0.00 0.00 39.64 37.76 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 -0.57 0.00 -4.40 0.38 1.57 -1.28 -3.45 116.57 108.82 2qee h LYS 85 Ca -0.52 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.03 2qee h LYS 85 Cb 1.68 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.79 2qee h LYS 85 CO -0.19 0.22 -0.71 1.03 -0.57 0.00 0.00 179.45 179.23 2qee s ARG 86 N -3.10 0.53 0.29 3.15 3.00 -1.25 -5.06 118.95 116.50 2qee s ARG 86 Ca 0.05 -0.86 -0.29 0.00 0.00 0.00 0.00 55.73 54.63 2qee s ARG 86 Cb 0.07 -0.13 -0.10 0.00 0.00 0.00 0.00 34.95 34.79 2qee s ARG 86 CO 0.72 -0.00 1.15 -1.12 0.00 0.00 0.00 175.30 176.04 2qee s SER 87 N -1.91 7.15 -1.25 0.23 0.01 -1.26 -3.48 113.70 113.20 2qee s SER 87 Ca -0.06 2.36 -0.08 0.00 1.31 0.00 0.00 55.95 59.48 2qee s SER 87 Cb -0.06 -2.63 -0.09 0.00 0.21 0.00 0.00 66.02 63.45 2qee s SER 87 CO -0.02 -0.23 2.69 -0.81 0.41 0.00 0.00 173.24 175.28 2qee n PRO 88 N 1.12 2.98 0.06 12.44 -0.04 -1.20 -4.63 135.00 145.73 2qee n PRO 88 Ca -0.01 -1.83 0.13 0.00 -0.04 0.00 0.00 63.50 61.75 2qee n PRO 88 Cb 0.44 -2.61 0.33 0.00 -0.04 0.00 0.00 33.50 31.62 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 3.71 0.37 -1.28 0.52 0.24 -1.26 -2.99 118.33 117.63 2qee n VAL 89 Ca 0.64 -0.21 -0.31 0.00 -2.04 0.00 0.00 64.34 62.42 2qee n VAL 89 Cb 0.24 -0.32 0.10 0.00 -1.47 0.00 0.00 33.84 32.39 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 -4.06 4.31 0.21 -1.34 1.04 -1.26 -4.70 113.70 107.91 2qee s SER 90 Ca 0.09 1.71 -0.10 0.00 0.48 0.00 0.00 55.95 58.13 2qee s SER 90 Cb 0.14 -2.41 0.17 0.00 0.10 0.00 0.00 66.02 64.01 2qee s SER 90 CO 0.65 -2.14 1.87 -0.08 0.98 0.00 0.00 173.24 174.52 2qee h GLU 91 N -1.20 0.96 -0.36 4.02 4.57 -1.96 0.13 114.58 120.73 2qee h GLU 91 Ca -0.45 -0.06 -0.15 0.00 -1.18 0.00 0.00 59.36 57.52 2qee h GLU 91 Cb 1.24 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 29.61 2qee h GLU 91 CO 0.53 0.63 -0.39 0.00 -1.18 0.00 0.00 179.01 178.60 2qee h ALA 92 N 1.28 0.64 -0.02 2.92 0.00 -1.95 -0.17 119.26 121.96 2qee h ALA 92 Ca 0.28 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2qee h ALA 92 Cb -0.08 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2qee h ALA 92 CO -0.07 0.67 -0.01 0.00 0.00 0.00 0.00 179.25 179.84 2qee h ARG 94 N -0.36 0.27 -0.80 0.00 2.43 -0.65 -2.21 114.38 113.06 2qee h ARG 94 Ca 0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2qee h ARG 94 Cb 0.44 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.89 2qee h ARG 94 CO 0.00 0.18 0.52 0.78 -1.51 0.00 0.00 179.97 179.94 2qee h GLY 95 N 0.28 1.13 0.54 2.80 0.00 -0.71 -0.74 103.07 106.38 2qee h GLY 95 Ca 0.55 -0.44 0.08 0.00 0.00 0.00 0.00 47.33 47.52 2qee h GLY 95 CO -0.60 0.43 0.35 -2.08 0.00 0.00 0.00 176.54 174.64 2qee h VAL 96 N 1.09 0.88 -0.47 4.60 2.07 -1.15 -1.47 116.25 121.80 2qee h VAL 96 Ca 0.29 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.57 2qee h VAL 96 Cb -0.10 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 2qee h VAL 96 CO -0.06 0.11 0.16 -0.07 0.02 0.00 0.00 177.57 177.74 2qee h LEU 97 N 0.62 0.66 -0.91 2.57 3.38 -1.18 -1.59 115.31 118.85 2qee h LEU 97 Ca 0.33 -0.19 0.08 0.00 0.09 0.00 0.00 57.88 58.19 2qee h LEU 97 Cb 0.30 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.81 2qee h LEU 97 CO -0.24 0.67 0.56 0.74 0.09 0.00 0.00 178.44 180.26 2qee h THR 98 N 0.61 0.99 -0.05 0.22 2.02 -0.71 -0.94 112.91 115.04 2qee h THR 98 Ca 0.15 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 2qee h THR 98 Cb 0.23 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 66.58 2qee h THR 98 CO -0.01 0.18 0.01 0.00 0.37 0.00 0.00 175.52 176.07 2qee h LEU 100 N -0.16 -0.64 -1.04 0.00 3.38 -0.97 -1.43 115.31 114.45 2qee h LEU 100 Ca 0.01 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 2qee h LEU 100 Cb 0.27 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 2qee h LEU 100 CO 0.00 -0.24 0.37 -0.61 0.09 0.00 0.00 178.44 178.05 2qee h GLN 101 N -0.19 1.05 -0.57 1.13 4.15 -1.14 -1.28 115.11 118.26 2qee h GLN 101 Ca 0.14 -0.14 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 2qee h GLN 101 Cb 0.41 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 2qee h GLN 101 CO -0.37 0.80 0.21 0.78 -1.93 0.00 0.00 178.83 178.32 2qee h GLY 102 N 1.09 0.89 1.25 2.39 0.00 -0.47 -1.36 103.07 106.86 2qee h GLY 102 Ca 0.26 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2qee h GLY 102 CO -0.04 0.43 0.00 1.04 0.00 0.00 0.00 176.54 177.98 2qee n LEU 103 N -4.32 0.00 0.00 3.11 4.77 -0.60 -4.86 117.00 115.09 2qee n LEU 103 Ca 0.05 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 2qee n LEU 103 Cb 0.17 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2qee n LEU 103 CO 0.39 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2qee n GLY 104 N 1.03 0.75 3.90 -0.72 0.00 -0.51 -5.07 105.19 104.57 2qee n GLY 104 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 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 3.03 -0.35 0.99 1.43 -0.54 -4.99 118.68 118.24 2qee s LEU 105 Ca 0.00 0.95 0.02 0.00 -1.03 0.00 0.00 54.13 54.07 2qee s LEU 105 Cb 0.00 -3.76 0.10 0.00 0.03 0.00 0.00 46.19 42.56 2qee s LEU 105 CO 0.00 -1.24 0.08 -0.62 0.23 0.00 0.00 176.35 174.81 2qee s ASP 106 N -4.34 4.90 0.66 2.29 2.15 -1.26 -3.91 116.67 117.15 2qee s ASP 106 Ca 0.56 -2.05 0.42 0.00 0.43 0.00 0.00 52.55 51.91 2qee s ASP 106 Cb -0.11 -1.69 2.31 0.00 -0.30 0.00 0.00 42.92 43.13 2qee s ASP 106 CO 0.49 -0.41 2.34 -0.65 -0.17 0.00 0.00 175.17 176.76 2qee h PRO 107 N 7.76 0.00 -0.92 4.34 0.11 -1.90 -2.62 132.00 138.76 2qee h PRO 107 Ca -0.08 0.00 0.13 0.00 0.11 0.00 0.00 66.00 66.17 2qee h PRO 107 Cb 1.03 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.07 2qee h PRO 107 CO 0.57 0.00 0.59 0.00 -0.21 0.00 0.00 178.00 178.95 2qee h ALA 108 N 1.97 1.73 0.00 -0.75 0.00 -2.01 -2.06 119.26 118.14 2qee h ALA 108 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2qee h ALA 108 Cb 0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2qee h ALA 108 CO -0.00 0.03 -0.13 1.79 0.00 0.00 0.00 179.25 180.93 2qee h THR 109 N 0.79 0.27 -3.07 0.00 1.35 -1.91 -3.47 112.91 106.87 2qee h THR 109 Ca 0.46 -1.10 -0.38 0.00 -0.55 0.00 0.00 66.41 64.85 2qee h THR 109 Cb 0.64 1.88 -0.03 0.00 -1.73 0.00 0.00 68.15 68.91 2qee h THR 109 CO -0.22 0.13 -0.48 0.54 -0.25 0.00 0.00 175.52 175.24 2qee n ARG 110 N -3.19 -1.79 -3.19 4.72 1.74 -0.78 -4.90 116.66 109.27 2qee n ARG 110 Ca 0.02 0.93 -0.45 0.00 -0.77 0.00 0.00 57.85 57.58 2qee n ARG 110 Cb 0.48 -5.56 -0.01 0.00 -1.02 0.00 0.00 32.46 26.35 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 -2.08 7.11 0.38 0.55 -1.08 -1.26 -4.85 116.67 115.44 2qee s ASP 111 Ca 0.00 -3.15 0.08 0.00 -0.52 0.00 0.00 52.55 48.95 2qee s ASP 111 Cb 0.00 -2.28 0.76 0.00 -1.46 0.00 0.00 42.92 39.94 2qee s ASP 111 CO 0.00 -0.53 1.94 0.25 0.52 0.00 0.00 175.17 177.35 2qee h LEU 112 N 8.03 0.34 -0.49 -1.34 5.85 -1.99 -1.70 115.31 124.02 2qee h LEU 112 Ca 0.21 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 2qee h LEU 112 Cb 0.91 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 2qee h LEU 112 CO 1.05 0.41 0.10 1.56 -0.34 0.00 0.00 178.44 181.22 2qee h GLN 113 N 0.36 0.80 -0.81 1.25 1.08 -2.00 -1.47 115.11 114.32 2qee h GLN 113 Ca 0.08 -0.20 -0.02 0.00 -1.45 0.00 0.00 58.65 57.06 2qee h GLN 113 Cb 0.26 -0.10 -0.04 0.00 -0.05 0.00 0.00 27.48 27.56 2qee h GLN 113 CO 0.01 0.78 0.42 0.28 -0.95 0.00 0.00 178.83 179.37 2qee h VAL 114 N 0.68 1.25 -0.71 -0.54 2.07 -1.85 -2.55 116.25 114.59 2qee h VAL 114 Ca 0.15 -0.65 0.01 0.00 0.82 0.00 0.00 66.70 67.03 2qee h VAL 114 Cb 0.36 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.28 2qee h VAL 114 CO 0.00 0.28 0.47 1.88 0.02 0.00 0.00 177.57 180.23 2qee h TYR 115 N 1.14 0.90 -0.77 1.57 0.05 -0.96 -2.54 116.97 116.36 2qee h TYR 115 Ca 0.28 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 59.07 2qee h TYR 115 Cb 0.07 -0.30 -0.04 0.00 1.01 0.00 0.00 36.73 37.47 2qee h TYR 115 CO 0.01 0.57 0.45 0.00 -1.05 0.00 0.00 178.16 178.13 2qee h ARG 116 N 0.97 1.05 -0.56 4.88 3.08 -1.01 -1.93 114.38 120.86 2qee h ARG 116 Ca 0.26 -0.10 0.11 0.00 0.07 0.00 0.00 59.98 60.32 2qee h ARG 116 Cb -0.11 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.69 2qee h ARG 116 CO -0.06 0.75 0.38 0.93 -1.07 0.00 0.00 179.97 180.91 2qee h GLU 117 N 1.06 0.28 -0.66 0.04 5.08 -1.05 -1.85 114.58 117.48 2qee h GLU 117 Ca 0.27 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 2qee h GLU 117 Cb -0.02 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 2qee h GLU 117 CO -0.05 0.18 0.34 -0.92 -1.00 0.00 0.00 179.01 177.57 2qee h TYR 118 N 0.29 0.93 0.00 4.33 3.20 -1.32 -3.04 116.97 121.35 2qee h TYR 118 Ca 0.27 -0.03 -0.18 0.00 3.14 0.00 0.00 58.73 61.93 2qee h TYR 118 Cb 0.66 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.61 2qee h TYR 118 CO -0.00 0.68 -0.84 0.74 -1.64 0.00 0.00 178.16 177.10 2qee h PHE 119 N 0.91 0.00 0.00 -3.82 0.04 -1.43 -3.24 116.94 109.40 2qee h PHE 119 Ca 0.23 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.00 2qee h PHE 119 Cb 0.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.22 2qee h PHE 119 CO -0.00 0.84 0.00 0.00 -0.60 0.00 0.00 178.31 178.55 2qee n ALA 120 N -2.36 1.48 0.05 2.45 0.00 -1.10 -2.26 120.51 118.76 2qee n ALA 120 Ca -0.00 0.11 -0.01 0.00 0.00 0.00 0.00 53.44 53.54 2qee n ALA 120 Cb 0.82 -1.36 -0.07 0.00 0.00 0.00 0.00 19.45 18.84 2qee n ALA 120 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qee h LYS 121 N 0.00 0.00 -6.32 0.00 1.57 -1.65 -3.48 116.57 106.69 2qee h LYS 121 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 2qee h LYS 121 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2qee h LYS 121 CO 0.00 0.43 -0.31 0.15 -0.57 0.00 0.00 179.45 179.15 2qee s LYS 122 N -2.86 3.48 0.53 3.15 1.02 -0.96 -5.11 119.74 119.00 2qee s LYS 122 Ca -0.01 -0.47 -0.03 0.00 0.02 0.00 0.00 55.97 55.47 2qee s LYS 122 Cb 0.08 -2.79 0.01 0.00 -0.52 0.00 0.00 37.83 34.61 2qee s LYS 122 CO 0.80 0.32 0.80 0.95 -0.92 0.00 0.00 175.35 177.30 2qee s THR 123 N -2.07 3.72 0.22 2.17 -4.23 -1.26 -4.98 115.64 109.21 2qee s THR 123 Ca 0.38 -0.23 -0.08 0.00 -1.18 0.00 0.00 61.69 60.57 2qee s THR 123 Cb -0.10 -3.43 0.16 0.00 1.34 0.00 0.00 72.50 70.47 2qee s THR 123 CO 0.32 -0.38 1.77 0.28 -0.54 0.00 0.00 174.62 176.06 2qee h SER 124 N 0.06 0.37 -0.82 3.99 0.02 -1.97 -1.96 113.55 113.24 2qee h SER 124 Ca -0.45 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 60.53 2qee h SER 124 Cb 1.26 0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.77 2qee h SER 124 CO 0.59 0.21 0.40 -0.33 -1.14 0.00 0.00 176.83 176.56 2qee h GLU 125 N 0.53 1.18 -0.55 3.45 3.07 -1.94 0.11 114.58 120.42 2qee h GLU 125 Ca 0.33 -0.17 -0.06 0.00 -0.50 0.00 0.00 59.36 58.97 2qee h GLU 125 Cb 0.38 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 28.05 2qee h GLU 125 CO -0.28 0.91 0.12 0.93 -1.40 0.00 0.00 179.01 179.29 2qee h GLU 126 N 1.17 0.89 -0.17 2.33 5.08 -1.85 -1.89 114.58 120.14 2qee h GLU 126 Ca 0.28 -0.22 -0.17 0.00 -1.00 0.00 0.00 59.36 58.25 2qee h GLU 126 Cb 0.11 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2qee h GLU 126 CO -0.04 0.84 -0.60 0.37 -1.00 0.00 0.00 179.01 178.59 2qee h GLN 127 N 0.79 0.56 -0.08 2.33 5.75 -0.98 -1.20 115.11 122.28 2qee h GLN 127 Ca 0.17 -0.38 0.00 0.00 -0.15 0.00 0.00 58.65 58.30 2qee h GLN 127 Cb 0.36 0.05 -0.00 0.00 1.07 0.00 0.00 27.48 28.96 2qee h GLN 127 CO 0.00 0.99 0.05 0.28 -2.65 0.00 0.00 178.83 177.51 2qee h VAL 128 N 0.41 1.03 -0.76 2.39 2.07 -0.70 0.13 116.25 120.83 2qee h VAL 128 Ca -0.00 -0.07 0.09 0.00 0.82 0.00 0.00 66.70 67.54 2qee h VAL 128 Cb 1.16 0.93 -0.07 0.00 -1.52 0.00 0.00 31.29 31.79 2qee h VAL 128 CO 0.11 0.03 0.40 0.44 0.02 0.00 0.00 177.57 178.58 2qee h ASP 129 N 0.10 0.55 -0.01 0.57 3.32 -1.07 -0.55 116.42 119.34 2qee h ASP 129 Ca 0.03 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2qee h ASP 129 Cb 0.00 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2qee h ASP 129 CO -0.01 0.31 -0.01 0.74 -1.72 0.00 0.00 179.24 178.56 2qee h THR 130 N 0.68 1.33 -0.38 0.35 2.02 -0.88 -2.55 112.91 113.47 2qee h THR 130 Ca 0.37 -0.98 -0.08 0.00 0.77 0.00 0.00 66.41 66.49 2qee h THR 130 Cb 0.37 1.97 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 2qee h THR 130 CO -0.26 0.26 -0.08 0.58 0.37 0.00 0.00 175.52 176.38 2qee h VAL 131 N -0.39 1.27 -0.18 3.16 2.07 -0.61 -0.02 116.25 121.57 2qee h VAL 131 Ca 0.00 -1.16 -0.05 0.00 0.82 0.00 0.00 66.70 66.32 2qee h VAL 131 Cb 0.42 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 2qee h VAL 131 CO 0.00 0.38 -0.10 -0.07 0.02 0.00 0.00 177.57 177.80 2qee h LEU 132 N 0.54 0.26 0.11 2.57 3.38 -1.15 0.14 115.31 121.15 2qee h LEU 132 Ca 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2qee h LEU 132 Cb 0.60 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2qee h LEU 132 CO 0.04 0.40 -0.05 -0.61 0.09 0.00 0.00 178.44 178.30 2qee h GLN 133 N 0.26 -0.14 -0.84 1.13 -0.00 -1.17 -1.20 115.11 113.16 2qee h GLN 133 Ca 0.05 0.01 0.04 0.00 -0.00 0.00 0.00 58.65 58.75 2qee h GLN 133 Cb 0.35 0.03 -0.05 0.00 0.00 0.00 0.00 27.48 27.81 2qee h GLN 133 CO 0.02 0.34 0.54 -0.07 0.00 0.00 0.00 178.83 179.66 2qee h LEU 134 N -0.72 0.88 -0.02 -2.39 3.38 -0.78 -2.13 115.31 113.53 2qee h LEU 134 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qee h LEU 134 Cb 0.54 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2qee h LEU 134 CO 0.02 0.60 -0.02 0.00 0.09 0.00 0.00 178.44 179.14 2qee n ALA 135 N -2.34 2.50 -3.92 1.53 0.00 0.47 -4.95 120.51 113.80 2qee n ALA 135 Ca 0.11 -0.15 -0.26 0.00 0.00 0.00 0.00 53.44 53.13 2qee n ALA 135 Cb 0.10 -1.47 -0.00 0.00 0.00 0.00 0.00 19.45 18.08 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 -1.29 -1.54 -4.47 0.00 5.15 -0.63 -4.82 115.26 107.66 2qee n ASN 136 Ca 0.13 -0.93 -0.35 0.00 -0.60 0.00 0.00 54.58 52.83 2qee n ASN 136 Cb 0.26 -3.39 -0.12 0.00 -0.53 0.00 0.00 39.78 35.99 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 -3.71 4.17 -0.10 3.44 1.01 -0.55 -0.07 120.40 124.59 2qee s VAL 137 Ca 0.19 -0.23 0.15 0.00 0.00 0.00 0.00 61.98 62.09 2qee s VAL 137 Cb -0.10 -2.91 -0.23 0.00 0.00 0.00 0.00 36.38 33.14 2qee s VAL 137 CO 0.87 0.40 0.49 -1.54 0.00 0.00 0.00 175.10 175.32 2qee n SER 138 N 4.42 0.58 -3.72 3.32 3.41 0.36 -4.71 113.62 117.28 2qee n SER 138 Ca -0.17 0.27 -0.13 0.00 -0.26 0.00 0.00 58.87 58.58 2qee n SER 138 Cb 0.52 0.35 -0.14 0.00 -0.26 0.00 0.00 64.21 64.68 2qee n SER 138 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2qee s ASP 139 N -5.82 -0.11 -0.14 4.04 1.01 -1.17 -4.74 116.67 109.73 2qee s ASP 139 Ca -0.06 0.46 0.00 0.00 0.71 0.00 0.00 52.55 53.66 2qee s ASP 139 Cb 0.08 0.37 -0.01 0.00 1.01 0.00 0.00 42.92 44.37 2qee s ASP 139 CO 0.83 -0.17 -0.15 -0.69 0.21 0.00 0.00 175.17 175.20 2qee s VAL 140 N 1.41 2.78 -0.23 -1.27 1.01 0.26 -0.64 120.40 123.72 2qee s VAL 140 Ca -0.08 -0.74 -0.18 0.00 0.00 0.00 0.00 61.98 60.98 2qee s VAL 140 Cb -0.11 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 2qee s VAL 140 CO -0.08 0.52 0.51 -0.69 0.00 0.00 0.00 175.10 175.36 2qee s VAL 141 N 0.64 5.10 0.74 2.92 1.01 0.05 -0.12 120.40 130.75 2qee s VAL 141 Ca -0.08 0.90 -0.09 0.00 0.00 0.00 0.00 61.98 62.71 2qee s VAL 141 Cb -0.16 -3.83 0.07 0.00 0.00 0.00 0.00 36.38 32.46 2qee s VAL 141 CO 0.02 0.14 1.08 -0.04 0.00 0.00 0.00 175.10 176.31 2qee s MET 142 N 1.91 2.14 -0.27 2.72 -1.94 0.98 -0.89 119.30 123.95 2qee s MET 142 Ca 0.22 -0.08 -0.03 0.00 -1.71 0.00 0.00 55.69 54.09 2qee s MET 142 Cb -0.15 -2.08 0.02 0.00 2.01 0.00 0.00 34.83 34.63 2qee s MET 142 CO 0.09 -1.37 -0.01 0.99 -0.01 0.00 0.00 175.02 174.72 2qee s THR 143 N -3.38 3.25 -0.23 2.05 2.01 -1.01 -3.25 115.64 115.07 2qee s THR 143 Ca 0.61 -0.96 0.01 0.00 0.31 0.00 0.00 61.69 61.66 2qee s THR 143 Cb -0.11 -2.69 0.04 0.00 0.01 0.00 0.00 72.50 69.75 2qee s THR 143 CO 0.47 0.12 -0.12 0.20 -0.69 0.00 0.00 174.62 174.60 2qee s ASN 144 N 1.37 4.03 -0.40 3.53 -0.87 -0.50 -4.95 114.94 117.16 2qee s ASN 144 Ca 0.00 -1.03 -0.07 0.00 -1.57 0.00 0.00 52.86 50.19 2qee s ASN 144 Cb -0.17 -1.56 0.07 0.00 -0.02 0.00 0.00 41.25 39.57 2qee s ASN 144 CO -0.02 -0.12 0.21 -0.62 -2.57 0.00 0.00 177.10 173.98 2qee s ASP 145 N 1.22 5.49 0.00 -1.22 2.15 -1.26 -0.95 116.67 122.10 2qee s ASP 145 Ca -0.02 -1.49 0.18 0.00 0.43 0.00 0.00 52.55 51.65 2qee s ASP 145 Cb -0.17 -1.93 1.00 0.00 -0.30 0.00 0.00 42.92 41.52 2qee s ASP 145 CO -0.07 -0.48 1.52 -0.81 -0.17 0.00 0.00 175.17 175.16 2qee n PRO 146 N 4.84 0.40 0.00 4.34 -0.04 -1.26 -1.58 135.00 141.70 2qee n PRO 146 Ca -0.10 0.06 0.13 0.00 -0.04 0.00 0.00 63.50 63.56 2qee n PRO 146 Cb 0.43 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.81 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 -1.16 0.00 -3.43 0.54 3.72 -1.26 -4.70 117.46 111.17 2qee n PHE 147 Ca 0.11 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.13 2qee n PHE 147 Cb 0.11 -0.12 -0.08 0.00 -0.94 0.00 0.00 39.48 38.44 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 -2.46 6.32 0.10 4.37 2.15 -0.61 -4.98 116.67 121.56 2qee s ASP 148 Ca 0.26 0.37 -0.23 0.00 0.43 0.00 0.00 52.55 53.37 2qee s ASP 148 Cb 0.19 -2.20 -0.13 0.00 -0.30 0.00 0.00 42.92 40.49 2qee s ASP 148 CO 0.50 -0.09 1.72 0.44 -0.17 0.00 0.00 175.17 177.56 2qee h ASP 149 N 7.69 -0.14 -0.19 -0.34 3.32 -1.87 0.32 116.42 125.21 2qee h ASP 149 Ca -0.35 0.02 0.06 0.00 0.02 0.00 0.00 57.03 56.78 2qee h ASP 149 Cb 1.16 0.06 -0.07 0.00 0.22 0.00 0.00 39.33 40.70 2qee h ASP 149 CO 0.68 -0.08 -0.28 -1.13 -1.72 0.00 0.00 179.24 176.71 2qee h ASN 150 N -0.10 -0.89 -0.76 6.45 -1.24 -1.96 -1.08 115.58 116.00 2qee h ASN 150 Ca 0.01 0.14 -0.03 0.00 0.71 0.00 0.00 56.30 57.14 2qee h ASN 150 Cb 0.11 0.40 -0.03 0.00 0.73 0.00 0.00 38.32 39.53 2qee h ASN 150 CO -0.04 -0.32 0.37 -0.33 -1.29 0.00 0.00 177.43 175.83 2qee h GLU 151 N -0.32 1.09 -0.40 6.67 5.08 -1.75 -3.05 114.58 121.90 2qee h GLU 151 Ca 0.12 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2qee h GLU 151 Cb 0.50 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2qee h GLU 151 CO -0.37 0.84 0.24 -0.09 -1.00 0.00 0.00 179.01 178.63 2qee h ARG 152 N 1.07 0.55 -0.50 2.33 2.43 0.17 -3.07 114.38 117.36 2qee h ARG 152 Ca 0.26 -0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.45 2qee h ARG 152 Cb 0.11 -0.11 -0.09 0.00 -0.42 0.00 0.00 29.97 29.45 2qee h ARG 152 CO -0.03 0.42 -0.48 0.82 -1.51 0.00 0.00 179.97 179.18 2qee h ILE 153 N 0.53 0.06 -0.69 1.20 2.04 -1.10 -0.88 117.51 118.67 2qee h ILE 153 Ca 0.14 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.13 2qee h ILE 153 Cb 0.01 0.06 -0.09 0.00 -0.74 0.00 0.00 36.82 36.06 2qee h ILE 153 CO -0.03 0.00 0.25 -1.28 0.00 0.00 0.00 178.15 177.09 2qee h SER 154 N -0.30 0.21 -0.52 1.72 0.87 -1.58 -0.04 113.55 113.91 2qee h SER 154 Ca 0.13 0.10 -0.08 0.00 -1.23 0.00 0.00 61.79 60.71 2qee h SER 154 Cb 0.58 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.61 2qee h SER 154 CO -0.64 0.09 -0.01 -0.50 -0.53 0.00 0.00 176.83 175.25 2qee h TRP 155 N 0.40 1.00 0.00 2.24 4.06 -1.33 -1.94 115.95 120.38 2qee h TRP 155 Ca 0.37 -0.18 -0.02 0.00 2.06 0.00 0.00 58.89 61.12 2qee h TRP 155 Cb 0.54 -0.26 -0.00 0.00 -1.00 0.00 0.00 29.16 28.43 2qee h TRP 155 CO -0.19 0.93 -0.10 -0.07 -3.56 0.00 0.00 178.44 175.46 2qee h LEU 156 N 0.79 0.00 -0.66 -4.49 3.38 -0.07 -0.93 115.31 113.33 2qee h LEU 156 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2qee h LEU 156 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2qee h LEU 156 CO 0.03 0.10 -0.01 -0.62 0.09 0.00 0.00 178.44 178.02 2qee n GLU 157 N -3.53 1.43 -1.00 1.13 1.02 -0.14 -4.94 120.64 114.60 2qee n GLU 157 Ca -0.02 -0.66 -0.00 0.00 -0.02 0.00 0.00 57.16 56.46 2qee n GLU 157 Cb 0.23 -1.49 -0.00 0.00 -0.02 0.00 0.00 31.44 30.16 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 1.14 0.42 3.70 0.62 0.00 -0.35 -5.01 105.19 105.71 2qee n GLY 158 Ca 0.20 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.30 4.14 -0.04 1.61 1.02 -0.75 -5.00 119.74 119.42 2qee s LYS 159 Ca 0.00 2.57 0.03 0.00 0.02 0.00 0.00 55.97 58.58 2qee s LYS 159 Cb 0.00 -3.39 -0.03 0.00 -0.52 0.00 0.00 37.83 33.89 2qee s LYS 159 CO 0.00 -0.79 -0.10 -0.65 -0.92 0.00 0.00 175.35 172.89 2qee s GLN 160 N 2.12 2.58 0.82 1.68 -1.52 -1.26 -4.64 119.66 119.43 2qee s GLN 160 Ca 0.78 -0.66 -0.10 0.00 -1.95 0.00 0.00 55.36 53.42 2qee s GLN 160 Cb -0.47 -2.47 0.09 0.00 -0.22 0.00 0.00 33.01 29.94 2qee s GLN 160 CO 0.34 0.63 1.11 -1.25 -0.25 0.00 0.00 175.29 175.88 2qee s PRO 161 N -0.94 1.83 0.96 2.91 0.04 -1.26 -5.01 135.00 133.53 2qee s PRO 161 Ca 0.13 1.32 -0.12 0.00 0.04 0.00 0.00 61.00 62.37 2qee s PRO 161 Cb -0.11 -1.84 0.17 0.00 0.04 0.00 0.00 34.50 32.76 2qee s PRO 161 CO 0.02 -1.99 1.09 0.16 0.04 0.00 0.00 177.00 176.32 2qee s ASP 162 N -3.11 2.85 0.33 6.66 1.47 -1.26 -4.87 116.67 118.75 2qee s ASP 162 Ca 0.63 1.50 0.25 0.00 1.18 0.00 0.00 52.55 56.12 2qee s ASP 162 Cb -0.19 -2.17 1.17 0.00 -0.34 0.00 0.00 42.92 41.38 2qee s ASP 162 CO 0.56 -3.03 1.76 0.77 0.68 0.00 0.00 175.17 175.91 2qee h SER 163 N -1.82 0.00 1.23 2.11 4.64 -2.00 -1.37 113.55 116.34 2qee h SER 163 Ca -0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 2qee h SER 163 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2qee h SER 163 CO 0.53 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 177.03 2qee n ARG 164 N -2.38 0.19 -4.56 4.77 1.74 -1.26 -4.80 116.66 110.36 2qee n ARG 164 Ca 0.00 0.21 -0.33 0.00 -0.77 0.00 0.00 57.85 56.96 2qee n ARG 164 Cb 0.16 -1.74 -0.15 0.00 -1.02 0.00 0.00 32.46 29.71 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 -3.11 2.80 0.01 -1.55 0.08 -0.52 -0.57 117.98 115.12 2qee s PHE 165 Ca 0.10 -0.93 0.04 0.00 0.12 0.00 0.00 56.93 56.26 2qee s PHE 165 Cb 0.13 -1.89 -0.03 0.00 -0.57 0.00 0.00 43.02 40.66 2qee s PHE 165 CO 0.54 -0.41 -0.10 -1.01 -0.10 0.00 0.00 175.22 174.13 2qee s HIS 166 N 0.73 2.78 0.36 0.36 3.76 0.83 -4.68 115.29 119.44 2qee s HIS 166 Ca -0.06 -0.11 -0.20 0.00 -0.15 0.00 0.00 55.06 54.54 2qee s HIS 166 Cb -0.15 -1.58 -0.10 0.00 1.11 0.00 0.00 32.58 31.86 2qee s HIS 166 CO 0.01 0.32 0.86 0.00 -0.85 0.00 0.00 174.74 175.09 2qee s ALA 167 N -0.95 3.19 -0.04 -1.40 0.00 -1.26 -0.02 121.76 121.29 2qee s ALA 167 Ca 0.16 0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.43 2qee s ALA 167 Cb -0.11 -3.01 0.02 0.00 0.00 0.00 0.00 23.12 20.02 2qee s ALA 167 CO 0.06 0.22 -0.06 0.00 0.00 0.00 0.00 175.76 175.98 2qee s ALA 168 N -1.94 0.74 -0.49 0.00 0.00 -1.20 -0.81 121.76 118.06 2qee s ALA 168 Ca 0.55 -0.14 -0.26 0.00 0.00 0.00 0.00 51.96 52.11 2qee s ALA 168 Cb -0.12 -0.40 0.03 0.00 0.00 0.00 0.00 23.12 22.63 2qee s ALA 168 CO 0.17 0.04 1.00 -1.17 0.00 0.00 0.00 175.76 175.80 2qee s LEU 169 N 0.70 3.89 -0.15 0.00 2.96 -0.23 -1.41 118.68 124.44 2qee s LEU 169 Ca -0.10 0.14 -0.28 0.00 -0.22 0.00 0.00 54.13 53.67 2qee s LEU 169 Cb -0.13 -3.23 -0.01 0.00 0.50 0.00 0.00 46.19 43.32 2qee s LEU 169 CO 0.01 -1.15 0.96 -0.60 -1.32 0.00 0.00 176.35 174.24 2qee s ARG 170 N 4.04 4.35 0.00 1.98 3.52 -0.12 -0.94 118.95 131.78 2qee s ARG 170 Ca 0.39 1.26 0.02 0.00 -0.13 0.00 0.00 55.73 57.27 2qee s ARG 170 Cb -0.09 -3.57 0.06 0.00 -1.56 0.00 0.00 34.95 29.78 2qee s ARG 170 CO 0.27 -0.38 1.01 1.28 -0.81 0.00 0.00 175.30 176.67 2qee n LEU 171 N 5.34 2.11 -0.29 -0.88 4.77 0.10 -4.43 117.00 123.71 2qee n LEU 171 Ca 0.08 -1.93 0.00 0.00 -0.03 0.00 0.00 56.01 54.14 2qee n LEU 171 Cb 0.48 -0.04 0.07 0.00 -2.33 0.00 0.00 43.42 41.60 2qee n LEU 171 CO 0.51 0.52 0.66 0.44 -1.33 0.00 0.00 177.39 178.19 2qee h ASP 172 N 0.39 -1.01 -0.71 -1.43 5.19 -1.94 -1.20 116.42 115.72 2qee h ASP 172 Ca 0.00 0.26 -0.02 0.00 -0.62 0.00 0.00 57.03 56.65 2qee h ASP 172 Cb 0.51 0.59 -0.03 0.00 0.18 0.00 0.00 39.33 40.57 2qee h ASP 172 CO 0.00 -0.29 0.37 -0.65 -3.12 0.00 0.00 179.24 175.55 2qee h PRO 173 N -0.04 1.01 0.04 3.56 0.11 -1.94 0.36 132.00 135.10 2qee h PRO 173 Ca 0.35 -0.12 -0.00 0.00 0.11 0.00 0.00 66.00 66.34 2qee h PRO 173 Cb 0.60 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.51 2qee h PRO 173 CO -0.85 0.76 -0.02 1.25 -0.21 0.00 0.00 178.00 178.94 2qee h LEU 174 N 1.02 -0.04 0.13 2.35 5.85 -1.59 -1.87 115.31 121.15 2qee h LEU 174 Ca 0.25 -0.21 -0.29 0.00 0.84 0.00 0.00 57.88 58.47 2qee h LEU 174 Cb 0.07 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.11 2qee h LEU 174 CO -0.04 0.19 -1.38 -0.07 -0.34 0.00 0.00 178.44 176.81 2qee h LEU 175 N -0.27 0.42 0.00 2.25 4.07 -0.95 -3.26 115.31 117.58 2qee h LEU 175 Ca -0.01 -0.50 0.00 0.00 0.08 0.00 0.00 57.88 57.45 2qee h LEU 175 Cb 0.25 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.85 2qee h LEU 175 CO 0.01 1.41 -1.77 0.59 -1.08 0.00 0.00 178.44 177.59 2qee n ASN 176 N -3.50 0.35 -2.59 -0.43 3.02 0.13 -3.60 115.26 108.64 2qee n ASN 176 Ca -0.12 -0.19 -0.08 0.00 -0.03 0.00 0.00 54.58 54.16 2qee n ASN 176 Cb 1.04 1.78 0.04 0.00 -0.61 0.00 0.00 39.78 42.02 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 -2.09 2.26 -0.31 3.52 1.02 -0.71 -4.95 120.64 119.39 2qee n GLU 177 Ca -0.02 -3.71 -0.03 0.00 -0.02 0.00 0.00 57.16 53.38 2qee n GLU 177 Cb 0.50 -1.79 0.09 0.00 -0.02 0.00 0.00 31.44 30.22 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 2.52 1.04 -0.61 -0.32 3.20 -1.59 -0.46 116.97 120.76 2qee h TYR 178 Ca 0.02 0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.04 2qee h TYR 178 Cb 1.32 -0.35 -0.11 0.00 1.54 0.00 0.00 36.73 39.13 2qee h TYR 178 CO 0.61 0.64 -0.09 0.93 -1.64 0.00 0.00 178.16 178.61 2qee h GLU 179 N 1.11 0.04 -0.16 1.82 4.39 -1.90 0.24 114.58 120.12 2qee h GLU 179 Ca 0.32 -0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.92 2qee h GLU 179 Cb -0.09 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.55 2qee h GLU 179 CO -0.08 0.03 -0.24 1.96 -1.16 0.00 0.00 179.01 179.51 2qee h GLN 180 N 0.04 0.45 0.00 2.33 7.50 -1.79 -3.36 115.11 120.28 2qee h GLN 180 Ca 0.30 -0.27 -0.12 0.00 0.50 0.00 0.00 58.65 59.07 2qee h GLN 180 Cb 0.48 0.02 -0.02 0.00 0.05 0.00 0.00 27.48 28.02 2qee h GLN 180 CO -0.58 0.86 -0.56 1.15 -1.50 0.00 0.00 178.83 178.20 2qee h THR 181 N 0.08 1.28 -0.11 -0.54 2.02 -0.10 -3.09 112.91 112.45 2qee h THR 181 Ca 0.02 -2.00 0.03 0.00 0.77 0.00 0.00 66.41 65.23 2qee h THR 181 Cb 0.82 2.11 -0.00 0.00 -1.74 0.00 0.00 68.15 69.34 2qee h THR 181 CO 0.06 0.55 0.12 0.07 0.37 0.00 0.00 175.52 176.68 2qee h LYS 182 N 0.00 0.00 -0.01 6.66 2.10 -0.72 -0.47 116.57 124.13 2qee h LYS 182 Ca -0.01 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.49 2qee h LYS 182 Cb 1.07 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.38 2qee h LYS 182 CO 0.07 0.00 -0.71 0.45 -2.00 0.00 0.00 179.45 177.26 2qee h HIS 183 N 0.00 0.08 -0.09 0.07 3.86 -1.77 -2.21 115.15 115.10 2qee h HIS 183 Ca 0.05 -0.04 -0.23 0.00 -1.16 0.00 0.00 60.37 58.99 2qee h HIS 183 Cb 0.29 -0.01 0.01 0.00 1.06 0.00 0.00 27.41 28.75 2qee h HIS 183 CO 0.00 0.75 -0.86 0.00 0.86 0.00 0.00 177.93 178.68 2qee h ARG 184 N 0.04 0.69 -0.53 2.45 3.08 -1.28 -1.18 114.38 117.65 2qee h ARG 184 Ca -0.01 -0.62 0.07 0.00 0.07 0.00 0.00 59.98 59.49 2qee h ARG 184 Cb 1.25 0.15 -0.06 0.00 0.08 0.00 0.00 29.97 31.39 2qee h ARG 184 CO 0.10 1.22 0.22 -0.07 -1.07 0.00 0.00 179.97 180.37 2qee h LEU 185 N 0.44 0.26 -0.40 3.04 3.38 -1.15 -0.05 115.31 120.83 2qee h LEU 185 Ca -0.07 0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 2qee h LEU 185 Cb 1.48 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.24 2qee h LEU 185 CO 0.17 0.18 -0.27 0.08 0.09 0.00 0.00 178.44 178.68 2qee h ARG 186 N 0.42 0.89 -1.22 1.13 0.11 -1.16 0.59 114.38 115.13 2qee h ARG 186 Ca 0.25 -0.42 0.37 0.00 0.10 0.00 0.00 59.98 60.28 2qee h ARG 186 Cb 0.24 -0.01 -0.11 0.00 1.11 0.00 0.00 29.97 31.21 2qee h ARG 186 CO -0.23 1.07 0.80 -0.44 0.10 0.00 0.00 179.97 181.27 2qee h ASP 187 N 0.70 0.29 -0.54 0.08 3.32 -0.67 0.26 116.42 119.86 2qee h ASP 187 Ca 0.08 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2qee h ASP 187 Cb 0.85 0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.47 2qee h ASP 187 CO 0.07 -0.06 0.00 0.79 -1.72 0.00 0.00 179.24 178.32 2qee n TRP 188 N -4.61 0.72 -0.49 4.55 8.01 -0.08 -4.92 117.44 120.63 2qee n TRP 188 Ca 0.32 -0.36 0.00 0.00 -1.31 0.00 0.00 57.50 56.15 2qee n TRP 188 Cb 1.22 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.52 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 1.43 0.74 3.47 6.99 0.00 0.91 -5.03 105.19 113.71 2qee n GLY 189 Ca 0.20 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.00 3.07 -1.52 1.61 2.02 0.19 -4.95 117.35 115.78 2qee s TYR 190 Ca 0.00 -0.36 -0.09 0.00 -0.37 0.00 0.00 57.07 56.24 2qee s TYR 190 Cb 0.00 -3.38 -0.07 0.00 -0.40 0.00 0.00 41.96 38.10 2qee s TYR 190 CO 0.00 -0.94 2.93 1.63 -1.57 0.00 0.00 175.55 177.60 2qee n LYS 191 N 6.13 3.73 -2.20 -0.62 4.76 -1.26 -2.64 118.16 126.06 2qee n LYS 191 Ca -0.05 -2.29 -0.42 0.00 -2.87 0.00 0.00 58.31 52.68 2qee n LYS 191 Cb 0.46 -2.74 -0.03 0.00 -1.84 0.00 0.00 35.03 30.88 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 1.71 3.51 0.81 -0.18 -7.23 -1.26 -4.51 120.40 113.26 2qee s VAL 192 Ca 0.68 1.03 -0.12 0.00 -1.81 0.00 0.00 61.98 61.76 2qee s VAL 192 Cb 0.19 -3.66 0.09 0.00 0.56 0.00 0.00 36.38 33.56 2qee s VAL 192 CO -0.06 0.05 1.17 0.20 -0.31 0.00 0.00 175.10 176.15 2qee s ASN 193 N 1.42 4.38 0.22 4.85 0.02 -1.26 -4.97 114.94 119.59 2qee s ASN 193 Ca 0.64 0.66 0.12 0.00 -1.02 0.00 0.00 52.86 53.26 2qee s ASN 193 Cb -0.34 -1.12 -0.01 0.00 0.02 0.00 0.00 41.25 39.80 2qee s ASN 193 CO 0.29 -1.97 1.40 0.44 0.02 0.00 0.00 177.10 177.28 2qee h ASP 194 N -1.06 0.00 -3.43 -1.22 3.32 -2.02 -3.44 116.42 108.57 2qee h ASP 194 Ca -0.45 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.06 2qee h ASP 194 Cb 1.32 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.84 2qee h ASP 194 CO 0.62 0.71 -0.12 -1.83 -1.72 0.00 0.00 179.24 176.89 2qee s GLU 195 N -2.91 3.80 -1.10 3.56 -1.05 -1.26 -5.00 118.70 114.73 2qee s GLU 195 Ca 0.02 0.27 -0.21 0.00 -0.15 0.00 0.00 54.97 54.90 2qee s GLU 195 Cb 0.09 -2.65 0.07 0.00 -0.44 0.00 0.00 34.13 31.19 2qee s GLU 195 CO 0.77 0.32 1.51 -0.46 0.95 0.00 0.00 175.26 178.35 2qee s TRP 196 N -1.81 2.68 0.34 4.83 -0.11 -1.26 -4.68 118.94 118.93 2qee s TRP 196 Ca 0.47 -1.15 0.01 0.00 1.22 0.00 0.00 56.10 56.64 2qee s TRP 196 Cb -0.11 -4.67 0.01 0.00 -1.50 0.00 0.00 33.47 27.19 2qee s TRP 196 CO 0.21 -1.85 0.05 0.27 -4.62 0.00 0.00 176.95 171.01 2qee n ASN 197 N 8.46 2.80 -0.07 5.86 0.23 -1.26 -4.98 115.26 126.31 2qee n ASN 197 Ca 0.37 -2.44 0.01 0.00 -0.53 0.00 0.00 54.58 51.99 2qee n ASN 197 Cb 0.49 0.19 0.31 0.00 -2.08 0.00 0.00 39.78 38.69 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 0.69 0.70 -3.83 4.57 -1.99 -0.03 114.58 114.69 2qee h GLU 198 Ca -0.27 -0.08 -0.03 0.00 -1.18 0.00 0.00 59.36 57.80 2qee h GLU 198 Cb 0.85 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.30 2qee h GLU 198 CO 0.45 0.54 -0.46 0.78 -1.18 0.00 0.00 179.01 179.15 2qee h GLY 199 N 0.81 -1.22 0.13 1.92 0.00 -1.94 -0.27 103.07 102.49 2qee h GLY 199 Ca 0.17 0.51 0.08 0.00 0.00 0.00 0.00 47.33 48.10 2qee h GLY 199 CO -0.02 -0.41 -0.12 1.76 0.00 0.00 0.00 176.54 177.74 2qee h SER 200 N -1.09 -0.43 -0.04 0.19 0.02 -1.62 -0.56 113.55 110.00 2qee h SER 200 Ca -0.09 0.13 0.03 0.00 -0.84 0.00 0.00 61.79 61.02 2qee h SER 200 Cb 0.89 0.28 -0.04 0.00 0.14 0.00 0.00 62.40 63.67 2qee h SER 200 CO 0.07 -0.15 -0.16 0.40 -1.14 0.00 0.00 176.83 175.85 2qee h ILE 201 N -0.02 0.61 -0.50 3.27 2.04 -0.96 -0.70 117.51 121.25 2qee h ILE 201 Ca 0.20 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.03 2qee h ILE 201 Cb 0.33 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 2qee h ILE 201 CO -0.44 0.00 0.18 1.56 0.00 0.00 0.00 178.15 179.44 2qee h GLN 202 N -0.24 0.73 -0.26 2.37 1.08 -0.57 -0.61 115.11 117.61 2qee h GLN 202 Ca 0.06 -0.11 -0.17 0.00 -1.45 0.00 0.00 58.65 56.98 2qee h GLN 202 Cb 0.33 -0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2qee h GLN 202 CO -0.18 0.62 -0.53 0.93 -0.95 0.00 0.00 178.83 178.72 2qee h GLU 203 N 0.72 0.75 -0.43 1.46 4.39 -0.78 -0.86 114.58 119.83 2qee h GLU 203 Ca 0.17 -0.46 -0.07 0.00 0.34 0.00 0.00 59.36 59.33 2qee h GLU 203 Cb 0.18 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 2qee h GLU 203 CO -0.01 1.09 -0.01 0.28 -1.16 0.00 0.00 179.01 179.19 2qee h VAL 204 N 0.58 1.26 -0.77 3.13 2.07 -0.74 -1.66 116.25 120.12 2qee h VAL 204 Ca 0.02 -1.06 0.08 0.00 0.82 0.00 0.00 66.70 66.56 2qee h VAL 204 Cb 1.11 1.09 -0.05 0.00 -1.52 0.00 0.00 31.29 31.92 2qee h VAL 204 CO 0.11 0.36 0.51 0.11 0.02 0.00 0.00 177.57 178.68 2qee h LYS 205 N 0.61 0.73 -0.43 1.57 1.57 -1.00 -1.54 116.57 118.08 2qee h LYS 205 Ca 0.12 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.72 2qee h LYS 205 Cb 0.51 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2qee h LYS 205 CO 0.02 0.48 -0.26 -0.09 -0.57 0.00 0.00 179.45 179.04 2qee h ARG 206 N 0.75 0.91 -0.47 3.15 2.43 -0.57 0.12 114.38 120.70 2qee h ARG 206 Ca 0.35 -0.40 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2qee h ARG 206 Cb 0.37 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2qee h ARG 206 CO -0.13 1.06 0.27 0.35 -1.51 0.00 0.00 179.97 180.01 2qee h PHE 207 N 0.78 0.64 -0.08 2.20 3.57 -0.78 0.23 116.94 123.51 2qee h PHE 207 Ca 0.09 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2qee h PHE 207 Cb 0.82 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.35 2qee h PHE 207 CO 0.05 0.47 0.03 -0.07 -2.23 0.00 0.00 178.31 176.56 2qee h LEU 208 N 0.63 0.10 -0.88 0.59 3.38 -0.96 -1.55 115.31 116.63 2qee h LEU 208 Ca 0.17 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2qee h LEU 208 Cb 0.03 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2qee h LEU 208 CO -0.03 0.24 0.57 0.74 0.09 0.00 0.00 178.44 180.05 2qee h THR 209 N -0.04 1.23 -0.69 0.22 2.02 -0.59 0.66 112.91 115.72 2qee h THR 209 Ca 0.03 -0.44 -0.02 0.00 0.77 0.00 0.00 66.41 66.75 2qee h THR 209 Cb 0.17 -0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 66.50 2qee h THR 209 CO -0.00 0.23 0.36 0.44 0.37 0.00 0.00 175.52 176.91 2qee h ASP 210 N 1.19 0.88 0.66 4.18 3.32 -0.38 -1.12 116.42 125.14 2qee h ASP 210 Ca 0.32 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 57.10 2qee h ASP 210 Cb -0.12 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.19 2qee h ASP 210 CO -0.07 0.74 -0.74 -0.50 -1.72 0.00 0.00 179.24 176.95 2qee h TRP 211 N 0.95 0.09 -0.36 4.55 4.06 -0.56 -1.57 115.95 123.12 2qee h TRP 211 Ca 0.24 -0.04 -0.02 0.00 2.06 0.00 0.00 58.89 61.13 2qee h TRP 211 Cb 0.07 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.20 2qee h TRP 211 CO -0.00 0.78 0.15 0.82 -3.56 0.00 0.00 178.44 176.63 2qee h ILE 212 N 0.04 1.18 -0.66 1.49 2.04 -0.65 0.20 117.51 121.15 2qee h ILE 212 Ca -0.01 -0.55 -0.06 0.00 1.00 0.00 0.00 64.86 65.24 2qee h ILE 212 Cb 1.30 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 2qee h ILE 212 CO 0.10 0.20 0.18 -0.33 0.00 0.00 0.00 178.15 178.29 2qee h GLU 213 N 0.43 1.03 -0.21 2.37 3.07 -1.12 0.97 114.58 121.12 2qee h GLU 213 Ca 0.12 -0.23 -0.18 0.00 -0.50 0.00 0.00 59.36 58.57 2qee h GLU 213 Cb 0.17 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 2qee h GLU 213 CO -0.01 0.90 -0.58 -0.09 -1.40 0.00 0.00 179.01 177.83 2qee h ARG 214 N 0.99 0.77 0.00 2.33 2.43 -1.10 -3.37 114.38 116.43 2qee h ARG 214 Ca 0.21 -0.54 -0.14 0.00 -0.81 0.00 0.00 59.98 58.70 2qee h ARG 214 Cb 0.33 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2qee h ARG 214 CO -0.00 1.16 -1.79 -1.33 -1.51 0.00 0.00 179.97 176.50 2qee n MET 215 N -4.06 0.65 -3.71 0.20 2.81 0.04 -5.00 117.12 108.05 2qee n MET 215 Ca -0.06 0.02 -0.29 0.00 -1.81 0.00 0.00 57.70 55.55 2qee n MET 215 Cb 0.64 -1.65 0.03 0.00 -0.71 0.00 0.00 33.22 31.54 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 -2.62 -4.27 -4.78 7.83 2.03 0.33 -4.55 116.55 110.51 2qee n ASP 216 Ca -0.12 -0.99 -0.35 0.00 0.52 0.00 0.00 54.79 53.85 2qee n ASP 216 Cb 0.79 -3.43 -0.01 0.00 -0.72 0.00 0.00 41.12 37.75 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 -6.02 3.54 0.29 -0.67 0.04 -1.26 -4.61 135.00 126.31 2qee s PRO 217 Ca 0.37 1.53 0.15 0.00 0.04 0.00 0.00 61.00 63.08 2qee s PRO 217 Cb -0.13 -2.06 0.24 0.00 0.04 0.00 0.00 34.50 32.59 2qee s PRO 217 CO 0.86 -0.68 1.52 -0.39 0.04 0.00 0.00 177.00 178.35 2qee h VAL 218 N 1.37 1.02 -2.98 -0.36 -1.51 -1.32 -3.47 116.25 108.99 2qee h VAL 218 Ca -0.50 -2.17 0.03 0.00 -1.23 0.00 0.00 66.70 62.83 2qee h VAL 218 Cb 1.25 2.32 -0.09 0.00 -2.13 0.00 0.00 31.29 32.63 2qee h VAL 218 CO 0.58 0.53 0.23 -0.72 -1.23 0.00 0.00 177.57 176.95 2qee s TYR 219 N -3.16 -0.37 -0.12 5.19 -0.85 -1.26 -4.25 117.35 112.53 2qee s TYR 219 Ca 0.02 0.05 -0.04 0.00 -0.52 0.00 0.00 57.07 56.58 2qee s TYR 219 Cb 0.09 0.63 -0.04 0.00 0.38 0.00 0.00 41.96 43.03 2qee s TYR 219 CO 0.74 -1.03 0.04 -1.64 -1.52 0.00 0.00 175.55 172.14 2qee s MET 220 N -3.82 3.33 0.07 -3.49 -1.94 -0.56 -1.07 119.30 111.82 2qee s MET 220 Ca 0.06 -0.35 0.05 0.00 -1.71 0.00 0.00 55.69 53.74 2qee s MET 220 Cb -0.03 -2.96 -0.03 0.00 2.01 0.00 0.00 34.83 33.81 2qee s MET 220 CO -0.04 0.59 -0.14 0.00 -0.01 0.00 0.00 175.02 175.42 2qee s ALA 221 N -0.54 1.20 -0.04 3.03 0.00 -0.11 0.10 121.76 125.39 2qee s ALA 221 Ca 0.10 -0.98 -0.13 0.00 0.00 0.00 0.00 51.96 50.95 2qee s ALA 221 Cb -0.12 -0.12 0.02 0.00 0.00 0.00 0.00 23.12 22.91 2qee s ALA 221 CO 0.02 0.18 0.29 0.54 0.00 0.00 0.00 175.76 176.79 2qee s VAL 222 N -1.20 0.05 -0.10 0.00 0.11 -0.51 -0.72 120.40 118.02 2qee s VAL 222 Ca -0.01 -0.38 -0.04 0.00 -2.93 0.00 0.00 61.98 58.62 2qee s VAL 222 Cb -0.10 -0.55 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 2qee s VAL 222 CO 0.02 -0.21 0.05 -0.44 -3.33 0.00 0.00 175.10 171.19 2qee s SER 223 N -0.97 5.61 0.04 3.54 0.01 -1.26 -0.90 113.70 119.77 2qee s SER 223 Ca -0.10 0.25 0.03 0.00 1.31 0.00 0.00 55.95 57.43 2qee s SER 223 Cb -0.05 -1.68 -0.02 0.00 0.21 0.00 0.00 66.02 64.48 2qee s SER 223 CO 0.03 0.38 -0.08 -0.76 0.41 0.00 0.00 173.24 173.22 2qee s LEU 224 N -0.89 2.24 0.82 2.44 1.43 0.13 -4.94 118.68 119.91 2qee s LEU 224 Ca 0.13 -0.52 -0.12 0.00 -1.03 0.00 0.00 54.13 52.59 2qee s LEU 224 Cb -0.12 -0.22 0.08 0.00 0.03 0.00 0.00 46.19 45.97 2qee s LEU 224 CO 0.03 -0.17 1.16 -2.16 0.23 0.00 0.00 176.35 175.44 2qee s PRO 225 N -1.49 1.89 0.54 1.29 0.04 -1.25 -0.53 135.00 135.49 2qee s PRO 225 Ca -0.08 0.21 0.23 0.00 0.04 0.00 0.00 61.00 61.39 2qee s PRO 225 Cb -0.09 -1.93 1.42 0.00 0.04 0.00 0.00 34.50 33.94 2qee s PRO 225 CO 0.01 -1.66 2.09 -1.35 0.04 0.00 0.00 177.00 176.12 2qee h PRO 226 N -1.11 0.00 -0.00 0.56 0.11 -1.77 -1.27 132.00 128.53 2qee h PRO 226 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2qee h PRO 226 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2qee h PRO 226 CO 0.65 0.00 -0.00 0.25 -0.21 0.00 0.00 178.00 178.68 2qee n THR 227 N -4.30 0.00 -1.61 -1.15 -2.24 -1.26 -3.90 114.28 99.82 2qee n THR 227 Ca 0.02 -0.02 -0.55 0.00 -2.27 0.00 0.00 64.05 61.23 2qee n THR 227 Cb 0.32 -0.42 -0.07 0.00 -2.10 0.00 0.00 70.33 68.05 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 -0.96 1.52 -4.02 4.78 7.35 -0.48 -4.98 117.46 120.68 2qee n PHE 228 Ca 0.22 0.71 -0.09 0.00 -0.76 0.00 0.00 57.45 57.53 2qee n PHE 228 Cb 0.15 -2.32 -0.11 0.00 0.35 0.00 0.00 39.48 37.55 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 1.27 0.40 -0.25 -2.13 1.04 -1.26 -4.71 113.70 108.06 2qee s SER 229 Ca 0.90 -0.62 -0.18 0.00 0.48 0.00 0.00 55.95 56.52 2qee s SER 229 Cb -1.06 0.11 0.07 0.00 0.10 0.00 0.00 66.02 65.24 2qee s SER 229 CO 0.55 -0.35 0.63 0.12 0.98 0.00 0.00 173.24 175.17 2qee s PHE 230 N -2.01 -0.84 0.80 5.02 2.19 -1.26 -4.42 117.98 117.47 2qee s PHE 230 Ca -0.10 1.84 -0.13 0.00 0.33 0.00 0.00 56.93 58.87 2qee s PHE 230 Cb -0.06 0.40 0.08 0.00 -1.31 0.00 0.00 43.02 42.13 2qee s PHE 230 CO -0.03 -0.42 1.20 -2.14 1.83 0.00 0.00 175.22 175.67 2qee s PRO 231 N 0.99 1.65 -0.17 10.12 0.02 -1.26 -4.23 135.00 142.11 2qee s PRO 231 Ca -0.05 1.75 -0.14 0.00 0.02 0.00 0.00 61.00 62.58 2qee s PRO 231 Cb -0.05 -1.78 0.05 0.00 0.02 0.00 0.00 34.50 32.74 2qee s PRO 231 CO -0.09 -2.20 0.45 -2.00 -0.33 0.00 0.00 177.00 172.83 2qee s GLU 232 N -4.14 0.50 -1.25 5.54 2.12 -1.26 -5.07 118.70 115.13 2qee s GLU 232 Ca 0.73 0.68 -0.16 0.00 0.36 0.00 0.00 54.97 56.59 2qee s GLU 232 Cb -0.28 0.18 0.12 0.00 0.26 0.00 0.00 34.13 34.41 2qee s GLU 232 CO 0.50 -0.09 1.58 0.39 -0.54 0.00 0.00 175.26 177.11 2qee n GLU 233 N 3.23 3.29 -4.01 4.30 -0.58 -1.26 -3.87 120.64 121.75 2qee n GLU 233 Ca -0.16 -3.58 -0.10 0.00 -0.42 0.00 0.00 57.16 52.90 2qee n GLU 233 Cb 0.57 -3.25 -0.07 0.00 -0.57 0.00 0.00 31.44 28.12 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 3.47 -0.01 0.19 1.62 1.04 -1.26 -5.00 113.70 113.75 2qee s SER 234 Ca 0.48 -0.96 -0.11 0.00 0.48 0.00 0.00 55.95 55.84 2qee s SER 234 Cb 0.00 0.49 0.19 0.00 0.10 0.00 0.00 66.02 66.81 2qee s SER 234 CO 0.04 -0.99 1.79 0.78 0.98 0.00 0.00 173.24 175.84 2qee h ASN 235 N 2.42 0.42 -0.16 7.02 2.35 -1.91 -0.91 115.58 124.82 2qee h ASN 235 Ca -0.30 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 2qee h ASN 235 Cb 1.24 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.56 2qee h ASN 235 CO 0.43 0.28 0.10 -0.09 -1.65 0.00 0.00 177.43 176.50 2qee h ARG 236 N 0.56 0.21 -0.74 0.81 2.43 -1.90 0.86 114.38 116.61 2qee h ARG 236 Ca 0.26 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.36 2qee h ARG 236 Cb 0.18 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 2qee h ARG 236 CO -0.18 0.17 0.26 0.78 -1.51 0.00 0.00 179.97 179.49 2qee h GLY 237 N 0.19 1.21 0.76 2.80 0.00 -1.60 -1.15 103.07 105.28 2qee h GLY 237 Ca 0.06 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.67 2qee h GLY 237 CO -0.01 0.65 -0.03 3.21 0.00 0.00 0.00 176.54 180.36 2qee h ARG 238 N 1.09 0.27 -0.61 4.80 3.08 -1.04 -1.93 114.38 120.05 2qee h ARG 238 Ca 0.24 -0.10 0.01 0.00 0.07 0.00 0.00 59.98 60.20 2qee h ARG 238 Cb 0.26 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 2qee h ARG 238 CO -0.01 0.55 0.40 0.82 -1.07 0.00 0.00 179.97 180.66 2qee h ILE 239 N -0.03 1.15 -0.27 2.04 2.04 -0.72 0.20 117.51 121.92 2qee h ILE 239 Ca 0.04 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.65 2qee h ILE 239 Cb 0.44 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 2qee h ILE 239 CO 0.01 0.15 0.09 0.40 0.00 0.00 0.00 178.15 178.80 2qee h ILE 240 N 0.82 0.92 -0.13 -0.67 2.04 -1.25 -0.04 117.51 119.19 2qee h ILE 240 Ca 0.23 -0.07 -0.06 0.00 1.00 0.00 0.00 64.86 65.95 2qee h ILE 240 Cb -0.09 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2qee h ILE 240 CO -0.05 0.04 -0.17 -0.09 0.00 0.00 0.00 178.15 177.88 2qee h ARG 241 N 0.21 0.35 0.00 2.37 2.43 -0.88 -1.21 114.38 117.64 2qee h ARG 241 Ca 0.12 -0.20 -0.07 0.00 -0.81 0.00 0.00 59.98 59.02 2qee h ARG 241 Cb 0.10 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 2qee h ARG 241 CO -0.13 0.76 -1.49 -0.25 -1.51 0.00 0.00 179.97 177.35 2qee n ASP 242 N -4.54 0.56 0.04 -3.80 8.00 0.67 -4.53 116.55 112.95 2qee n ASP 242 Ca -0.06 0.23 -0.00 0.00 0.71 0.00 0.00 54.79 55.66 2qee n ASP 242 Cb 0.38 0.83 -0.00 0.00 -0.02 0.00 0.00 41.12 42.31 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 -0.05 -0.63 -0.15 0.00 7.12 -1.05 -2.46 115.31 118.10 2qee h LEU 244 Ca -0.00 -0.04 -0.00 0.00 0.13 0.00 0.00 57.88 57.97 2qee h LEU 244 Cb 0.14 0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 40.42 2qee h LEU 244 CO -0.00 -0.34 0.09 -0.07 -0.13 0.00 0.00 178.44 177.99 2qee h LEU 245 N -0.90 0.18 -0.52 2.25 3.38 -1.46 0.95 115.31 119.19 2qee h LEU 245 Ca -0.08 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2qee h LEU 245 Cb 0.62 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 2qee h LEU 245 CO 0.12 0.16 0.25 -0.65 0.09 0.00 0.00 178.44 178.42 2qee h PRO 246 N 0.18 0.47 -0.26 1.13 0.11 -1.79 0.21 132.00 132.05 2qee h PRO 246 Ca 0.05 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.13 2qee h PRO 246 Cb 0.02 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.01 2qee h PRO 246 CO -0.01 0.31 0.14 0.28 -0.21 0.00 0.00 178.00 178.51 2qee h VAL 247 N 0.48 1.13 -0.92 3.15 2.07 -1.22 -0.49 116.25 120.45 2qee h VAL 247 Ca 0.23 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.43 2qee h VAL 247 Cb 0.16 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 2qee h VAL 247 CO -0.17 0.13 0.60 0.00 0.02 0.00 0.00 177.57 178.15 2qee h ALA 248 N 1.01 1.20 -0.01 1.67 0.00 -0.40 -1.56 119.26 121.17 2qee h ALA 248 Ca 0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2qee h ALA 248 Cb 0.08 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 2qee h ALA 248 CO -0.01 0.50 0.00 1.49 0.00 0.00 0.00 179.25 181.23 2qee h GLU 249 N 1.19 0.02 -0.77 0.00 4.81 -0.31 0.21 114.58 119.73 2qee h GLU 249 Ca 0.36 -0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.63 2qee h GLU 249 Cb -0.05 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 2qee h GLU 249 CO -0.10 0.19 0.48 -0.22 -0.73 0.00 0.00 179.01 178.62 2qee h LYS 250 N -0.16 0.87 -0.01 1.92 3.64 -0.77 -1.86 116.57 120.20 2qee h LYS 250 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2qee h LYS 250 Cb 0.18 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2qee h LYS 250 CO -0.00 0.58 -0.19 0.72 -2.27 0.00 0.00 179.45 178.29 2qee n HIS 251 N -4.65 0.00 -3.71 1.91 8.25 -0.62 -4.95 115.22 111.46 2qee n HIS 251 Ca 0.10 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.32 2qee n HIS 251 Cb 0.13 -0.13 0.05 0.00 1.12 0.00 0.00 29.99 31.16 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 -0.66 -3.60 -4.53 0.41 4.05 0.56 -4.99 115.26 106.51 2qee n ASN 252 Ca 0.13 -0.72 -0.34 0.00 0.45 0.00 0.00 54.58 54.11 2qee n ASN 252 Cb 0.33 -4.38 -0.11 0.00 1.23 0.00 0.00 39.78 36.84 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 -3.43 4.22 0.69 -1.44 -1.09 -0.25 -4.86 121.20 115.05 2qee s ILE 253 Ca 0.34 -0.23 -0.16 0.00 -2.23 0.00 0.00 60.65 58.37 2qee s ILE 253 Cb -0.16 -2.88 0.02 0.00 -1.58 0.00 0.00 42.46 37.85 2qee s ILE 253 CO 0.79 0.46 1.18 -2.84 -1.23 0.00 0.00 174.94 173.30 2qee s PRO 254 N 0.54 2.43 -0.30 2.79 0.02 -1.26 -4.61 135.00 134.61 2qee s PRO 254 Ca -0.00 1.67 -0.09 0.00 0.02 0.00 0.00 61.00 62.59 2qee s PRO 254 Cb -0.14 -1.88 -0.01 0.00 0.02 0.00 0.00 34.50 32.50 2qee s PRO 254 CO 0.02 -1.59 0.13 0.12 -0.33 0.00 0.00 177.00 175.35 2qee s PHE 255 N -2.03 3.16 -0.19 6.54 5.36 -0.47 -1.50 117.98 128.86 2qee s PHE 255 Ca 0.73 -0.60 -0.15 0.00 -0.96 0.00 0.00 56.93 55.94 2qee s PHE 255 Cb -0.27 -2.33 -0.04 0.00 -0.34 0.00 0.00 43.02 40.04 2qee s PHE 255 CO 0.42 -0.46 0.35 0.00 -1.46 0.00 0.00 175.22 174.08 2qee s ALA 256 N 1.60 3.56 -0.16 11.12 0.00 0.11 -1.53 121.76 136.46 2qee s ALA 256 Ca 0.05 -0.51 0.01 0.00 0.00 0.00 0.00 51.96 51.51 2qee s ALA 256 Cb -0.17 -2.54 0.01 0.00 0.00 0.00 0.00 23.12 20.42 2qee s ALA 256 CO 0.05 -0.15 -0.19 -1.64 0.00 0.00 0.00 175.76 173.83 2qee s MET 257 N 0.99 3.07 -0.40 0.00 1.00 0.86 -1.43 119.30 123.38 2qee s MET 257 Ca 0.18 -0.81 -0.08 0.00 0.00 0.00 0.00 55.69 54.97 2qee s MET 257 Cb -0.14 -2.55 0.07 0.00 0.00 0.00 0.00 34.83 32.21 2qee s MET 257 CO 0.07 -0.09 0.23 -1.64 0.00 0.00 0.00 175.02 173.59 2qee s MET 258 N 1.02 2.57 -0.12 2.03 -1.94 -0.08 -2.42 119.30 120.36 2qee s MET 258 Ca -0.02 -1.43 -0.01 0.00 -1.71 0.00 0.00 55.69 52.52 2qee s MET 258 Cb -0.15 -3.72 -0.02 0.00 2.01 0.00 0.00 34.83 32.96 2qee s MET 258 CO -0.06 -0.91 -0.09 0.42 -0.01 0.00 0.00 175.02 174.38 2qee s ILE 259 N 1.40 3.47 0.00 2.53 1.01 -0.33 -0.69 121.20 128.60 2qee s ILE 259 Ca 0.03 -0.53 0.00 0.00 0.00 0.00 0.00 60.65 60.15 2qee s ILE 259 Cb -0.22 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.78 2qee s ILE 259 CO 0.02 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.10 2qee n GLY 260 N 3.14 0.31 3.71 6.18 0.00 0.31 -0.41 105.19 118.43 2qee n GLY 260 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.82 4.97 -0.39 1.61 0.11 -1.07 -1.69 120.40 123.12 2qee s VAL 261 Ca 0.00 1.68 -0.11 0.00 -2.93 0.00 0.00 61.98 60.61 2qee s VAL 261 Cb 0.00 -4.15 0.04 0.00 -1.53 0.00 0.00 36.38 30.74 2qee s VAL 261 CO 0.00 0.19 0.24 -0.75 -3.33 0.00 0.00 175.10 171.45 2qee s LYS 262 N 1.05 2.81 0.30 1.54 2.20 -0.54 -3.87 119.74 123.22 2qee s LYS 262 Ca 0.43 -1.15 -0.23 0.00 -0.36 0.00 0.00 55.97 54.66 2qee s LYS 262 Cb -0.19 -3.79 -0.09 0.00 -1.51 0.00 0.00 37.83 32.25 2qee s LYS 262 CO 0.21 -0.77 0.85 0.15 -0.36 0.00 0.00 175.35 175.43 2qee s LYS 263 N 1.55 4.40 -1.31 4.03 -0.14 -1.26 0.08 119.74 127.09 2qee s LYS 263 Ca 0.02 1.11 -0.06 0.00 -1.36 0.00 0.00 55.97 55.68 2qee s LYS 263 Cb -0.20 -2.75 0.01 0.00 -1.68 0.00 0.00 37.83 33.21 2qee s LYS 263 CO 0.06 0.29 1.11 0.54 -0.76 0.00 0.00 175.35 176.59 2qee n ARG 264 N 0.45 -7.38 0.24 1.68 1.74 -1.21 -4.87 116.66 107.31 2qee n ARG 264 Ca 0.01 0.82 0.15 0.00 -0.77 0.00 0.00 57.85 58.06 2qee n ARG 264 Cb 0.51 -5.85 0.47 0.00 -1.02 0.00 0.00 32.46 26.57 2qee n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 2qee h VAL 265 N -2.40 0.00 -2.45 1.55 -1.51 -1.06 -3.35 116.25 107.03 2qee h VAL 265 Ca -0.58 -0.68 -0.59 0.00 -1.23 0.00 0.00 66.70 63.62 2qee h VAL 265 Cb 1.36 1.66 -0.38 0.00 -2.13 0.00 0.00 31.29 31.80 2qee h VAL 265 CO 0.54 0.00 -0.93 -2.28 -1.23 0.00 0.00 177.57 173.67 2qee s HIS 266 N -3.45 1.30 0.43 5.19 5.65 -1.02 -5.02 115.29 118.37 2qee s HIS 266 Ca 0.04 -2.39 0.15 0.00 0.25 0.00 0.00 55.06 53.12 2qee s HIS 266 Cb 0.08 -1.09 1.05 0.00 -1.18 0.00 0.00 32.58 31.44 2qee s HIS 266 CO 0.58 -0.80 1.93 -1.35 -0.65 0.00 0.00 174.74 174.46 2qee h PRO 267 N 5.70 0.40 -0.04 2.88 0.11 -1.84 -1.09 132.00 138.12 2qee h PRO 267 Ca 0.24 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.34 2qee h PRO 267 Cb 0.90 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.92 2qee h PRO 267 CO 0.40 0.27 0.04 0.00 -0.21 0.00 0.00 178.00 178.49 2qee h ALA 268 N 1.66 1.66 -0.00 -0.75 0.00 -1.95 -1.37 119.26 118.50 2qee h ALA 268 Ca 0.35 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2qee h ALA 268 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2qee h ALA 268 CO -0.11 -0.06 -0.01 1.28 0.00 0.00 0.00 179.25 180.35 2qee n LEU 269 N -3.95 0.09 0.00 0.00 4.77 -0.41 -4.98 117.00 112.52 2qee n LEU 269 Ca -0.02 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2qee n LEU 269 Cb 0.13 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2qee n LEU 269 CO 0.28 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 2qee n GLY 270 N 1.17 3.70 0.35 -0.72 0.00 -0.52 -1.47 105.19 107.70 2qee n GLY 270 Ca 0.18 -0.07 0.18 0.00 0.00 0.00 0.00 46.02 46.30 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 0.00 0.00 -0.00 1.61 3.32 -1.93 0.18 116.42 119.60 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 -2.52 2.58 -0.42 3.45 0.00 -0.54 -4.14 120.51 118.92 2qee n ALA 272 Ca 0.05 -0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.51 2qee n ALA 272 Cb 0.46 -1.23 0.33 0.00 0.00 0.00 0.00 19.45 19.00 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 0.73 2.57 3.88 0.00 0.00 0.64 -4.83 105.19 108.19 2qee n GLY 273 Ca 0.11 -0.79 -0.34 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 6.52 0.00 1.61 1.01 -1.26 -0.63 116.67 122.93 2qee s ASP 274 Ca 0.49 0.59 0.00 0.00 0.71 0.00 0.00 52.55 54.34 2qee s ASP 274 Cb 0.27 -2.10 0.00 0.00 1.01 0.00 0.00 42.92 42.10 2qee s ASP 274 CO 0.31 0.22 0.00 0.33 0.21 0.00 0.00 175.17 176.24 2qee n PHE 275 N 0.99 -0.08 -4.08 4.23 7.35 0.11 -4.93 117.46 121.05 2qee n PHE 275 Ca -0.10 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.49 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 -0.53 0.41 0.09 -2.13 0.11 -1.26 -1.46 120.40 115.62 2qee s VAL 276 Ca 0.00 -1.48 -0.13 0.00 -2.93 0.00 0.00 61.98 57.44 2qee s VAL 276 Cb 0.00 -1.09 0.02 0.00 -1.53 0.00 0.00 36.38 33.78 2qee s VAL 276 CO 0.00 -0.71 0.29 -0.83 -3.33 0.00 0.00 175.10 170.52 2qee s GLY 277 N -2.33 -0.09 0.22 6.54 0.00 -0.68 -4.83 107.32 106.15 2qee s GLY 277 Ca -0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 44.72 44.15 2qee s GLY 277 CO -0.04 -0.49 1.26 1.25 0.00 0.00 0.00 173.10 175.08 2qee s LYS 278 N -3.54 4.44 0.22 2.90 2.20 -1.26 -4.42 119.74 120.28 2qee s LYS 278 Ca 0.02 2.00 0.05 0.00 -0.36 0.00 0.00 55.97 57.68 2qee s LYS 278 Cb 0.02 -3.19 -0.03 0.00 -1.51 0.00 0.00 37.83 33.12 2qee s LYS 278 CO -0.10 -0.16 0.26 0.00 -0.36 0.00 0.00 175.35 175.00 2qee s ALA 279 N -0.18 3.78 0.38 3.13 0.00 -1.26 -4.76 121.76 122.85 2qee s ALA 279 Ca 0.54 -1.25 -0.26 0.00 0.00 0.00 0.00 51.96 50.98 2qee s ALA 279 Cb -0.35 -1.56 -0.09 0.00 0.00 0.00 0.00 23.12 21.12 2qee s ALA 279 CO 0.40 0.33 1.20 0.45 0.00 0.00 0.00 175.76 178.14 2qee s SER 280 N -3.68 6.61 0.00 0.00 0.15 -1.25 -4.94 113.70 110.58 2qee s SER 280 Ca 0.33 2.44 0.28 0.00 0.70 0.00 0.00 55.95 59.70 2qee s SER 280 Cb -0.09 -2.62 1.11 0.00 -1.71 0.00 0.00 66.02 62.71 2qee s SER 280 CO 0.27 -0.62 1.83 0.23 1.20 0.00 0.00 173.24 176.14 2qee n MET 281 N 0.31 0.09 -0.35 5.44 2.81 -1.26 -4.36 117.12 119.79 2qee n MET 281 Ca 0.03 -0.02 0.04 0.00 -1.81 0.00 0.00 57.70 55.94 2qee n MET 281 Cb 0.45 -1.50 0.20 0.00 -0.71 0.00 0.00 33.22 31.66 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 0.04 0.95 -0.31 7.83 3.32 -1.93 0.04 116.42 126.36 2qee h ASP 282 Ca 0.00 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 56.94 2qee h ASP 282 Cb 0.47 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 2qee h ASP 282 CO 0.00 0.56 -0.35 1.23 -1.72 0.00 0.00 179.24 178.96 2qee h GLY 283 N 1.05 0.85 1.02 2.75 0.00 -1.76 0.38 103.07 107.38 2qee h GLY 283 Ca 0.45 -0.90 -0.08 0.00 0.00 0.00 0.00 47.33 46.80 2qee h GLY 283 CO -0.22 0.81 -0.01 -2.08 0.00 0.00 0.00 176.54 175.05 2qee h VAL 284 N 0.55 1.26 -0.03 4.60 2.07 -1.71 -1.15 116.25 121.84 2qee h VAL 284 Ca 0.04 -1.10 0.01 0.00 0.82 0.00 0.00 66.70 66.47 2qee h VAL 284 Cb 0.93 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2qee h VAL 284 CO 0.08 0.39 -0.02 -0.08 0.02 0.00 0.00 177.57 177.96 2qee h GLU 285 N 0.78 -0.02 -0.09 1.57 4.81 -0.85 -1.28 114.58 119.50 2qee h GLU 285 Ca 0.15 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.40 2qee h GLU 285 Cb 0.53 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 2qee h GLU 285 CO 0.03 -0.01 -0.07 1.25 -0.73 0.00 0.00 179.01 179.47 2qee h HIS 286 N -0.02 -0.17 -0.54 0.92 2.76 -0.80 -1.42 115.15 115.89 2qee h HIS 286 Ca 0.02 0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.31 2qee h HIS 286 Cb 0.05 0.09 -0.09 0.00 1.55 0.00 0.00 27.41 29.01 2qee h HIS 286 CO -0.11 -0.11 -0.04 -0.07 -1.30 0.00 0.00 177.93 176.30 2qee h LEU 287 N -0.08 -0.31 -0.54 0.26 3.38 -1.02 -0.02 115.31 116.98 2qee h LEU 287 Ca 0.06 0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 2qee h LEU 287 Cb 0.17 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2qee h LEU 287 CO -0.14 -0.11 0.05 -0.07 0.09 0.00 0.00 178.44 178.25 2qee h LEU 288 N 0.08 0.89 -0.04 1.67 3.38 -0.95 -1.63 115.31 118.71 2qee h LEU 288 Ca 0.27 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2qee h LEU 288 Cb 0.42 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2qee h LEU 288 CO -0.48 0.95 -0.07 -0.09 0.09 0.00 0.00 178.44 178.84 2qee h ARG 289 N 0.79 0.11 0.00 1.13 2.43 -0.96 -3.35 114.38 114.54 2qee h ARG 289 Ca 0.16 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2qee h ARG 289 Cb 0.47 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2qee h ARG 289 CO 0.02 0.64 -0.17 0.39 -1.51 0.00 0.00 179.97 179.34 2qee n GLU 290 N -4.72 0.28 -3.19 0.20 -0.58 -0.05 -4.13 120.64 108.45 2qee n GLU 290 Ca -0.08 0.19 -0.26 0.00 -0.42 0.00 0.00 57.16 56.59 2qee n GLU 290 Cb 0.32 -1.78 -0.06 0.00 -0.57 0.00 0.00 31.44 29.35 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 -2.24 2.87 0.32 -0.32 4.01 -0.62 -4.94 117.16 116.24 2qee n TYR 291 Ca 0.05 -3.98 0.16 0.00 -0.16 0.00 0.00 57.90 53.96 2qee n TYR 291 Cb 0.44 -0.49 0.68 0.00 -0.31 0.00 0.00 39.34 39.66 2qee n TYR 291 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2qee h PRO 292 N 3.59 0.00 -0.22 -0.72 0.13 -1.72 -1.08 132.00 131.98 2qee h PRO 292 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2qee h PRO 292 Cb 0.67 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.80 2qee h PRO 292 CO 0.74 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.60 2qee n ASN 293 N -2.75 2.52 -4.79 1.44 5.03 -1.26 -4.87 115.26 110.57 2qee n ASN 293 Ca 0.00 -1.84 -0.29 0.00 0.87 0.00 0.00 54.58 53.33 2qee n ASN 293 Cb 0.23 -0.14 -0.06 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 -1.63 5.55 0.07 6.41 -0.87 -0.41 -4.76 114.94 119.31 2qee s ASN 294 Ca 0.35 -0.05 0.06 0.00 -1.57 0.00 0.00 52.86 51.65 2qee s ASN 294 Cb 0.20 -1.48 -0.04 0.00 -0.02 0.00 0.00 41.25 39.91 2qee s ASN 294 CO 0.29 0.13 -0.08 -0.54 -2.57 0.00 0.00 177.10 174.33 2qee s LYS 295 N -2.68 2.29 -0.04 -0.60 1.02 -1.26 -4.85 119.74 113.62 2qee s LYS 295 Ca 0.30 -0.92 0.00 0.00 0.02 0.00 0.00 55.97 55.38 2qee s LYS 295 Cb -0.11 -2.38 0.03 0.00 -0.52 0.00 0.00 37.83 34.84 2qee s LYS 295 CO 0.23 0.54 -0.01 -0.06 -0.92 0.00 0.00 175.35 175.13 2qee s PHE 296 N -1.15 0.47 -0.20 3.18 0.08 -0.24 -1.37 117.98 118.74 2qee s PHE 296 Ca 0.20 -0.07 -0.09 0.00 0.12 0.00 0.00 56.93 57.09 2qee s PHE 296 Cb -0.11 -0.53 -0.05 0.00 -0.57 0.00 0.00 43.02 41.76 2qee s PHE 296 CO 0.12 -0.17 0.11 -0.51 -0.10 0.00 0.00 175.22 174.67 2qee s LEU 297 N 1.14 4.07 -0.02 -0.37 1.43 -0.58 -0.82 118.68 123.53 2qee s LEU 297 Ca -0.08 0.17 0.01 0.00 -1.03 0.00 0.00 54.13 53.20 2qee s LEU 297 Cb -0.14 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.04 2qee s LEU 297 CO -0.02 0.17 -0.04 -0.69 0.23 0.00 0.00 176.35 176.00 2qee s VAL 298 N 0.43 0.40 0.03 -1.59 1.01 -0.60 -0.10 120.40 119.98 2qee s VAL 298 Ca 0.06 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.91 2qee s VAL 298 Cb -0.12 -0.38 -0.02 0.00 0.00 0.00 0.00 36.38 35.87 2qee s VAL 298 CO -0.01 0.14 -0.08 0.28 0.00 0.00 0.00 175.10 175.44 2qee s THR 299 N 0.26 0.58 0.12 3.92 -1.32 -1.02 -1.73 115.64 116.45 2qee s THR 299 Ca -0.03 -0.81 0.07 0.00 -1.21 0.00 0.00 61.69 59.72 2qee s THR 299 Cb -0.06 -0.58 -0.04 0.00 -1.51 0.00 0.00 72.50 70.31 2qee s THR 299 CO -0.00 -0.18 -0.17 -0.04 -2.21 0.00 0.00 174.62 172.02 2qee s MET 300 N -1.08 1.11 -0.01 7.08 -1.94 -1.26 -1.18 119.30 122.02 2qee s MET 300 Ca -0.05 -1.24 0.15 0.00 -1.71 0.00 0.00 55.69 52.84 2qee s MET 300 Cb -0.07 -1.17 -0.20 0.00 2.01 0.00 0.00 34.83 35.41 2qee s MET 300 CO 0.00 0.25 0.69 -0.11 -0.01 0.00 0.00 175.02 175.84 2qee n LEU 301 N 0.69 0.82 -4.76 -0.03 7.94 0.45 -4.62 117.00 117.49 2qee n LEU 301 Ca -0.16 0.38 -0.40 0.00 -1.11 0.00 0.00 56.01 54.72 2qee n LEU 301 Cb 0.56 0.15 -0.06 0.00 0.53 0.00 0.00 43.42 44.60 2qee n LEU 301 CO 0.26 0.29 0.52 -0.55 -1.11 0.00 0.00 177.39 176.80 2qee s SER 302 N -5.92 7.40 0.31 1.96 0.15 -1.26 -4.52 113.70 111.82 2qee s SER 302 Ca -0.04 1.66 0.04 0.00 0.70 0.00 0.00 55.95 58.31 2qee s SER 302 Cb 0.08 -2.52 0.63 0.00 -1.71 0.00 0.00 66.02 62.51 2qee s SER 302 CO 0.82 0.15 1.87 -0.09 1.20 0.00 0.00 173.24 177.19 2qee h ARG 303 N 4.63 0.88 0.00 5.44 2.43 -1.95 -1.98 114.38 123.83 2qee h ARG 303 Ca -0.46 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 2qee h ARG 303 Cb 1.21 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2qee h ARG 303 CO 0.68 0.58 0.00 0.39 -1.51 0.00 0.00 179.97 180.11 2qee n GLU 304 N -4.55 0.50 0.01 0.20 4.71 -1.26 -2.40 120.64 117.86 2qee n GLU 304 Ca 0.16 0.02 0.11 0.00 -0.01 0.00 0.00 57.16 57.45 2qee n GLU 304 Cb 0.33 -1.50 0.11 0.00 -1.01 0.00 0.00 31.44 29.37 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 -1.22 0.64 -0.05 1.62 5.03 -0.74 -4.67 115.26 115.86 2qee n ASN 305 Ca 0.15 -0.35 -0.14 0.00 0.87 0.00 0.00 54.58 55.11 2qee n ASN 305 Cb 0.19 0.54 -0.08 0.00 -1.02 0.00 0.00 39.78 39.42 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 0.41 -0.25 3.52 1.08 -1.56 -1.29 115.11 117.03 2qee h GLN 306 Ca 0.00 -0.27 -0.02 0.00 -1.45 0.00 0.00 58.65 56.92 2qee h GLN 306 Cb 0.59 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 2qee h GLN 306 CO 0.00 0.86 0.08 1.25 -0.95 0.00 0.00 178.83 180.08 2qee h HIS 307 N 0.01 0.40 0.00 2.96 2.76 -1.83 -2.18 115.15 117.27 2qee h HIS 307 Ca 0.01 -0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.06 2qee h HIS 307 Cb 0.85 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.68 2qee h HIS 307 CO 0.10 0.44 -0.34 1.05 -1.30 0.00 0.00 177.93 177.88 2qee h GLU 308 N 0.24 0.00 -0.85 5.26 4.11 -1.84 -1.72 114.58 119.78 2qee h GLU 308 Ca 0.08 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.48 2qee h GLU 308 Cb 0.23 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 2qee h GLU 308 CO -0.00 0.34 0.40 1.25 0.07 0.00 0.00 179.01 181.07 2qee h LEU 309 N 0.00 1.11 -0.65 3.06 5.85 -0.93 -0.50 115.31 123.25 2qee h LEU 309 Ca -0.00 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.60 2qee h LEU 309 Cb 0.65 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 2qee h LEU 309 CO 0.04 0.94 0.41 0.58 -0.34 0.00 0.00 178.44 180.07 2qee h VAL 310 N 1.21 1.11 -0.71 1.05 2.07 -0.72 -1.41 116.25 118.84 2qee h VAL 310 Ca 0.29 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 2qee h VAL 310 Cb 0.12 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.08 2qee h VAL 310 CO -0.04 0.15 0.28 0.58 0.02 0.00 0.00 177.57 178.56 2qee h VAL 311 N 0.82 1.24 -0.29 2.57 2.07 -0.94 -1.97 116.25 119.74 2qee h VAL 311 Ca 0.25 -0.77 -0.10 0.00 0.82 0.00 0.00 66.70 66.90 2qee h VAL 311 Cb -0.02 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 2qee h VAL 311 CO -0.09 0.31 -0.22 0.25 0.02 0.00 0.00 177.57 177.84 2qee h LEU 312 N 1.04 0.56 -1.23 2.57 5.85 -0.57 -1.29 115.31 122.24 2qee h LEU 312 Ca 0.24 -0.19 0.04 0.00 0.84 0.00 0.00 57.88 58.82 2qee h LEU 312 Cb 0.21 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.04 2qee h LEU 312 CO -0.02 0.78 0.54 0.00 -0.34 0.00 0.00 178.44 179.40 2qee h ALA 313 N 1.26 1.52 -0.36 1.25 0.00 -0.56 -1.22 119.26 121.16 2qee h ALA 313 Ca 0.07 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2qee h ALA 313 Cb 0.66 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2qee h ALA 313 CO 0.05 0.38 0.24 0.00 0.00 0.00 0.00 179.25 179.92 2qee h ARG 314 N 0.98 0.27 0.01 0.00 3.08 -0.61 -2.99 114.38 115.12 2qee h ARG 314 Ca 0.33 -0.02 -0.21 0.00 0.07 0.00 0.00 59.98 60.16 2qee h ARG 314 Cb 0.08 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 2qee h ARG 314 CO -0.10 0.18 -0.99 0.87 -1.07 0.00 0.00 179.97 178.86 2qee h LYS 315 N 0.28 0.03 -3.46 0.04 1.79 -0.91 -3.45 116.57 110.89 2qee h LYS 315 Ca 0.16 -0.05 -0.45 0.00 -2.18 0.00 0.00 60.65 58.12 2qee h LYS 315 Cb 0.27 0.02 -0.39 0.00 -1.58 0.00 0.00 32.23 30.54 2qee h LYS 315 CO -0.03 0.99 -0.76 -0.06 -1.08 0.00 0.00 179.45 178.51 2qee s PHE 316 N -2.79 0.57 -0.11 -1.35 0.08 -0.95 -5.01 117.98 108.43 2qee s PHE 316 Ca 0.00 -0.32 0.30 0.00 0.12 0.00 0.00 56.93 57.03 2qee s PHE 316 Cb 0.10 -0.79 1.26 0.00 -0.57 0.00 0.00 43.02 43.02 2qee s PHE 316 CO 0.82 -0.42 1.89 0.66 -0.10 0.00 0.00 175.22 178.07 2qee h SER 317 N 8.34 0.00 -0.12 1.36 4.64 -1.89 -2.39 113.55 123.50 2qee h SER 317 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2qee h SER 317 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2qee h SER 317 CO 0.27 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.77 2qee n ASN 318 N -2.75 0.76 -4.53 4.97 6.94 -1.26 -4.72 115.26 114.68 2qee n ASN 318 Ca 0.01 -1.81 -0.35 0.00 -0.02 0.00 0.00 54.58 52.41 2qee n ASN 318 Cb 0.26 -0.08 -0.11 0.00 -2.36 0.00 0.00 39.78 37.49 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 -1.24 3.51 -0.19 -4.53 2.96 -0.90 -1.08 118.68 117.21 2qee s LEU 319 Ca 0.18 -0.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.02 2qee s LEU 319 Cb 0.09 -1.89 0.02 0.00 0.50 0.00 0.00 46.19 44.91 2qee s LEU 319 CO 0.14 0.11 -0.17 -0.32 -1.32 0.00 0.00 176.35 174.79 2qee s MET 320 N 0.75 3.05 0.10 1.98 -2.45 -0.00 -4.93 119.30 117.79 2qee s MET 320 Ca 0.02 -0.80 -0.08 0.00 -1.25 0.00 0.00 55.69 53.58 2qee s MET 320 Cb -0.14 -2.67 -0.06 0.00 1.25 0.00 0.00 34.83 33.22 2qee s MET 320 CO 0.02 -0.21 0.38 0.96 1.05 0.00 0.00 175.02 177.22 2qee s ILE 321 N 1.32 5.14 -0.05 10.11 -4.36 -1.26 -1.55 121.20 130.55 2qee s ILE 321 Ca 0.05 0.26 -0.04 0.00 -0.26 0.00 0.00 60.65 60.66 2qee s ILE 321 Cb -0.13 -3.63 0.01 0.00 1.25 0.00 0.00 42.46 39.96 2qee s ILE 321 CO -0.11 0.19 0.13 0.72 0.24 0.00 0.00 174.94 176.11 2qee s PHE 322 N -1.50 -0.14 0.16 1.37 -0.12 -0.71 -2.47 117.98 114.58 2qee s PHE 322 Ca 0.36 0.34 0.00 0.00 -0.05 0.00 0.00 56.93 57.58 2qee s PHE 322 Cb -0.13 0.03 0.00 0.00 -0.63 0.00 0.00 43.02 42.29 2qee s PHE 322 CO 0.20 -0.07 0.00 0.41 -0.05 0.00 0.00 175.22 175.71 2qee n GLY 323 N 3.12 -2.10 2.92 1.99 0.00 -0.20 -4.39 105.19 106.53 2qee n GLY 323 Ca -0.14 -1.37 -0.31 0.00 0.00 0.00 0.00 46.02 44.21 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 1.12 3.50 0.00 0.00 -0.00 -1.26 -3.61 118.94 118.68 2qee s TRP 325 Ca 0.11 1.18 0.00 0.00 -0.00 0.00 0.00 56.10 57.39 2qee s TRP 325 Cb -0.19 -2.85 0.00 0.00 -0.00 0.00 0.00 33.47 30.43 2qee s TRP 325 CO -0.14 -0.05 0.00 1.87 -0.00 0.00 0.00 176.95 178.64 2qee n TRP 326 N 4.39 0.00 0.51 5.86 -0.00 -1.26 -0.42 117.44 126.53 2qee n TRP 326 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.50 57.57 2qee n TRP 326 Cb 0.50 0.00 0.33 0.00 -0.00 0.00 0.00 31.31 32.14 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 0.02 0.73 5.87 3.72 -1.26 -0.91 117.46 125.63 2qee n PHE 327 Ca 0.00 0.01 0.12 0.00 -0.05 0.00 0.00 57.45 57.53 2qee n PHE 327 Cb 0.00 -0.51 0.28 0.00 -0.94 0.00 0.00 39.48 38.31 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 -1.52 0.19 -1.60 -1.08 2.81 0.44 -4.59 117.12 111.77 2qee n MET 328 Ca 0.04 0.08 -0.31 0.00 -1.81 0.00 0.00 57.70 55.69 2qee n MET 328 Cb 0.18 -1.64 -0.05 0.00 -0.71 0.00 0.00 33.22 31.00 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 -1.93 7.12 -4.04 7.83 5.15 -0.09 -3.55 115.26 125.75 2qee n ASN 329 Ca 0.05 -3.03 -0.20 0.00 -0.60 0.00 0.00 54.58 50.79 2qee n ASN 329 Cb 0.40 -1.33 -0.15 0.00 -0.53 0.00 0.00 39.78 38.17 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 0.74 1.30 0.27 1.20 0.01 -1.26 -4.96 114.94 112.24 2qee s ASN 330 Ca 0.59 -0.20 -0.05 0.00 -0.71 0.00 0.00 52.86 52.49 2qee s ASN 330 Cb 0.28 -0.23 0.52 0.00 0.41 0.00 0.00 41.25 42.23 2qee s ASN 330 CO -0.13 0.11 1.60 -0.65 -1.51 0.00 0.00 177.10 176.51 2qee h PRO 331 N 6.08 0.04 -0.92 -0.60 0.11 -1.98 0.27 132.00 135.00 2qee h PRO 331 Ca -0.32 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.84 2qee h PRO 331 Cb 1.17 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.22 2qee h PRO 331 CO 0.49 0.02 0.60 1.49 -0.21 0.00 0.00 178.00 180.40 2qee h GLU 332 N 0.04 1.05 0.15 1.05 4.57 -1.97 -0.16 114.58 119.31 2qee h GLU 332 Ca 0.47 -0.06 -0.32 0.00 -1.18 0.00 0.00 59.36 58.28 2qee h GLU 332 Cb 0.85 -0.24 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 2qee h GLU 332 CO -0.83 0.70 -1.59 0.82 -1.18 0.00 0.00 179.01 176.92 2qee h ILE 333 N 1.08 0.97 -0.82 2.32 1.08 -1.29 -2.74 117.51 118.12 2qee h ILE 333 Ca 0.39 -2.45 0.15 0.00 -0.39 0.00 0.00 64.86 62.56 2qee h ILE 333 Cb 0.14 2.74 -0.10 0.00 -3.07 0.00 0.00 36.82 36.53 2qee h ILE 333 CO -0.14 0.79 0.39 0.40 -0.69 0.00 0.00 178.15 178.89 2qee h ILE 334 N -0.09 0.68 0.25 -0.67 2.04 -0.40 0.18 117.51 119.49 2qee h ILE 334 Ca -0.33 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 2qee h ILE 334 Cb 1.93 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 2qee h ILE 334 CO 0.12 0.10 -0.12 -1.13 0.00 0.00 0.00 178.15 177.12 2qee h ASN 335 N 0.54 -0.28 -0.66 1.72 -1.24 -1.07 -0.38 115.58 114.20 2qee h ASN 335 Ca 0.45 -0.20 0.01 0.00 0.71 0.00 0.00 56.30 57.27 2qee h ASN 335 Cb 0.68 0.07 -0.03 0.00 0.73 0.00 0.00 38.32 39.77 2qee h ASN 335 CO -0.39 0.06 0.44 1.05 -1.29 0.00 0.00 177.43 177.30 2qee h GLU 336 N -0.65 0.88 -0.14 6.67 4.11 -1.23 -1.66 114.58 122.55 2qee h GLU 336 Ca -0.03 -0.05 -0.08 0.00 0.07 0.00 0.00 59.36 59.26 2qee h GLU 336 Cb 0.46 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 2qee h GLU 336 CO 0.06 0.58 -0.21 0.52 0.07 0.00 0.00 179.01 180.03 2qee h MET 337 N 0.90 0.39 -0.49 1.06 2.86 -0.84 -1.20 114.93 117.62 2qee h MET 337 Ca 0.24 -0.23 -0.08 0.00 -2.06 0.00 0.00 59.70 57.57 2qee h MET 337 Cb -0.10 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 2qee h MET 337 CO -0.05 0.82 -0.02 1.15 1.06 0.00 0.00 176.91 179.87 2qee h THR 338 N 0.00 1.25 -0.20 2.22 2.02 -0.93 -0.19 112.91 117.07 2qee h THR 338 Ca 0.01 -1.04 -0.05 0.00 0.77 0.00 0.00 66.41 66.11 2qee h THR 338 Cb 0.78 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 2qee h THR 338 CO 0.05 0.37 -0.05 0.03 0.37 0.00 0.00 175.52 176.29 2qee h ARG 339 N 0.76 0.40 -0.87 6.66 3.08 -1.21 -0.84 114.38 122.36 2qee h ARG 339 Ca 0.14 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2qee h ARG 339 Cb 0.48 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.47 2qee h ARG 339 CO 0.02 0.65 0.49 0.52 -1.07 0.00 0.00 179.97 180.58 2qee h MET 340 N 0.12 1.21 0.13 0.04 2.86 -1.03 0.04 114.93 118.29 2qee h MET 340 Ca 0.05 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 2qee h MET 340 Cb 0.50 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.92 2qee h MET 340 CO 0.02 0.88 -0.06 0.00 1.06 0.00 0.00 176.91 178.81 2qee h ARG 341 N 1.21 -0.16 -0.57 1.72 3.08 -0.96 -2.43 114.38 116.27 2qee h ARG 341 Ca 0.31 0.01 -0.08 0.00 0.07 0.00 0.00 59.98 60.29 2qee h ARG 341 Cb 0.01 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 2qee h ARG 341 CO -0.05 0.02 0.04 1.98 -1.07 0.00 0.00 179.97 180.89 2qee h MET 342 N -0.32 0.98 -0.93 0.04 4.05 -1.03 0.26 114.93 117.99 2qee h MET 342 Ca -0.02 -0.29 0.12 0.00 -0.28 0.00 0.00 59.70 59.23 2qee h MET 342 Cb 0.26 -0.10 -0.07 0.00 -0.80 0.00 0.00 31.60 30.89 2qee h MET 342 CO 0.03 0.96 0.59 0.93 0.23 0.00 0.00 176.91 179.65 2qee h GLU 343 N 0.88 0.82 0.00 0.39 5.08 -0.92 -0.89 114.58 119.93 2qee h GLU 343 Ca 0.17 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2qee h GLU 343 Cb 0.49 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2qee h GLU 343 CO 0.02 0.54 -1.44 -1.33 -1.00 0.00 0.00 179.01 175.80 2qee n MET 344 N -4.57 0.83 0.00 2.33 2.81 -0.92 -4.60 117.12 112.99 2qee n MET 344 Ca 0.17 -0.10 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 2qee n MET 344 Cb 0.39 -1.38 0.00 0.00 -0.71 0.00 0.00 33.22 31.52 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 -1.85 0.63 0.00 4.03 4.77 0.89 -4.87 117.00 120.60 2qee n LEU 345 Ca -0.01 -0.74 0.00 0.00 -0.03 0.00 0.00 56.01 55.23 2qee n LEU 345 Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 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 0.21 4.18 1.07 -0.72 0.00 -0.34 -1.36 105.19 108.23 2qee n GLY 346 Ca 0.00 0.13 0.08 0.00 0.00 0.00 0.00 46.02 46.23 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 1.69 -1.01 2.61 -2.24 -1.26 -4.37 114.28 109.69 2qee n THR 347 Ca 0.00 -1.33 -0.15 0.00 -2.27 0.00 0.00 64.05 60.30 2qee n THR 347 Cb 0.00 0.14 -0.06 0.00 -2.10 0.00 0.00 70.33 68.31 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 0.44 5.84 -3.48 3.42 3.41 -0.46 -4.70 113.62 118.09 2qee n SER 348 Ca 0.20 -2.78 -0.11 0.00 -0.26 0.00 0.00 58.87 55.91 2qee n SER 348 Cb 0.74 -1.24 -0.03 0.00 -0.26 0.00 0.00 64.21 63.41 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 -0.50 0.61 -0.36 7.33 -0.12 -1.26 -4.84 117.98 118.83 2qee s PHE 349 Ca 0.44 -0.97 -0.04 0.00 -0.05 0.00 0.00 56.93 56.31 2qee s PHE 349 Cb 0.26 0.20 0.08 0.00 -0.63 0.00 0.00 43.02 42.92 2qee s PHE 349 CO -0.06 -1.16 0.13 0.42 -0.05 0.00 0.00 175.22 174.49 2qee s ILE 350 N -3.30 3.37 0.41 -4.49 1.01 -1.03 -4.69 121.20 112.48 2qee s ILE 350 Ca 0.24 -1.61 0.10 0.00 0.00 0.00 0.00 60.65 59.39 2qee s ILE 350 Cb -0.01 -3.10 0.18 0.00 0.01 0.00 0.00 42.46 39.54 2qee s ILE 350 CO 0.14 -0.39 1.96 1.55 0.00 0.00 0.00 174.94 178.19 2qee h PRO 351 N 8.10 0.22 -3.01 2.79 0.13 -1.87 -0.52 132.00 137.84 2qee h PRO 351 Ca -0.18 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 64.84 2qee h PRO 351 Cb 1.06 -0.03 -0.15 0.00 0.13 0.00 0.00 31.00 32.00 2qee h PRO 351 CO 0.63 0.32 -0.03 -1.14 -0.23 0.00 0.00 178.00 177.55 2qee s GLN 352 N -4.82 1.01 0.06 0.86 2.00 -1.26 -3.48 119.66 114.03 2qee s GLN 352 Ca -0.05 -0.39 -0.01 0.00 -2.00 0.00 0.00 55.36 52.90 2qee s GLN 352 Cb 0.16 0.45 -0.04 0.00 0.80 0.00 0.00 33.01 34.38 2qee s GLN 352 CO 0.72 -0.37 -0.02 -3.38 -0.50 0.00 0.00 175.29 171.74 2qee s HIS 353 N -2.80 0.55 -0.04 1.67 -3.43 -1.26 -4.66 115.29 105.33 2qee s HIS 353 Ca -0.03 -1.08 0.09 0.00 -0.80 0.00 0.00 55.06 53.24 2qee s HIS 353 Cb -0.00 -0.40 -0.23 0.00 -1.43 0.00 0.00 32.58 30.52 2qee s HIS 353 CO -0.05 -0.39 0.68 0.66 -2.00 0.00 0.00 174.74 173.63 2qee h SER 354 N 3.12 0.06 -2.41 7.38 4.64 -1.92 -3.44 113.55 120.98 2qee h SER 354 Ca -0.34 -0.13 -0.38 0.00 -0.47 0.00 0.00 61.79 60.46 2qee h SER 354 Cb 1.15 -0.02 -0.07 0.00 -0.31 0.00 0.00 62.40 63.15 2qee h SER 354 CO 0.65 1.12 -0.44 -0.67 -0.87 0.00 0.00 176.83 176.62 2qee n ASP 355 N -3.13 -5.31 -4.72 4.97 -0.08 -0.05 -4.88 116.55 103.34 2qee n ASP 355 Ca -0.18 0.19 -0.42 0.00 -1.51 0.00 0.00 54.79 52.88 2qee n ASP 355 Cb 1.04 -4.54 -0.03 0.00 2.34 0.00 0.00 41.12 39.93 2qee n ASP 355 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qee s ALA 356 N -2.83 3.86 -0.13 -1.67 0.00 -1.26 -4.39 121.76 115.35 2qee s ALA 356 Ca 0.00 1.48 0.19 0.00 0.00 0.00 0.00 51.96 53.63 2qee s ALA 356 Cb 0.00 -3.67 -0.27 0.00 0.00 0.00 0.00 23.12 19.19 2qee s ALA 356 CO 0.00 -0.87 0.32 0.54 0.00 0.00 0.00 175.76 175.74 2qee n ARG 357 N 4.08 0.67 -5.12 0.00 1.74 -1.26 -0.16 116.66 116.60 2qee n ARG 357 Ca 0.15 -0.04 -0.31 0.00 -0.77 0.00 0.00 57.85 56.88 2qee n ARG 357 Cb 0.37 -1.56 -0.17 0.00 -1.02 0.00 0.00 32.46 30.08 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 -2.91 1.91 0.23 1.55 1.01 -1.26 -4.37 120.40 116.56 2qee s VAL 358 Ca -0.08 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 2qee s VAL 358 Cb 0.09 -1.66 0.30 0.00 0.00 0.00 0.00 36.38 35.11 2qee s VAL 358 CO 0.86 0.53 1.61 0.25 0.00 0.00 0.00 175.10 178.34 2qee h LEU 359 N 6.74 -0.67 -1.94 3.92 5.85 -1.16 -0.07 115.31 127.97 2qee h LEU 359 Ca -0.21 0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2qee h LEU 359 Cb 1.23 0.46 0.00 0.00 0.37 0.00 0.00 40.66 42.72 2qee h LEU 359 CO 0.47 -0.24 0.00 -0.33 -0.34 0.00 0.00 178.44 178.00 2qee h GLU 360 N 0.00 0.00 -0.01 1.25 3.07 -1.93 -2.49 114.58 114.47 2qee h GLU 360 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 2qee h GLU 360 Cb 0.56 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.47 2qee h GLU 360 CO -0.76 0.00 0.04 1.96 -1.40 0.00 0.00 179.01 178.85 2qee h GLN 361 N 0.00 0.00 -0.78 2.33 4.20 -1.41 -0.31 115.11 119.14 2qee h GLN 361 Ca 0.00 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.79 2qee h GLN 361 Cb 0.30 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.03 2qee h GLN 361 CO 0.00 0.00 0.51 -0.07 -0.67 0.00 0.00 178.83 178.60 2qee h LEU 362 N 0.00 0.68 0.81 1.46 3.38 -1.62 -0.30 115.31 119.72 2qee h LEU 362 Ca 0.00 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2qee h LEU 362 Cb 0.08 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2qee h LEU 362 CO -0.00 0.42 -0.43 0.40 0.09 0.00 0.00 178.44 178.91 2qee h ILE 363 N 0.76 0.00 -0.25 1.22 2.04 -1.29 -2.55 117.51 117.44 2qee h ILE 363 Ca 0.35 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 66.06 2qee h ILE 363 Cb 0.37 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 2qee h ILE 363 CO -0.13 0.00 -0.46 0.10 0.00 0.00 0.00 178.15 177.66 2qee h TYR 364 N -1.15 0.78 -0.61 1.37 -0.00 -1.59 -0.74 116.97 115.03 2qee h TYR 364 Ca -0.11 -0.25 -0.03 0.00 0.00 0.00 0.00 58.73 58.34 2qee h TYR 364 Cb 0.90 -0.16 -0.03 0.00 0.00 0.00 0.00 36.73 37.44 2qee h TYR 364 CO -0.02 0.98 0.27 0.87 -0.00 0.00 0.00 178.16 180.26 2qee h LYS 365 N 0.51 0.90 -0.01 0.10 1.79 -1.10 0.66 116.57 119.43 2qee h LYS 365 Ca 0.03 -0.14 -0.23 0.00 -2.18 0.00 0.00 60.65 58.12 2qee h LYS 365 Cb 1.00 -0.15 0.02 0.00 -1.58 0.00 0.00 32.23 31.51 2qee h LYS 365 CO 0.09 0.74 -0.91 -1.49 -1.08 0.00 0.00 179.45 176.80 2qee h TRP 366 N 0.85 0.93 -0.27 -1.35 4.06 -1.44 -2.52 115.95 116.20 2qee h TRP 366 Ca 0.21 -0.50 -0.04 0.00 2.06 0.00 0.00 58.89 60.61 2qee h TRP 366 Cb 0.15 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 28.20 2qee h TRP 366 CO 0.00 1.33 -0.00 0.45 -3.56 0.00 0.00 178.44 176.66 2qee h HIS 367 N 0.26 0.53 -0.42 0.49 3.86 -0.91 0.12 115.15 119.07 2qee h HIS 367 Ca -0.11 -0.09 -0.08 0.00 -1.16 0.00 0.00 60.37 58.92 2qee h HIS 367 Cb 1.58 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.90 2qee h HIS 367 CO 0.12 0.64 -0.05 0.45 0.86 0.00 0.00 177.93 179.95 2qee h HIS 368 N 0.27 0.86 -0.37 2.45 3.86 -0.97 -2.63 115.15 118.62 2qee h HIS 368 Ca 0.08 -0.17 -0.11 0.00 -1.16 0.00 0.00 60.37 59.01 2qee h HIS 368 Cb 0.43 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 2qee h HIS 368 CO 0.04 0.87 -0.20 0.77 0.86 0.00 0.00 177.93 180.27 2qee h SER 369 N 0.61 0.82 -0.93 2.45 0.02 -1.39 -3.19 113.55 111.94 2qee h SER 369 Ca 0.11 -0.41 0.02 0.00 -0.84 0.00 0.00 61.79 60.67 2qee h SER 369 Cb 0.56 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.82 2qee h SER 369 CO 0.03 1.05 0.61 0.11 -1.14 0.00 0.00 176.83 177.49 2qee h LYS 370 N 0.59 1.18 -0.64 3.45 1.57 -0.67 -0.22 116.57 121.84 2qee h LYS 370 Ca 0.08 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2qee h LYS 370 Cb 0.75 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 2qee h LYS 370 CO 0.06 0.78 0.41 0.66 -0.57 0.00 0.00 179.45 180.79 2qee h SER 371 N 1.22 0.74 -0.13 0.86 4.64 -1.47 0.69 113.55 120.10 2qee h SER 371 Ca 0.35 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.62 2qee h SER 371 Cb -0.08 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.82 2qee h SER 371 CO -0.09 0.55 0.02 0.40 -0.87 0.00 0.00 176.83 176.84 2qee h ILE 372 N 0.86 1.23 -0.94 0.95 2.04 -1.45 -2.01 117.51 118.20 2qee h ILE 372 Ca 0.23 -0.72 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 2qee h ILE 372 Cb -0.07 1.46 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 2qee h ILE 372 CO -0.05 0.21 0.57 0.40 0.00 0.00 0.00 178.15 179.29 2qee h ILE 373 N -0.01 1.25 -0.51 -0.67 2.04 -0.85 -1.36 117.51 117.39 2qee h ILE 373 Ca 0.04 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 65.36 2qee h ILE 373 Cb 0.31 -0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.29 2qee h ILE 373 CO 0.00 0.27 0.34 0.00 0.00 0.00 0.00 178.15 178.76 2qee h ALA 374 N 1.34 0.65 -0.90 1.87 0.00 -0.76 -0.96 119.26 120.50 2qee h ALA 374 Ca 0.34 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2qee h ALA 374 Cb -0.07 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 2qee h ALA 374 CO -0.06 0.09 0.52 1.49 0.00 0.00 0.00 179.25 181.28 2qee h GLU 375 N 0.69 1.23 -0.36 0.00 4.57 -0.72 0.42 114.58 120.41 2qee h GLU 375 Ca 0.19 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.23 2qee h GLU 375 Cb -0.07 -0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 28.25 2qee h GLU 375 CO -0.05 0.88 0.17 0.28 -1.18 0.00 0.00 179.01 179.12 2qee h VAL 376 N 1.25 1.17 -0.62 0.32 2.07 -0.88 -1.75 116.25 117.81 2qee h VAL 376 Ca 0.32 -0.47 -0.05 0.00 0.82 0.00 0.00 66.70 67.32 2qee h VAL 376 Cb -0.01 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 2qee h VAL 376 CO -0.06 0.18 0.21 -0.07 0.02 0.00 0.00 177.57 177.85 2qee h LEU 377 N 0.44 0.89 -0.55 2.57 3.38 -0.76 -0.92 115.31 120.37 2qee h LEU 377 Ca 0.12 -0.20 0.05 0.00 0.09 0.00 0.00 57.88 57.95 2qee h LEU 377 Cb 0.12 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 2qee h LEU 377 CO -0.02 0.85 0.27 0.40 0.09 0.00 0.00 178.44 180.04 2qee h ILE 378 N 0.88 0.93 -0.42 1.22 2.04 -0.74 0.86 117.51 122.28 2qee h ILE 378 Ca 0.20 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.84 2qee h ILE 378 Cb 0.27 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 2qee h ILE 378 CO -0.01 0.09 0.08 0.44 0.00 0.00 0.00 178.15 178.75 2qee h ASP 379 N 0.51 0.66 -0.46 1.72 3.32 -0.66 0.64 116.42 122.15 2qee h ASP 379 Ca 0.25 -0.25 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 2qee h ASP 379 Cb 0.18 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2qee h ASP 379 CO -0.18 0.74 -0.10 0.11 -1.72 0.00 0.00 179.24 178.08 2qee h LYS 380 N 0.54 0.93 -0.47 3.56 6.56 -0.79 -0.50 116.57 126.40 2qee h LYS 380 Ca 0.13 -0.33 -0.12 0.00 -1.06 0.00 0.00 60.65 59.27 2qee h LYS 380 Cb 0.36 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.94 2qee h LYS 380 CO 0.01 0.98 -0.16 1.88 -2.06 0.00 0.00 179.45 180.10 2qee h TYR 381 N 0.83 1.08 -0.86 -1.35 0.05 -0.75 -2.82 116.97 113.16 2qee h TYR 381 Ca 0.13 -0.25 -0.01 0.00 0.05 0.00 0.00 58.73 58.66 2qee h TYR 381 Cb 0.64 -0.26 -0.04 0.00 1.01 0.00 0.00 36.73 38.08 2qee h TYR 381 CO 0.04 1.05 0.51 0.22 -1.05 0.00 0.00 178.16 178.93 2qee h ASP 382 N 0.79 1.04 -1.00 3.88 3.58 -0.62 0.55 116.42 124.64 2qee h ASP 382 Ca 0.11 -0.07 0.03 0.00 0.42 0.00 0.00 57.03 57.52 2qee h ASP 382 Cb 0.73 -0.26 -0.06 0.00 1.72 0.00 0.00 39.33 41.46 2qee h ASP 382 CO 0.06 0.80 0.66 0.44 -2.88 0.00 0.00 179.24 178.32 2qee h ASP 383 N 1.18 1.12 1.05 2.28 3.32 -0.95 0.72 116.42 125.13 2qee h ASP 383 Ca 0.31 -0.02 -0.19 0.00 0.02 0.00 0.00 57.03 57.15 2qee h ASP 383 Cb -0.04 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.22 2qee h ASP 383 CO -0.06 0.78 -0.98 0.16 -1.72 0.00 0.00 179.24 177.42 2qee h ILE 384 N 1.30 1.36 -0.63 0.35 3.07 -1.15 -2.51 117.51 119.30 2qee h ILE 384 Ca 0.39 -2.99 0.03 0.00 1.55 0.00 0.00 64.86 63.85 2qee h ILE 384 Cb -0.05 2.66 -0.04 0.00 -0.27 0.00 0.00 36.82 39.11 2qee h ILE 384 CO -0.11 0.77 0.38 -0.07 -1.05 0.00 0.00 178.15 178.07 2qee h LEU 385 N 0.00 0.61 -1.83 0.16 3.38 -0.65 -1.21 115.31 115.76 2qee h LEU 385 Ca -0.05 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2qee h LEU 385 Cb 1.69 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.32 2qee h LEU 385 CO 0.10 0.42 -0.12 1.56 0.09 0.00 0.00 178.44 180.49 2qee h GLN 386 N 0.74 0.00 -0.06 1.13 1.08 -0.71 -1.24 115.11 116.06 2qee h GLN 386 Ca 0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 2qee h GLN 386 Cb 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 2qee h GLN 386 CO -0.12 0.12 0.00 0.00 -0.95 0.00 0.00 178.83 177.88 2qee n ALA 387 N -2.46 2.59 0.00 3.87 0.00 -0.86 -4.90 120.51 118.74 2qee n ALA 387 Ca -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.10 2qee n ALA 387 Cb 0.20 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 1.00 0.49 3.76 0.00 0.00 -0.47 -5.07 105.19 104.91 2qee n GLY 388 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 3.60 -0.31 1.61 -0.11 -0.51 -5.00 118.94 116.22 2qee s TRP 389 Ca 0.00 1.74 -0.10 0.00 1.22 0.00 0.00 56.10 58.96 2qee s TRP 389 Cb 0.00 -3.14 -0.01 0.00 -1.50 0.00 0.00 33.47 28.82 2qee s TRP 389 CO 0.00 -0.27 0.16 -1.21 -4.62 0.00 0.00 176.95 171.01 2qee s GLU 390 N -1.72 3.37 -0.07 5.86 2.02 -1.26 -4.13 118.70 122.76 2qee s GLU 390 Ca 0.48 -0.70 -0.19 0.00 0.02 0.00 0.00 54.97 54.58 2qee s GLU 390 Cb -0.27 -3.58 -0.05 0.00 0.10 0.00 0.00 34.13 30.34 2qee s GLU 390 CO 0.34 -0.41 0.51 0.08 0.02 0.00 0.00 175.26 175.80 2qee s VAL 391 N 1.63 5.10 0.31 2.63 1.01 -1.26 -5.08 120.40 124.73 2qee s VAL 391 Ca 0.05 1.04 -0.00 0.00 0.00 0.00 0.00 61.98 63.06 2qee s VAL 391 Cb -0.17 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 2qee s VAL 391 CO 0.07 0.37 0.51 0.42 0.00 0.00 0.00 175.10 176.47 2qee s THR 392 N 0.24 5.12 0.35 3.92 -4.23 -1.26 -4.47 115.64 115.31 2qee s THR 392 Ca 0.27 -0.41 0.04 0.00 -1.18 0.00 0.00 61.69 60.42 2qee s THR 392 Cb -0.16 -3.82 0.20 0.00 1.34 0.00 0.00 72.50 70.05 2qee s THR 392 CO 0.13 -0.45 1.93 -0.08 -0.54 0.00 0.00 174.62 175.60 2qee h GLU 393 N 1.10 0.61 -0.41 3.99 4.81 -1.98 -1.05 114.58 121.65 2qee h GLU 393 Ca -0.49 -0.09 -0.09 0.00 -0.13 0.00 0.00 59.36 58.56 2qee h GLU 393 Cb 1.21 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 2qee h GLU 393 CO 0.63 0.54 -0.09 0.93 -0.73 0.00 0.00 179.01 180.28 2qee h GLU 394 N 0.60 0.72 -0.54 1.92 4.39 -1.99 -0.48 114.58 119.20 2qee h GLU 394 Ca 0.14 -0.23 -0.12 0.00 0.34 0.00 0.00 59.36 59.50 2qee h GLU 394 Cb 0.18 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 2qee h GLU 394 CO -0.01 0.80 -0.12 0.93 -1.16 0.00 0.00 179.01 179.45 2qee h GLU 395 N 0.66 1.04 -0.27 2.33 5.08 -1.76 -0.60 114.58 121.07 2qee h GLU 395 Ca 0.12 -0.39 0.03 0.00 -1.00 0.00 0.00 59.36 58.12 2qee h GLU 395 Cb 0.55 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 2qee h GLU 395 CO 0.03 1.08 0.06 0.82 -1.00 0.00 0.00 179.01 180.01 2qee h ILE 396 N 0.92 0.89 -0.71 3.13 2.04 -0.99 -0.52 117.51 122.27 2qee h ILE 396 Ca 0.14 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 66.01 2qee h ILE 396 Cb 0.69 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 37.42 2qee h ILE 396 CO 0.05 0.03 0.39 0.11 0.00 0.00 0.00 178.15 178.74 2qee h LYS 397 N 0.17 0.69 0.09 2.37 1.57 -0.86 -1.19 116.57 119.42 2qee h LYS 397 Ca 0.12 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2qee h LYS 397 Cb 0.12 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2qee h LYS 397 CO -0.15 0.46 -0.04 -0.09 -0.57 0.00 0.00 179.45 179.05 2qee h ARG 398 N 0.71 -0.12 -0.66 3.15 2.43 -0.84 -0.99 114.38 118.06 2qee h ARG 398 Ca 0.33 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.57 2qee h ARG 398 Cb 0.24 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.76 2qee h ARG 398 CO -0.21 -0.03 0.35 -0.44 -1.51 0.00 0.00 179.97 178.13 2qee h ASP 399 N -0.18 0.51 -0.46 -3.80 3.32 -0.78 -1.13 116.42 113.90 2qee h ASP 399 Ca -0.01 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 56.94 2qee h ASP 399 Cb 0.14 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2qee h ASP 399 CO 0.02 0.32 -0.22 0.58 -1.72 0.00 0.00 179.24 178.23 2qee h VAL 400 N 0.65 1.27 -0.78 -1.35 2.07 -1.14 -1.78 116.25 115.19 2qee h VAL 400 Ca 0.30 -1.38 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 2qee h VAL 400 Cb 0.22 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 2qee h VAL 400 CO -0.20 0.48 0.37 0.00 0.02 0.00 0.00 177.57 178.23 2qee h ALA 401 N 0.90 1.18 -0.22 1.67 0.00 -0.84 -0.76 119.26 121.19 2qee h ALA 401 Ca 0.11 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2qee h ALA 401 Cb 0.79 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2qee h ALA 401 CO 0.07 0.62 0.13 -0.44 0.00 0.00 0.00 179.25 179.62 2qee h ASP 402 N 1.10 0.27 -0.49 0.00 3.32 -0.79 -0.08 116.42 119.75 2qee h ASP 402 Ca 0.27 -0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.17 2qee h ASP 402 Cb 0.12 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2qee h ASP 402 CO -0.03 0.26 0.00 -0.07 -1.72 0.00 0.00 179.24 177.68 2qee h LEU 403 N 0.26 0.85 -0.05 1.55 3.38 -0.89 -0.53 115.31 119.88 2qee h LEU 403 Ca 0.08 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2qee h LEU 403 Cb 0.05 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.57 2qee h LEU 403 CO -0.01 0.95 -0.58 0.49 0.09 0.00 0.00 178.44 179.37 2qee n PHE 404 N -4.33 0.00 0.18 1.13 3.72 -0.33 -4.26 117.46 113.56 2qee n PHE 404 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 2qee n PHE 404 Cb 0.31 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 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 -1.42 -2.56 0.13 4.37 2.88 -0.28 -1.56 113.62 115.17 2qee n SER 405 Ca 0.06 0.66 -0.02 0.00 -1.33 0.00 0.00 58.87 58.24 2qee n SER 405 Cb 0.34 2.49 0.19 0.00 -0.75 0.00 0.00 64.21 66.48 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 0.09 -0.81 -1.46 3.08 -1.07 -2.64 114.38 111.56 2qee h ARG 406 Ca 0.00 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 2qee h ARG 406 Cb 0.00 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 2qee h ARG 406 CO 0.00 0.62 0.37 -0.91 -1.07 0.00 0.00 179.97 178.98 2qee h ASN 407 N 0.07 1.07 0.05 7.04 2.35 -1.30 -0.18 115.58 124.68 2qee h ASN 407 Ca -0.00 -0.14 -0.00 0.00 -0.55 0.00 0.00 56.30 55.61 2qee h ASN 407 Cb 1.01 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.10 2qee h ASN 407 CO 0.08 0.92 -0.03 0.15 -1.65 0.00 0.00 177.43 176.90 2qee h PHE 408 N 1.16 -0.07 -0.19 1.19 3.57 -1.71 -2.12 116.94 118.77 2qee h PHE 408 Ca 0.28 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.71 2qee h PHE 408 Cb 0.15 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 2qee h PHE 408 CO 0.02 0.16 -0.18 -1.49 -2.23 0.00 0.00 178.31 174.58 2qee h TRP 409 N -0.29 0.35 -0.37 0.41 4.06 -1.33 -0.41 115.95 118.37 2qee h TRP 409 Ca -0.01 -0.05 -0.03 0.00 2.06 0.00 0.00 58.89 60.85 2qee h TRP 409 Cb 0.26 -0.09 -0.02 0.00 -1.00 0.00 0.00 29.16 28.31 2qee h TRP 409 CO -0.00 0.50 0.10 -0.09 -3.56 0.00 0.00 178.44 175.39 2qee h ARG 410 N 0.30 0.58 -0.22 0.49 2.43 -0.97 -0.69 114.38 116.30 2qee h ARG 410 Ca 0.05 -0.13 -0.15 0.00 -0.81 0.00 0.00 59.98 58.95 2qee h ARG 410 Cb 0.50 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2qee h ARG 410 CO 0.03 0.61 -0.43 0.35 -1.51 0.00 0.00 179.97 179.03 2qee h PHE 411 N 0.45 0.86 0.00 2.20 3.57 -0.66 -2.85 116.94 120.50 2qee h PHE 411 Ca 0.12 -0.31 0.00 0.00 3.53 0.00 0.00 57.97 61.31 2qee h PHE 411 Cb 0.28 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.86 2qee h PHE 411 CO 0.01 1.08 0.00 1.33 -2.23 0.00 0.00 178.31 178.51 2qee n VAL 412 N -4.19 0.52 -2.81 1.41 0.24 -0.23 -4.88 118.33 108.38 2qee n VAL 412 Ca -0.05 -0.12 -0.08 0.00 -2.04 0.00 0.00 64.34 62.05 2qee n VAL 412 Cb 0.55 -0.68 0.03 0.00 -1.47 0.00 0.00 33.84 32.28 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 1.08 0.38 0.00 7.63 0.00 -0.36 -4.81 105.19 109.11 2qee n GLY 413 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.09 0.00 0.00 1.61 1.74 -0.61 -5.05 116.66 112.26 2qee n ARG 414 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2qee n ARG 414 Cb 0.53 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.97 2qee n ARG 414 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40