#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 5.36 -0.26 1.96 0.15 -1.26 -4.97 113.70 114.68 2qee s SER 2 Ca 0.00 2.69 -0.25 0.00 0.70 0.00 0.00 55.95 59.09 2qee s SER 2 Cb 0.00 -2.63 -0.00 0.00 -1.71 0.00 0.00 66.02 61.68 2qee s SER 2 CO 0.00 -1.50 0.86 -0.63 1.20 0.00 0.00 173.24 173.17 2qee s ILE 3 N -1.34 4.79 0.00 6.45 1.01 -1.26 -4.92 121.20 125.93 2qee s ILE 3 Ca 0.71 1.57 0.00 0.00 0.00 0.00 0.00 60.65 62.93 2qee s ILE 3 Cb -0.39 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 37.93 2qee s ILE 3 CO 0.45 -0.13 0.09 -0.46 0.00 0.00 0.00 174.94 174.90 2qee n ASN 4 N 6.12 0.19 -3.82 3.58 6.94 -1.26 -4.85 115.26 122.16 2qee n ASN 4 Ca 0.06 -0.54 -0.09 0.00 -0.02 0.00 0.00 54.58 53.98 2qee n ASN 4 Cb 0.47 0.62 -0.07 0.00 -2.36 0.00 0.00 39.78 38.44 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 -0.62 0.05 0.24 0.53 1.04 -1.26 -5.05 113.70 108.63 2qee s SER 5 Ca 0.00 -0.52 -0.06 0.00 0.48 0.00 0.00 55.95 55.85 2qee s SER 5 Cb 0.00 0.35 0.31 0.00 0.10 0.00 0.00 66.02 66.78 2qee s SER 5 CO 0.00 -0.70 1.86 -0.09 0.98 0.00 0.00 173.24 175.29 2qee h ARG 6 N 2.88 0.97 -0.39 4.02 2.43 -1.98 -2.27 114.38 120.04 2qee h ARG 6 Ca -0.33 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 58.82 2qee h ARG 6 Cb 1.20 -0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 30.50 2qee h ARG 6 CO 0.53 0.64 0.16 1.49 -1.51 0.00 0.00 179.97 181.28 2qee h GLU 7 N 1.00 0.33 -0.40 0.20 4.81 -1.99 0.25 114.58 118.78 2qee h GLU 7 Ca 0.37 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.49 2qee h GLU 7 Cb 0.13 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2qee h GLU 7 CO -0.16 0.22 -0.10 0.28 -0.73 0.00 0.00 179.01 178.52 2qee h VAL 8 N 0.34 1.28 -0.41 0.32 2.07 -1.95 -2.74 116.25 115.15 2qee h VAL 8 Ca 0.17 -1.19 0.05 0.00 0.82 0.00 0.00 66.70 66.55 2qee h VAL 8 Cb 0.12 1.22 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 2qee h VAL 8 CO -0.15 0.40 0.15 0.25 0.02 0.00 0.00 177.57 178.24 2qee h LEU 9 N 0.59 0.16 -0.64 2.57 5.85 -1.07 -2.18 115.31 120.58 2qee h LEU 9 Ca 0.10 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.91 2qee h LEU 9 Cb 0.63 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.64 2qee h LEU 9 CO 0.04 0.12 0.37 0.00 -0.34 0.00 0.00 178.44 178.64 2qee h ALA 10 N 1.27 0.85 -0.21 1.25 0.00 -0.27 0.24 119.26 122.38 2qee h ALA 10 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2qee h ALA 10 Cb 0.17 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2qee h ALA 10 CO -0.19 0.08 0.13 0.93 0.00 0.00 0.00 179.25 180.20 2qee h GLU 11 N 0.71 0.28 -0.90 0.00 4.39 -1.25 -0.90 114.58 116.92 2qee h GLU 11 Ca 0.28 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.93 2qee h GLU 11 Cb 0.11 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 2qee h GLU 11 CO -0.15 0.22 0.48 0.87 -1.16 0.00 0.00 179.01 179.27 2qee h LYS 12 N 0.27 1.26 -0.06 2.33 1.79 -0.75 -1.13 116.57 120.28 2qee h LYS 12 Ca 0.08 -0.15 -0.06 0.00 -2.18 0.00 0.00 60.65 58.33 2qee h LYS 12 Cb 0.00 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 30.41 2qee h LYS 12 CO -0.02 0.93 -0.21 0.28 -1.08 0.00 0.00 179.45 179.35 2qee h VAL 13 N 1.26 1.44 -0.50 0.50 2.07 -0.73 -1.97 116.25 118.31 2qee h VAL 13 Ca 0.31 -1.61 0.03 0.00 0.82 0.00 0.00 66.70 66.26 2qee h VAL 13 Cb 0.04 2.33 -0.04 0.00 -1.52 0.00 0.00 31.29 32.11 2qee h VAL 13 CO -0.05 0.45 0.28 0.11 0.02 0.00 0.00 177.57 178.38 2qee h LYS 14 N -0.28 0.54 -0.40 1.57 1.57 -1.12 0.17 116.57 118.62 2qee h LYS 14 Ca -0.01 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.77 2qee h LYS 14 Cb 0.84 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.99 2qee h LYS 14 CO 0.04 0.36 0.18 -0.91 -0.57 0.00 0.00 179.45 178.55 2qee h ASN 15 N 0.55 0.25 0.12 0.86 2.35 -1.21 0.80 115.58 119.30 2qee h ASN 15 Ca 0.21 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.98 2qee h ASN 15 Cb 0.07 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.42 2qee h ASN 15 CO -0.12 0.18 -0.06 0.00 -1.65 0.00 0.00 177.43 175.78 2qee h ALA 16 N 1.23 -0.17 -0.15 -0.83 0.00 -0.82 0.98 119.26 119.50 2qee h ALA 16 Ca 0.17 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.08 2qee h ALA 16 Cb 0.11 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2qee h ALA 16 CO -0.14 -0.59 -0.04 0.28 0.00 0.00 0.00 179.25 178.76 2qee h VAL 17 N -0.17 0.85 -0.97 0.00 2.07 -0.52 -0.81 116.25 116.71 2qee h VAL 17 Ca -0.02 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.51 2qee h VAL 17 Cb 0.13 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 2qee h VAL 17 CO 0.02 0.00 0.64 0.78 0.02 0.00 0.00 177.57 179.04 2qee h ASN 18 N 0.00 1.11 1.70 0.57 -0.26 -0.68 -3.06 115.58 114.96 2qee h ASN 18 Ca 0.07 -0.03 0.00 0.00 -0.56 0.00 0.00 56.30 55.78 2qee h ASN 18 Cb 0.11 -0.28 0.00 0.00 -1.06 0.00 0.00 38.32 37.09 2qee h ASN 18 CO -0.15 0.80 -0.23 0.78 -1.06 0.00 0.00 177.43 177.57 2qee h ASN 19 N 1.31 0.00 -2.79 5.81 2.35 -0.40 -3.46 115.58 118.40 2qee h ASN 19 Ca 0.36 -0.01 -0.55 0.00 -0.55 0.00 0.00 56.30 55.55 2qee h ASN 19 Cb -0.15 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 2qee h ASN 19 CO -0.08 0.00 0.96 -1.58 -1.65 0.00 0.00 177.43 175.09 2qee s GLN 20 N -3.23 4.22 0.32 0.81 2.00 -0.34 -4.98 119.66 118.45 2qee s GLN 20 Ca 0.06 1.95 -0.29 0.00 -2.00 0.00 0.00 55.36 55.08 2qee s GLN 20 Cb 0.07 -3.81 -0.10 0.00 0.80 0.00 0.00 33.01 29.97 2qee s GLN 20 CO 0.69 -0.73 1.38 -2.14 -0.50 0.00 0.00 175.29 173.99 2qee s PRO 21 N 3.44 4.28 -0.11 1.67 0.02 -1.26 -4.93 135.00 138.11 2qee s PRO 21 Ca 0.65 2.31 -0.11 0.00 0.02 0.00 0.00 61.00 63.86 2qee s PRO 21 Cb -0.29 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 31.12 2qee s PRO 21 CO 0.24 -0.32 0.24 0.08 -0.33 0.00 0.00 177.00 176.91 2qee s VAL 22 N -0.82 5.33 -0.24 3.83 1.01 0.10 -4.65 120.40 124.97 2qee s VAL 22 Ca 0.53 0.45 -0.16 0.00 0.00 0.00 0.00 61.98 62.79 2qee s VAL 22 Cb -0.42 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2qee s VAL 22 CO 0.52 0.53 0.42 -0.89 0.00 0.00 0.00 175.10 175.68 2qee s THR 23 N -0.46 5.16 -0.50 3.92 2.01 -0.37 -1.04 115.64 124.35 2qee s THR 23 Ca 0.17 0.71 -0.16 0.00 0.31 0.00 0.00 61.69 62.72 2qee s THR 23 Cb -0.13 -3.75 0.08 0.00 0.01 0.00 0.00 72.50 68.72 2qee s THR 23 CO 0.05 0.18 0.46 -0.62 -0.69 0.00 0.00 174.62 174.01 2qee s ASP 24 N 1.35 6.17 0.00 3.53 -1.08 0.26 -4.72 116.67 122.19 2qee s ASP 24 Ca 0.18 -1.36 0.22 0.00 -0.52 0.00 0.00 52.55 51.07 2qee s ASP 24 Cb -0.15 -2.21 0.80 0.00 -1.46 0.00 0.00 42.92 39.90 2qee s ASP 24 CO 0.09 -0.75 1.58 1.15 0.52 0.00 0.00 175.17 177.77 2qee n MET 25 N 5.41 1.71 -3.47 4.34 0.00 -1.26 -1.06 117.12 122.79 2qee n MET 25 Ca -0.12 -1.07 -0.05 0.00 0.00 0.00 0.00 57.70 56.46 2qee n MET 25 Cb 0.43 -1.41 -0.06 0.00 0.00 0.00 0.00 33.22 32.18 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 -1.83 -1.05 0.23 3.17 5.65 -1.26 -4.71 115.29 115.49 2qee s HIS 26 Ca 0.33 1.49 -0.02 0.00 0.25 0.00 0.00 55.06 57.12 2qee s HIS 26 Cb 0.18 0.36 -0.03 0.00 -1.18 0.00 0.00 32.58 31.90 2qee s HIS 26 CO 0.27 -0.66 0.22 0.95 -0.65 0.00 0.00 174.74 174.87 2qee s THR 27 N 2.69 0.00 -0.33 0.89 -4.23 -0.51 -1.24 115.64 112.91 2qee s THR 27 Ca 0.06 -1.89 0.07 0.00 -1.18 0.00 0.00 61.69 58.75 2qee s THR 27 Cb -0.14 -2.46 0.47 0.00 1.34 0.00 0.00 72.50 71.71 2qee s THR 27 CO -0.16 0.00 1.39 1.41 -0.54 0.00 0.00 174.62 176.72 2qee n HIS 28 N -0.34 1.93 -3.56 3.99 8.25 0.16 -2.46 115.22 123.18 2qee n HIS 28 Ca 0.02 -2.05 -0.19 0.00 -0.26 0.00 0.00 57.72 55.24 2qee n HIS 28 Cb 0.65 -0.52 -0.01 0.00 1.12 0.00 0.00 29.99 31.22 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 3.96 0.05 2.41 1.43 -1.21 -4.59 118.68 117.25 2qee s LEU 29 Ca 0.49 -0.20 0.03 0.00 -1.03 0.00 0.00 54.13 53.42 2qee s LEU 29 Cb 0.42 -2.70 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 2qee s LEU 29 CO 0.00 -0.39 -0.09 -0.36 0.23 0.00 0.00 176.35 175.74 2qee s PHE 30 N -2.17 0.81 0.32 0.29 0.08 -1.26 -4.39 117.98 111.65 2qee s PHE 30 Ca 0.43 -0.48 -0.27 0.00 0.12 0.00 0.00 56.93 56.74 2qee s PHE 30 Cb -0.09 -0.47 -0.13 0.00 -0.57 0.00 0.00 43.02 41.75 2qee s PHE 30 CO 0.30 -0.05 0.99 0.45 -0.10 0.00 0.00 175.22 176.82 2qee n SER 31 N 1.46 1.23 0.23 1.36 2.88 -1.26 -4.75 113.62 114.76 2qee n SER 31 Ca -0.22 1.14 0.08 0.00 -1.33 0.00 0.00 58.87 58.54 2qee n SER 31 Cb 0.55 -1.30 0.54 0.00 -0.75 0.00 0.00 64.21 63.25 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 1.87 0.00 0.00 -1.46 0.13 -1.93 0.17 132.00 130.78 2qee h PRO 32 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2qee h PRO 32 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2qee h PRO 32 CO 0.59 0.22 0.00 0.27 -0.23 0.00 0.00 178.00 178.86 2qee n ASN 33 N -3.91 0.00 -0.01 1.44 6.94 -1.26 -1.57 115.26 116.89 2qee n ASN 33 Ca -0.02 0.32 0.15 0.00 -0.02 0.00 0.00 54.58 55.01 2qee n ASN 33 Cb 0.31 -0.40 0.72 0.00 -2.36 0.00 0.00 39.78 38.05 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 -1.40 0.00 -1.60 -2.53 3.01 0.05 -5.02 117.46 109.97 2qee n PHE 34 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 2qee n PHE 34 Cb 0.10 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.28 2qee n PHE 34 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qee n GLY 35 N 1.31 -0.17 0.30 1.37 0.00 -0.61 -4.42 105.19 102.98 2qee n GLY 35 Ca 0.13 -1.54 0.20 0.00 0.00 0.00 0.00 46.02 44.81 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 -1.95 -2.10 114.58 116.52 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 -0.03 -0.84 -1.16 0.00 0.00 179.01 176.98 2qee h ILE 37 N 0.00 0.16 -3.02 3.13 3.07 -1.97 -3.37 117.51 115.52 2qee h ILE 37 Ca 0.00 -0.32 -0.57 0.00 1.55 0.00 0.00 64.86 65.52 2qee h ILE 37 Cb 0.15 1.27 -0.04 0.00 -0.27 0.00 0.00 36.82 37.93 2qee h ILE 37 CO 0.00 0.03 1.15 -0.22 -1.05 0.00 0.00 178.15 178.06 2qee s LEU 38 N -6.49 3.54 0.06 0.16 2.96 -0.79 -4.76 118.68 113.35 2qee s LEU 38 Ca -0.02 0.96 -0.18 0.00 -0.22 0.00 0.00 54.13 54.67 2qee s LEU 38 Cb 0.12 -3.49 -0.06 0.00 0.50 0.00 0.00 46.19 43.25 2qee s LEU 38 CO 0.51 -1.56 0.52 -0.76 -1.32 0.00 0.00 176.35 173.73 2qee s LEU 39 N 6.06 4.50 0.10 -0.68 1.43 -1.26 -5.01 118.68 123.82 2qee s LEU 39 Ca 0.68 1.16 -0.24 0.00 -1.03 0.00 0.00 54.13 54.69 2qee s LEU 39 Cb -0.17 -2.83 0.07 0.00 0.03 0.00 0.00 46.19 43.29 2qee s LEU 39 CO 0.32 0.28 0.59 -1.66 0.23 0.00 0.00 176.35 176.12 2qee s TRP 40 N -1.13 -0.53 0.00 0.29 1.48 -1.26 -0.62 118.94 117.17 2qee s TRP 40 Ca 0.28 0.48 0.00 0.00 -1.06 0.00 0.00 56.10 55.80 2qee s TRP 40 Cb -0.18 0.48 0.00 0.00 -1.16 0.00 0.00 33.47 32.61 2qee s TRP 40 CO 0.17 -0.77 0.00 -0.40 -4.06 0.00 0.00 176.95 171.90 2qee n ASP 41 N -0.01 0.00 -0.02 -2.66 5.68 -1.26 -4.58 116.55 113.70 2qee n ASP 41 Ca -0.18 0.00 -0.07 0.00 -0.50 0.00 0.00 54.79 54.04 2qee n ASP 41 Cb 0.63 0.00 0.10 0.00 -1.14 0.00 0.00 41.12 40.71 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 1.29 -0.58 2.12 6.09 -1.96 0.75 117.51 125.23 2qee h ILE 42 Ca 0.00 -1.51 -0.07 0.00 -1.37 0.00 0.00 64.86 61.92 2qee h ILE 42 Cb 0.00 1.48 -0.03 0.00 0.47 0.00 0.00 36.82 38.74 2qee h ILE 42 CO 0.00 0.48 0.10 0.44 -3.07 0.00 0.00 178.15 176.10 2qee h ASP 43 N 0.51 0.88 -0.38 2.19 3.32 -1.94 -0.22 116.42 120.78 2qee h ASP 43 Ca 0.05 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 56.85 2qee h ASP 43 Cb 0.86 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 2qee h ASP 43 CO 0.07 0.88 -0.03 -0.33 -1.72 0.00 0.00 179.24 178.12 2qee h GLU 44 N 0.88 0.68 -0.42 3.56 4.39 -1.70 -1.62 114.58 120.36 2qee h GLU 44 Ca 0.18 -0.23 0.03 0.00 0.34 0.00 0.00 59.36 59.68 2qee h GLU 44 Cb 0.38 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.94 2qee h GLU 44 CO 0.01 0.80 0.21 -0.07 -1.16 0.00 0.00 179.01 178.80 2qee h LEU 45 N 0.50 0.31 -1.07 1.33 3.38 -0.66 -2.07 115.31 117.03 2qee h LEU 45 Ca 0.10 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2qee h LEU 45 Cb 0.51 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2qee h LEU 45 CO 0.02 0.22 -0.45 -0.07 0.09 0.00 0.00 178.44 178.25 2qee h LEU 46 N 0.43 0.00 -2.47 1.67 3.38 -0.99 -3.05 115.31 114.28 2qee h LEU 46 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2qee h LEU 46 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2qee h LEU 46 CO -0.12 0.45 0.00 0.35 0.09 0.00 0.00 178.44 179.21 2qee n THR 47 N -3.94 0.93 -1.50 0.22 -2.24 -0.61 -4.65 114.28 102.48 2qee n THR 47 Ca -0.01 -0.90 -0.45 0.00 -2.27 0.00 0.00 64.05 60.42 2qee n THR 47 Cb 0.48 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 69.13 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 1.43 0.29 0.25 4.78 9.36 -0.81 -4.68 117.16 127.78 2qee n TYR 48 Ca 0.22 0.75 0.08 0.00 3.32 0.00 0.00 57.90 62.28 2qee n TYR 48 Cb 0.57 -2.10 0.61 0.00 -0.63 0.00 0.00 39.34 37.80 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 1.39 0.00 -0.93 2.98 2.07 -1.92 -0.41 115.15 118.33 2qee h HIS 49 Ca -0.36 0.00 0.08 0.00 -2.85 0.00 0.00 60.37 57.24 2qee h HIS 49 Cb 1.38 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 31.30 2qee h HIS 49 CO 0.43 0.11 0.60 1.88 -3.07 0.00 0.00 177.93 177.88 2qee h TYR 50 N 0.00 1.05 0.04 6.12 -1.99 -1.94 -1.65 116.97 118.61 2qee h TYR 50 Ca -0.00 0.03 -0.23 0.00 2.00 0.00 0.00 58.73 60.52 2qee h TYR 50 Cb 0.22 -0.34 -0.02 0.00 2.00 0.00 0.00 36.73 38.59 2qee h TYR 50 CO 0.00 0.51 -1.09 -0.07 -0.00 0.00 0.00 178.16 177.52 2qee h LEU 51 N 1.00 0.14 -0.43 3.88 3.38 -1.39 -2.80 115.31 119.09 2qee h LEU 51 Ca 0.41 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.30 2qee h LEU 51 Cb 0.29 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 2qee h LEU 51 CO -0.17 1.12 0.11 0.58 0.09 0.00 0.00 178.44 180.17 2qee h VAL 52 N 0.02 0.81 -0.24 1.22 2.07 -0.81 0.01 116.25 119.33 2qee h VAL 52 Ca -0.05 -0.09 0.03 0.00 0.82 0.00 0.00 66.70 67.41 2qee h VAL 52 Cb 1.84 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 32.11 2qee h VAL 52 CO 0.15 0.05 0.06 0.00 0.02 0.00 0.00 177.57 177.85 2qee h ALA 53 N 1.31 0.26 -0.55 1.67 0.00 -1.34 -1.96 119.26 118.65 2qee h ALA 53 Ca 0.21 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2qee h ALA 53 Cb 0.23 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2qee h ALA 53 CO -0.25 -0.36 0.17 0.93 0.00 0.00 0.00 179.25 179.75 2qee h GLU 54 N 0.16 0.85 -0.19 0.00 5.08 -1.25 -2.84 114.58 116.39 2qee h GLU 54 Ca 0.11 -0.18 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 2qee h GLU 54 Cb 0.10 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2qee h GLU 54 CO -0.13 0.78 -0.21 -0.24 -1.00 0.00 0.00 179.01 178.21 2qee h VAL 55 N 0.76 1.23 0.00 3.13 3.04 -0.68 -1.86 116.25 121.87 2qee h VAL 55 Ca 0.18 -1.07 0.00 0.00 -1.01 0.00 0.00 66.70 64.79 2qee h VAL 55 Cb 0.28 1.32 0.00 0.00 -2.01 0.00 0.00 31.29 30.88 2qee h VAL 55 CO -0.01 0.34 0.00 0.24 -1.01 0.00 0.00 177.57 177.13 2qee h MET 56 N 0.30 0.00 0.00 4.17 2.86 -1.12 0.24 114.93 121.38 2qee h MET 56 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2qee h MET 56 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 2qee h MET 56 CO 0.04 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.01 2qee h ARG 57 N 0.00 0.00 0.00 1.72 3.08 -1.24 -3.37 114.38 114.57 2qee h ARG 57 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.91 2qee h ARG 57 Cb 0.37 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 2qee h ARG 57 CO 0.00 0.00 -1.49 0.91 -1.07 0.00 0.00 179.97 178.32 2qee n TRP 58 N -2.63 0.00 -2.26 3.04 7.02 -0.16 -5.07 117.44 117.37 2qee n TRP 58 Ca 0.02 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.16 2qee n TRP 58 Cb 0.32 -0.32 -0.00 0.00 -2.42 0.00 0.00 31.31 28.89 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 3.41 -0.64 -0.99 -1.32 -0.11 -4.96 115.64 108.87 2qee s THR 59 Ca -0.12 0.83 0.24 0.00 -1.21 0.00 0.00 61.69 61.44 2qee s THR 59 Cb 0.04 -3.32 0.10 0.00 -1.51 0.00 0.00 72.50 67.81 2qee s THR 59 CO 0.18 -0.23 1.41 0.44 -2.21 0.00 0.00 174.62 174.20 2qee h ASP 60 N 1.10 0.00 -2.61 8.08 3.32 -1.94 -3.47 116.42 120.90 2qee h ASP 60 Ca -0.49 -0.16 -0.53 0.00 0.02 0.00 0.00 57.03 55.87 2qee h ASP 60 Cb 1.24 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.85 2qee h ASP 60 CO 0.57 0.08 1.00 0.52 -1.72 0.00 0.00 179.24 179.69 2qee n VAL 61 N -2.19 0.01 -1.51 -1.35 0.31 -1.26 -4.98 118.33 107.36 2qee n VAL 61 Ca 0.04 -0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.05 2qee n VAL 61 Cb 0.44 -1.95 0.06 0.00 -0.91 0.00 0.00 33.84 31.49 2qee n VAL 61 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2qee s SER 62 N 1.19 5.01 0.25 4.52 1.04 -1.26 -4.80 113.70 119.65 2qee s SER 62 Ca 0.76 1.77 -0.06 0.00 0.48 0.00 0.00 55.95 58.90 2qee s SER 62 Cb -0.52 -2.52 0.29 0.00 0.10 0.00 0.00 66.02 63.38 2qee s SER 62 CO 0.33 -1.69 1.91 -0.29 0.98 0.00 0.00 173.24 174.47 2qee h ILE 63 N -0.69 1.19 -0.03 -1.02 6.09 -1.97 0.12 117.51 121.19 2qee h ILE 63 Ca -0.44 -0.43 0.01 0.00 -1.37 0.00 0.00 64.86 62.63 2qee h ILE 63 Cb 1.22 -0.17 -0.01 0.00 0.47 0.00 0.00 36.82 38.34 2qee h ILE 63 CO 0.54 0.23 -0.03 -0.33 -3.07 0.00 0.00 178.15 175.49 2qee h GLU 64 N 1.25 -0.04 -0.62 2.19 3.07 -1.94 -0.92 114.58 117.57 2qee h GLU 64 Ca 0.38 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.26 2qee h GLU 64 Cb -0.04 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 27.84 2qee h GLU 64 CO -0.11 -0.03 0.39 0.00 -1.40 0.00 0.00 179.01 177.86 2qee h ALA 65 N 0.98 0.80 -0.10 3.43 0.00 -1.87 -2.28 119.26 120.21 2qee h ALA 65 Ca 0.02 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.94 2qee h ALA 65 Cb 0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2qee h ALA 65 CO -0.06 0.16 -0.15 0.35 0.00 0.00 0.00 179.25 179.55 2qee h PHE 66 N 0.78 -0.38 0.00 0.00 3.57 -0.48 -2.10 116.94 118.33 2qee h PHE 66 Ca 0.24 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 2qee h PHE 66 Cb -0.02 0.18 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 2qee h PHE 66 CO -0.04 -0.22 -0.06 -1.49 -2.23 0.00 0.00 178.31 174.27 2qee h TRP 67 N -0.20 0.00 0.00 0.41 -0.00 -0.91 -2.00 115.95 113.25 2qee h TRP 67 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.97 2qee h TRP 67 Cb 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.48 2qee h TRP 67 CO -0.25 0.06 0.00 0.00 -0.00 0.00 0.00 178.44 178.25 2qee h ALA 68 N 1.94 1.00 -2.54 1.49 0.00 -0.82 -3.46 119.26 116.87 2qee h ALA 68 Ca -0.00 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.40 2qee h ALA 68 Cb 0.34 0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.24 2qee h ALA 68 CO 0.01 0.00 0.39 -1.64 0.00 0.00 0.00 179.25 178.01 2qee s MET 69 N -3.22 2.79 0.84 0.00 -1.94 -0.75 -5.04 119.30 111.98 2qee s MET 69 Ca 0.07 1.52 -0.11 0.00 -1.71 0.00 0.00 55.69 55.46 2qee s MET 69 Cb 0.08 -1.94 0.10 0.00 2.01 0.00 0.00 34.83 35.08 2qee s MET 69 CO 0.62 -1.28 1.09 -1.54 -0.01 0.00 0.00 175.02 173.90 2qee s SER 70 N -2.28 3.98 0.18 3.03 1.04 -1.26 -4.78 113.70 113.60 2qee s SER 70 Ca 0.70 1.46 -0.14 0.00 0.48 0.00 0.00 55.95 58.45 2qee s SER 70 Cb -0.23 -2.16 0.15 0.00 0.10 0.00 0.00 66.02 63.88 2qee s SER 70 CO 0.39 -2.31 1.72 0.50 0.98 0.00 0.00 173.24 174.52 2qee h LYS 71 N -1.32 0.24 -0.59 4.02 3.64 -1.96 -0.04 116.57 120.56 2qee h LYS 71 Ca -0.48 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 58.92 2qee h LYS 71 Cb 1.27 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 33.00 2qee h LYS 71 CO 0.56 0.16 0.36 -0.09 -2.27 0.00 0.00 179.45 178.16 2qee h ARG 72 N 0.24 0.68 -0.71 1.90 2.43 -1.93 0.57 114.38 117.56 2qee h ARG 72 Ca 0.23 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 2qee h ARG 72 Cb 0.28 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 2qee h ARG 72 CO -0.28 0.45 0.22 0.93 -1.51 0.00 0.00 179.97 179.77 2qee h GLU 73 N 0.70 1.10 -0.50 0.20 5.08 -1.79 0.45 114.58 119.82 2qee h GLU 73 Ca 0.24 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2qee h GLU 73 Cb 0.04 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 2qee h GLU 73 CO -0.11 0.95 0.33 1.96 -1.00 0.00 0.00 179.01 181.14 2qee h GLN 74 N 1.04 0.66 -0.25 2.33 4.20 -0.50 -1.11 115.11 121.48 2qee h GLN 74 Ca 0.23 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 2qee h GLN 74 Cb 0.31 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2qee h GLN 74 CO -0.01 0.44 0.11 0.00 -0.67 0.00 0.00 178.83 178.71 2qee h ALA 75 N 1.18 0.32 -0.67 3.87 0.00 -0.63 -0.81 119.26 122.52 2qee h ALA 75 Ca 0.18 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.08 2qee h ALA 75 Cb -0.07 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.55 2qee h ALA 75 CO -0.04 -0.09 0.32 -0.44 0.00 0.00 0.00 179.25 178.99 2qee h ASP 76 N 0.26 0.40 -0.24 0.00 3.32 -0.72 0.65 116.42 120.09 2qee h ASP 76 Ca 0.08 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 2qee h ASP 76 Cb 0.16 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 2qee h ASP 76 CO -0.01 0.23 0.06 0.25 -1.72 0.00 0.00 179.24 178.05 2qee h LEU 77 N 0.55 0.36 -0.67 1.55 5.85 -0.75 -1.05 115.31 121.14 2qee h LEU 77 Ca 0.33 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2qee h LEU 77 Cb 0.36 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 2qee h LEU 77 CO -0.27 0.49 0.38 0.40 -0.34 0.00 0.00 178.44 179.10 2qee h ILE 78 N 0.20 1.21 0.08 4.05 2.04 -0.90 0.49 117.51 124.68 2qee h ILE 78 Ca 0.07 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.44 2qee h ILE 78 Cb 0.28 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2qee h ILE 78 CO 0.00 0.22 -0.12 -0.25 0.00 0.00 0.00 178.15 178.00 2qee h TRP 79 N 0.92 -0.32 -0.46 1.37 2.91 -0.70 0.09 115.95 119.76 2qee h TRP 79 Ca 0.24 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.26 2qee h TRP 79 Cb 0.02 0.13 -0.02 0.00 -0.51 0.00 0.00 29.16 28.78 2qee h TRP 79 CO -0.01 -0.19 0.28 1.49 -1.03 0.00 0.00 178.44 178.99 2qee h GLU 80 N -0.25 0.62 0.07 2.65 4.57 -0.78 -0.98 114.58 120.48 2qee h GLU 80 Ca 0.02 -0.05 -0.26 0.00 -1.18 0.00 0.00 59.36 57.89 2qee h GLU 80 Cb 0.26 -0.13 0.01 0.00 -0.16 0.00 0.00 28.75 28.73 2qee h GLU 80 CO -0.07 0.45 -1.11 0.93 -1.18 0.00 0.00 179.01 178.04 2qee h GLU 81 N 0.62 0.43 0.00 1.92 4.39 -0.79 -0.25 114.58 120.90 2qee h GLU 81 Ca 0.17 -0.56 0.00 0.00 0.34 0.00 0.00 59.36 59.31 2qee h GLU 81 Cb -0.02 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2qee h GLU 81 CO -0.03 1.21 -1.21 1.28 -1.16 0.00 0.00 179.01 179.10 2qee n LEU 82 N -3.70 0.48 -0.01 1.33 4.77 0.01 -3.90 117.00 115.97 2qee n LEU 82 Ca -0.09 -0.30 -0.02 0.00 -0.03 0.00 0.00 56.01 55.58 2qee n LEU 82 Cb 0.93 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.00 2qee n LEU 82 CO 0.54 0.12 -0.58 0.49 -1.33 0.00 0.00 177.39 176.63 2qee n PHE 83 N -1.69 0.00 -0.10 -1.77 3.72 -0.43 -3.35 117.46 113.84 2qee n PHE 83 Ca 0.01 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.20 2qee n PHE 83 Cb 0.34 -0.10 -0.11 0.00 -0.94 0.00 0.00 39.48 38.67 2qee n PHE 83 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2qee h ILE 84 N 0.00 0.89 0.00 4.37 1.08 -1.22 -3.40 117.51 119.24 2qee h ILE 84 Ca -0.06 -2.13 -0.08 0.00 -0.39 0.00 0.00 64.86 62.21 2qee h ILE 84 Cb 1.10 2.14 -0.01 0.00 -3.07 0.00 0.00 36.82 36.98 2qee h ILE 84 CO -0.00 0.30 -0.37 0.11 -0.69 0.00 0.00 178.15 177.50 2qee h LYS 85 N -1.00 0.00 -4.33 2.37 1.57 -1.22 -3.45 116.57 110.52 2qee h LYS 85 Ca -0.33 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.27 2qee h LYS 85 Cb 1.26 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.40 2qee h LYS 85 CO -0.20 0.37 -0.70 1.03 -0.57 0.00 0.00 179.45 179.38 2qee s ARG 86 N -3.24 0.57 0.30 3.15 3.00 -1.25 -5.06 118.95 116.42 2qee s ARG 86 Ca 0.03 -1.02 -0.29 0.00 0.00 0.00 0.00 55.73 54.45 2qee s ARG 86 Cb 0.08 0.01 -0.10 0.00 0.00 0.00 0.00 34.95 34.94 2qee s ARG 86 CO 0.70 -0.05 1.14 -1.12 0.00 0.00 0.00 175.30 175.97 2qee s SER 87 N -2.36 7.11 -1.39 0.23 0.01 -1.26 -3.49 113.70 112.53 2qee s SER 87 Ca -0.00 2.34 -0.09 0.00 1.31 0.00 0.00 55.95 59.51 2qee s SER 87 Cb -0.00 -2.63 -0.07 0.00 0.21 0.00 0.00 66.02 63.53 2qee s SER 87 CO -0.05 -0.26 2.66 -0.81 0.41 0.00 0.00 173.24 175.19 2qee n PRO 88 N 0.99 3.14 0.07 12.44 -0.04 -1.21 -4.63 135.00 145.76 2qee n PRO 88 Ca -0.00 -1.99 0.12 0.00 -0.04 0.00 0.00 63.50 61.59 2qee n PRO 88 Cb 0.45 -2.72 0.29 0.00 -0.04 0.00 0.00 33.50 31.47 2qee n PRO 88 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2qee n VAL 89 N 3.88 0.40 -1.20 0.52 0.24 -1.26 -3.16 118.33 117.74 2qee n VAL 89 Ca 0.67 -0.25 -0.32 0.00 -2.04 0.00 0.00 64.34 62.41 2qee n VAL 89 Cb 0.21 -0.29 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 -4.19 4.15 0.23 -1.34 1.04 -1.26 -4.72 113.70 107.60 2qee s SER 90 Ca 0.09 2.00 -0.08 0.00 0.48 0.00 0.00 55.95 58.44 2qee s SER 90 Cb 0.14 -2.54 0.26 0.00 0.10 0.00 0.00 66.02 63.97 2qee s SER 90 CO 0.66 -2.28 1.85 -0.08 0.98 0.00 0.00 173.24 174.38 2qee h GLU 91 N -1.07 0.91 -0.25 4.02 4.57 -1.96 0.75 114.58 121.54 2qee h GLU 91 Ca -0.44 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 57.55 2qee h GLU 91 Cb 1.25 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.62 2qee h GLU 91 CO 0.49 0.60 -0.41 0.00 -1.18 0.00 0.00 179.01 178.51 2qee h ALA 92 N 1.35 0.82 0.04 2.92 0.00 -1.94 -0.30 119.26 122.15 2qee h ALA 92 Ca 0.33 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2qee h ALA 92 Cb 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2qee h ALA 92 CO -0.14 0.65 -0.02 0.00 0.00 0.00 0.00 179.25 179.74 2qee h ARG 94 N -0.48 0.49 -0.58 0.00 2.43 -0.79 -2.02 114.38 113.44 2qee h ARG 94 Ca -0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2qee h ARG 94 Cb 0.44 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.85 2qee h ARG 94 CO 0.01 0.32 0.37 0.78 -1.51 0.00 0.00 179.97 179.95 2qee h GLY 95 N 0.50 0.82 0.65 2.80 0.00 -0.72 -0.42 103.07 106.70 2qee h GLY 95 Ca 0.61 -0.32 0.08 0.00 0.00 0.00 0.00 47.33 47.70 2qee h GLY 95 CO -0.50 0.31 0.56 -2.08 0.00 0.00 0.00 176.54 174.83 2qee h VAL 96 N 0.79 1.01 -0.41 4.60 2.07 -1.09 -1.94 116.25 121.28 2qee h VAL 96 Ca 0.21 -0.34 -0.13 0.00 0.82 0.00 0.00 66.70 67.26 2qee h VAL 96 Cb -0.07 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.63 2qee h VAL 96 CO -0.04 0.18 -0.26 -0.07 0.02 0.00 0.00 177.57 177.39 2qee h LEU 97 N 0.98 0.93 -0.72 2.57 3.38 -1.14 -1.82 115.31 119.48 2qee h LEU 97 Ca 0.41 -0.43 0.09 0.00 0.09 0.00 0.00 57.88 58.04 2qee h LEU 97 Cb 0.25 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.67 2qee h LEU 97 CO -0.20 1.16 0.38 0.74 0.09 0.00 0.00 178.44 180.61 2qee h THR 98 N 0.71 0.88 -0.03 0.22 2.02 -0.56 -0.17 112.91 115.98 2qee h THR 98 Ca 0.08 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 2qee h THR 98 Cb 0.84 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2qee h THR 98 CO 0.07 0.12 0.01 0.00 0.37 0.00 0.00 175.52 176.09 2qee h LEU 100 N -0.19 -0.81 -1.02 0.00 3.38 -0.97 -1.13 115.31 114.56 2qee h LEU 100 Ca 0.01 0.13 0.06 0.00 0.09 0.00 0.00 57.88 58.16 2qee h LEU 100 Cb 0.25 0.36 -0.06 0.00 0.09 0.00 0.00 40.66 41.29 2qee h LEU 100 CO 0.00 -0.31 0.65 -0.61 0.09 0.00 0.00 178.44 178.26 2qee h GLN 101 N -0.33 1.16 -0.83 1.13 4.15 -0.93 -1.67 115.11 117.80 2qee h GLN 101 Ca 0.10 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 2qee h GLN 101 Cb 0.48 -0.26 -0.04 0.00 0.21 0.00 0.00 27.48 27.87 2qee h GLN 101 CO -0.32 0.77 0.45 0.78 -1.93 0.00 0.00 178.83 178.58 2qee h GLY 102 N 1.20 1.24 1.19 2.39 0.00 -0.04 -0.31 103.07 108.74 2qee h GLY 102 Ca 0.42 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2qee h GLY 102 CO -0.15 0.54 0.00 1.04 0.00 0.00 0.00 176.54 177.97 2qee n LEU 103 N -4.34 0.00 0.00 3.11 4.77 -0.52 -4.88 117.00 115.15 2qee n LEU 103 Ca 0.09 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 2qee n LEU 103 Cb 0.10 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2qee n LEU 103 CO 0.39 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2qee n GLY 104 N 0.49 0.66 3.87 -0.72 0.00 -0.13 -5.06 105.19 104.31 2qee n GLY 104 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 3.25 -0.36 0.99 1.43 -0.65 -5.01 118.68 118.33 2qee s LEU 105 Ca 0.00 1.36 -0.01 0.00 -1.03 0.00 0.00 54.13 54.45 2qee s LEU 105 Cb 0.00 -4.38 0.09 0.00 0.03 0.00 0.00 46.19 41.93 2qee s LEU 105 CO 0.00 -0.87 0.10 -0.62 0.23 0.00 0.00 176.35 175.19 2qee s ASP 106 N -4.18 5.02 0.52 2.29 2.15 -1.26 -3.99 116.67 117.21 2qee s ASP 106 Ca 0.54 -1.80 0.35 0.00 0.43 0.00 0.00 52.55 52.08 2qee s ASP 106 Cb -0.11 -1.74 1.82 0.00 -0.30 0.00 0.00 42.92 42.58 2qee s ASP 106 CO 0.53 -0.41 2.06 -0.65 -0.17 0.00 0.00 175.17 176.53 2qee h PRO 107 N 7.94 0.00 -0.75 4.34 0.11 -1.91 -2.82 132.00 138.92 2qee h PRO 107 Ca -0.14 0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.11 2qee h PRO 107 Cb 1.05 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.11 2qee h PRO 107 CO 0.60 0.00 0.50 0.00 -0.21 0.00 0.00 178.00 178.89 2qee h ALA 108 N 2.02 2.07 0.00 -0.75 0.00 -2.01 -1.85 119.26 118.74 2qee h ALA 108 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2qee h ALA 108 Cb 0.09 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2qee h ALA 108 CO 0.00 -0.27 -0.06 1.79 0.00 0.00 0.00 179.25 180.71 2qee h THR 109 N 0.45 0.12 -3.22 0.00 1.35 -1.94 -3.47 112.91 106.19 2qee h THR 109 Ca 0.36 -1.07 -0.30 0.00 -0.55 0.00 0.00 66.41 64.85 2qee h THR 109 Cb 0.79 1.97 -0.03 0.00 -1.73 0.00 0.00 68.15 69.15 2qee h THR 109 CO -0.12 0.06 -0.36 0.54 -0.25 0.00 0.00 175.52 175.39 2qee n ARG 110 N -3.12 -1.95 -3.17 4.72 1.74 -0.70 -4.90 116.66 109.29 2qee n ARG 110 Ca 0.03 0.74 -0.45 0.00 -0.77 0.00 0.00 57.85 57.40 2qee n ARG 110 Cb 0.52 -5.31 -0.01 0.00 -1.02 0.00 0.00 32.46 26.64 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 -2.07 6.95 0.41 0.55 -1.08 -1.26 -4.85 116.67 115.32 2qee s ASP 111 Ca 0.00 -2.86 0.11 0.00 -0.52 0.00 0.00 52.55 49.28 2qee s ASP 111 Cb 0.00 -2.29 0.87 0.00 -1.46 0.00 0.00 42.92 40.04 2qee s ASP 111 CO 0.00 -0.64 1.96 0.25 0.52 0.00 0.00 175.17 177.26 2qee h LEU 112 N 8.43 0.18 -0.33 -1.34 5.85 -1.99 -1.34 115.31 124.78 2qee h LEU 112 Ca 0.18 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.87 2qee h LEU 112 Cb 0.96 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 2qee h LEU 112 CO 1.00 0.31 0.21 1.56 -0.34 0.00 0.00 178.44 181.18 2qee h GLN 113 N 0.19 0.44 -0.52 1.25 1.08 -2.00 -1.10 115.11 114.45 2qee h GLN 113 Ca 0.04 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.18 2qee h GLN 113 Cb 0.30 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 2qee h GLN 113 CO 0.02 0.31 0.21 0.28 -0.95 0.00 0.00 178.83 178.69 2qee h VAL 114 N 0.44 1.22 -0.79 -0.54 2.07 -1.81 -2.93 116.25 113.90 2qee h VAL 114 Ca 0.12 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 66.98 2qee h VAL 114 Cb -0.03 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 2qee h VAL 114 CO -0.02 0.25 0.52 1.88 0.02 0.00 0.00 177.57 180.22 2qee h TYR 115 N 0.69 0.99 -0.61 1.57 0.05 -0.96 -1.57 116.97 117.13 2qee h TYR 115 Ca 0.17 0.02 0.13 0.00 0.05 0.00 0.00 58.73 59.11 2qee h TYR 115 Cb 0.20 -0.33 -0.03 0.00 1.01 0.00 0.00 36.73 37.57 2qee h TYR 115 CO 0.01 0.61 0.42 0.00 -1.05 0.00 0.00 178.16 178.15 2qee h ARG 116 N 1.06 0.25 -0.01 4.88 3.08 -1.03 -2.09 114.38 120.52 2qee h ARG 116 Ca 0.30 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.27 2qee h ARG 116 Cb -0.10 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 2qee h ARG 116 CO -0.07 0.17 -0.29 0.93 -1.07 0.00 0.00 179.97 179.64 2qee h GLU 117 N 0.26 0.03 -0.37 0.04 5.08 -1.14 -2.42 114.58 116.05 2qee h GLU 117 Ca 0.29 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.69 2qee h GLU 117 Cb 0.80 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.01 2qee h GLU 117 CO -0.06 0.31 0.13 -0.92 -1.00 0.00 0.00 179.01 177.47 2qee h TYR 118 N 0.02 0.24 0.00 4.33 3.20 -1.38 -2.95 116.97 120.43 2qee h TYR 118 Ca 0.00 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.71 2qee h TYR 118 Cb 0.52 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 2qee h TYR 118 CO 0.00 0.10 -0.82 0.74 -1.64 0.00 0.00 178.16 176.54 2qee h PHE 119 N 0.29 0.08 0.00 -3.82 0.04 -1.53 -3.20 116.94 108.80 2qee h PHE 119 Ca 0.17 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 2qee h PHE 119 Cb 0.14 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.29 2qee h PHE 119 CO -0.14 0.85 -0.02 0.00 -0.60 0.00 0.00 178.31 178.39 2qee h ALA 120 N 1.14 1.06 -0.02 2.45 0.00 -1.31 -2.81 119.26 119.77 2qee h ALA 120 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qee h ALA 120 Cb 1.44 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2qee h ALA 120 CO 0.11 0.03 0.00 0.36 0.00 0.00 0.00 179.25 179.75 2qee n LYS 121 N -3.20 1.66 -4.39 0.00 2.85 -1.21 -4.96 118.16 108.91 2qee n LYS 121 Ca -0.01 -0.96 -0.26 0.00 -1.05 0.00 0.00 58.31 56.03 2qee n LYS 121 Cb 0.19 -1.48 -0.10 0.00 -0.65 0.00 0.00 35.03 32.99 2qee n LYS 121 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2qee s LYS 122 N -2.00 1.78 0.49 -1.58 1.02 -1.06 -5.14 119.74 113.25 2qee s LYS 122 Ca 0.38 -1.51 -0.01 0.00 0.02 0.00 0.00 55.97 54.86 2qee s LYS 122 Cb 0.21 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.58 2qee s LYS 122 CO 0.33 0.39 0.72 0.95 -0.92 0.00 0.00 175.35 176.83 2qee s THR 123 N -1.95 3.80 0.22 2.17 -4.23 -1.26 -4.97 115.64 109.42 2qee s THR 123 Ca 0.25 -0.42 -0.08 0.00 -1.18 0.00 0.00 61.69 60.26 2qee s THR 123 Cb -0.07 -3.43 0.16 0.00 1.34 0.00 0.00 72.50 70.50 2qee s THR 123 CO 0.13 -0.33 1.78 0.28 -0.54 0.00 0.00 174.62 175.95 2qee h SER 124 N 0.26 0.45 -0.37 3.99 0.02 -1.97 -1.63 113.55 114.30 2qee h SER 124 Ca -0.46 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 2qee h SER 124 Cb 1.26 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.76 2qee h SER 124 CO 0.57 0.27 0.24 -0.33 -1.14 0.00 0.00 176.83 176.44 2qee h GLU 125 N 0.59 0.48 -0.82 3.45 3.07 -1.94 0.57 114.58 119.99 2qee h GLU 125 Ca 0.33 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 59.16 2qee h GLU 125 Cb 0.32 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.09 2qee h GLU 125 CO -0.25 0.33 0.51 0.93 -1.40 0.00 0.00 179.01 179.12 2qee h GLU 126 N 0.49 1.10 -0.45 2.33 5.08 -1.88 -1.29 114.58 119.96 2qee h GLU 126 Ca 0.13 -0.09 -0.14 0.00 -1.00 0.00 0.00 59.36 58.26 2qee h GLU 126 Cb -0.05 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 28.96 2qee h GLU 126 CO -0.03 0.76 -0.26 0.37 -1.00 0.00 0.00 179.01 178.85 2qee h GLN 127 N 1.11 0.97 -0.06 2.33 5.75 -0.81 -0.95 115.11 123.46 2qee h GLN 127 Ca 0.29 -0.44 0.01 0.00 -0.15 0.00 0.00 58.65 58.37 2qee h GLN 127 Cb -0.07 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 2qee h GLN 127 CO -0.06 1.11 -0.01 0.28 -2.65 0.00 0.00 178.83 177.50 2qee h VAL 128 N 0.82 0.96 -0.55 2.39 2.07 -0.74 0.11 116.25 121.32 2qee h VAL 128 Ca 0.10 -0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.70 2qee h VAL 128 Cb 0.84 0.94 -0.07 0.00 -1.52 0.00 0.00 31.29 31.48 2qee h VAL 128 CO 0.07 0.00 0.15 0.44 0.02 0.00 0.00 177.57 178.26 2qee h ASP 129 N 0.01 0.09 0.13 0.57 3.32 -0.93 -0.19 116.42 119.43 2qee h ASP 129 Ca 0.03 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 2qee h ASP 129 Cb 0.03 0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.68 2qee h ASP 129 CO -0.05 0.07 -0.06 0.74 -1.72 0.00 0.00 179.24 178.22 2qee h THR 130 N 0.30 0.91 -0.23 0.35 2.02 -0.88 -2.26 112.91 113.13 2qee h THR 130 Ca 0.28 -0.15 -0.04 0.00 0.77 0.00 0.00 66.41 67.27 2qee h THR 130 Cb 0.36 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 2qee h THR 130 CO -0.32 0.04 0.00 0.58 0.37 0.00 0.00 175.52 176.18 2qee h VAL 131 N -0.24 1.25 0.00 3.16 2.07 -0.55 -0.63 116.25 121.31 2qee h VAL 131 Ca -0.02 -0.88 -0.05 0.00 0.82 0.00 0.00 66.70 66.57 2qee h VAL 131 Cb 0.19 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 2qee h VAL 131 CO 0.03 0.27 -0.23 -0.07 0.02 0.00 0.00 177.57 177.59 2qee h LEU 132 N 0.17 0.00 0.18 2.57 3.38 -1.06 0.10 115.31 120.66 2qee h LEU 132 Ca 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2qee h LEU 132 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2qee h LEU 132 CO 0.01 0.23 -0.09 -0.61 0.09 0.00 0.00 178.44 178.07 2qee h GLN 133 N 0.00 -0.24 -0.69 1.13 -0.00 -1.11 -1.54 115.11 112.66 2qee h GLN 133 Ca -0.00 0.02 -0.06 0.00 -0.00 0.00 0.00 58.65 58.61 2qee h GLN 133 Cb 0.44 0.05 -0.03 0.00 0.00 0.00 0.00 27.48 27.95 2qee h GLN 133 CO 0.03 0.12 0.21 -0.07 0.00 0.00 0.00 178.83 179.12 2qee h LEU 134 N -0.66 1.01 0.00 -2.39 3.38 -0.82 -1.77 115.31 114.07 2qee h LEU 134 Ca -0.03 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2qee h LEU 134 Cb 0.47 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2qee h LEU 134 CO 0.04 0.96 0.00 0.00 0.09 0.00 0.00 178.44 179.53 2qee n ALA 135 N -2.43 2.38 -3.99 1.53 0.00 0.33 -4.95 120.51 113.37 2qee n ALA 135 Ca 0.05 -0.13 -0.26 0.00 0.00 0.00 0.00 53.44 53.10 2qee n ALA 135 Cb 0.23 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 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 -1.31 -0.44 -4.40 0.00 5.15 -0.66 -4.82 115.26 108.77 2qee n ASN 136 Ca 0.12 -1.02 -0.36 0.00 -0.60 0.00 0.00 54.58 52.72 2qee n ASN 136 Cb 0.24 -2.95 -0.13 0.00 -0.53 0.00 0.00 39.78 36.41 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 -3.94 3.96 -0.03 3.44 1.01 -0.71 -0.72 120.40 123.41 2qee s VAL 137 Ca 0.05 -0.29 0.12 0.00 0.00 0.00 0.00 61.98 61.86 2qee s VAL 137 Cb -0.03 -2.83 -0.20 0.00 0.00 0.00 0.00 36.38 33.32 2qee s VAL 137 CO 0.90 0.38 0.82 0.77 0.00 0.00 0.00 175.10 177.97 2qee h SER 138 N 8.09 0.00 -3.51 3.32 4.64 -1.38 -3.44 113.55 121.26 2qee h SER 138 Ca -0.39 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.70 2qee h SER 138 Cb 1.17 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.96 2qee h SER 138 CO 0.59 0.92 -0.58 -1.81 -0.87 0.00 0.00 176.83 175.08 2qee s ASP 139 N -6.16 -0.13 -0.14 4.97 1.01 -1.15 -4.71 116.67 110.35 2qee s ASP 139 Ca -0.03 0.31 0.02 0.00 0.71 0.00 0.00 52.55 53.56 2qee s ASP 139 Cb 0.08 0.22 0.00 0.00 1.01 0.00 0.00 42.92 44.24 2qee s ASP 139 CO 0.82 -0.12 -0.20 -0.69 0.21 0.00 0.00 175.17 175.19 2qee s VAL 140 N 0.91 2.29 -0.21 -1.27 1.01 0.93 -0.57 120.40 123.49 2qee s VAL 140 Ca -0.07 -0.90 -0.15 0.00 0.00 0.00 0.00 61.98 60.85 2qee s VAL 140 Cb -0.09 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 2qee s VAL 140 CO -0.05 0.54 0.38 -0.69 0.00 0.00 0.00 175.10 175.28 2qee s VAL 141 N 0.75 5.21 0.77 2.92 1.01 -0.22 -0.24 120.40 130.60 2qee s VAL 141 Ca -0.08 0.66 -0.08 0.00 0.00 0.00 0.00 61.98 62.48 2qee s VAL 141 Cb -0.16 -3.71 0.11 0.00 0.00 0.00 0.00 36.38 32.62 2qee s VAL 141 CO 0.00 0.25 1.09 -0.04 0.00 0.00 0.00 175.10 176.40 2qee s MET 142 N 1.34 1.70 -0.31 2.72 -1.94 0.10 -1.43 119.30 121.49 2qee s MET 142 Ca 0.18 -0.47 -0.02 0.00 -1.71 0.00 0.00 55.69 53.67 2qee s MET 142 Cb -0.15 -2.12 0.06 0.00 2.01 0.00 0.00 34.83 34.63 2qee s MET 142 CO 0.08 -1.57 0.02 0.99 -0.01 0.00 0.00 175.02 174.52 2qee s THR 143 N -3.38 3.00 -0.26 2.05 2.01 -1.03 -3.47 115.64 114.56 2qee s THR 143 Ca 0.65 -1.48 -0.05 0.00 0.31 0.00 0.00 61.69 61.12 2qee s THR 143 Cb -0.08 -2.77 0.01 0.00 0.01 0.00 0.00 72.50 69.66 2qee s THR 143 CO 0.47 -0.18 0.01 0.20 -0.69 0.00 0.00 174.62 174.43 2qee s ASN 144 N 1.30 4.70 -0.42 3.53 -0.87 -0.01 -4.95 114.94 118.22 2qee s ASN 144 Ca -0.03 -0.64 -0.07 0.00 -1.57 0.00 0.00 52.86 50.55 2qee s ASN 144 Cb -0.20 -1.79 0.09 0.00 -0.02 0.00 0.00 41.25 39.33 2qee s ASN 144 CO -0.02 -0.12 0.24 -0.62 -2.57 0.00 0.00 177.10 174.02 2qee s ASP 145 N 1.45 5.50 0.00 -1.22 2.15 -1.26 -0.73 116.67 122.57 2qee s ASP 145 Ca 0.03 -1.70 0.12 0.00 0.43 0.00 0.00 52.55 51.43 2qee s ASP 145 Cb -0.16 -1.93 0.55 0.00 -0.30 0.00 0.00 42.92 41.08 2qee s ASP 145 CO -0.01 -0.55 1.33 -0.81 -0.17 0.00 0.00 175.17 174.96 2qee n PRO 146 N 4.81 0.08 0.00 4.34 -0.04 -1.26 -1.89 135.00 141.05 2qee n PRO 146 Ca -0.08 0.24 0.12 0.00 -0.04 0.00 0.00 63.50 63.74 2qee n PRO 146 Cb 0.42 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.66 2qee n PRO 146 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2qee n PHE 147 N -1.40 0.03 -2.97 0.54 3.72 -1.26 -4.70 117.46 111.43 2qee n PHE 147 Ca 0.04 0.01 -0.41 0.00 -0.05 0.00 0.00 57.45 57.04 2qee n PHE 147 Cb 0.12 -0.29 -0.05 0.00 -0.94 0.00 0.00 39.48 38.31 2qee n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2qee s ASP 148 N -3.06 6.76 0.22 4.37 2.15 -0.79 -4.96 116.67 121.36 2qee s ASP 148 Ca 0.11 0.94 -0.08 0.00 0.43 0.00 0.00 52.55 53.95 2qee s ASP 148 Cb 0.17 -2.40 0.25 0.00 -0.30 0.00 0.00 42.92 40.64 2qee s ASP 148 CO 0.69 -0.45 1.83 0.44 -0.17 0.00 0.00 175.17 177.51 2qee h ASP 149 N 7.69 0.67 0.50 -0.34 3.32 -1.87 0.73 116.42 127.11 2qee h ASP 149 Ca -0.25 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.80 2qee h ASP 149 Cb 1.11 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 2qee h ASP 149 CO 0.84 0.44 -0.42 -1.13 -1.72 0.00 0.00 179.24 177.24 2qee h ASN 150 N 0.81 -1.13 -0.90 6.45 -1.24 -1.94 -2.49 115.58 115.12 2qee h ASN 150 Ca 0.31 0.09 0.02 0.00 0.71 0.00 0.00 56.30 57.43 2qee h ASN 150 Cb 0.14 0.37 -0.05 0.00 0.73 0.00 0.00 38.32 39.51 2qee h ASN 150 CO -0.16 -0.60 0.59 -0.33 -1.29 0.00 0.00 177.43 175.64 2qee h GLU 151 N -0.91 1.15 -0.87 6.67 5.08 -1.72 -2.85 114.58 121.13 2qee h GLU 151 Ca -0.05 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 2qee h GLU 151 Cb 0.79 -0.26 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 2qee h GLU 151 CO -0.02 0.76 0.45 -0.09 -1.00 0.00 0.00 179.01 179.10 2qee h ARG 152 N 1.18 1.24 -0.31 2.33 2.43 -0.64 -3.03 114.38 117.59 2qee h ARG 152 Ca 0.35 -0.17 0.04 0.00 -0.81 0.00 0.00 59.98 59.39 2qee h ARG 152 Cb -0.07 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 29.21 2qee h ARG 152 CO -0.10 0.93 0.06 0.82 -1.51 0.00 0.00 179.97 180.17 2qee h ILE 153 N 1.24 0.85 -0.40 1.20 2.04 -1.20 0.79 117.51 122.02 2qee h ILE 153 Ca 0.30 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 66.18 2qee h ILE 153 Cb 0.08 0.67 -0.06 0.00 -0.74 0.00 0.00 36.82 36.76 2qee h ILE 153 CO -0.04 0.03 0.01 -1.28 0.00 0.00 0.00 178.15 176.86 2qee h SER 154 N 0.16 -0.15 -0.65 1.72 0.87 -1.58 0.38 113.55 114.30 2qee h SER 154 Ca 0.14 0.09 -0.07 0.00 -1.23 0.00 0.00 61.79 60.73 2qee h SER 154 Cb 0.16 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.25 2qee h SER 154 CO -0.19 -0.04 0.14 -0.50 -0.53 0.00 0.00 176.83 175.71 2qee h TRP 155 N 0.11 1.11 -0.12 2.24 4.06 -1.35 -1.96 115.95 120.05 2qee h TRP 155 Ca 0.20 -0.14 -0.04 0.00 2.06 0.00 0.00 58.89 60.96 2qee h TRP 155 Cb 0.27 -0.31 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 2qee h TRP 155 CO -0.26 0.93 -0.13 -0.07 -3.56 0.00 0.00 178.44 175.35 2qee h LEU 156 N 0.98 0.17 0.00 -4.49 3.38 0.29 -1.27 115.31 114.37 2qee h LEU 156 Ca 0.20 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2qee h LEU 156 Cb 0.39 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2qee h LEU 156 CO 0.01 0.33 0.00 -0.62 0.09 0.00 0.00 178.44 178.24 2qee n GLU 157 N -4.30 0.87 -1.15 1.13 1.02 0.12 -4.91 120.64 113.43 2qee n GLU 157 Ca -0.01 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.08 2qee n GLU 157 Cb 0.25 -1.38 -0.02 0.00 -0.02 0.00 0.00 31.44 30.27 2qee n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qee n GLY 158 N 0.65 0.79 3.69 0.62 0.00 -0.48 -5.00 105.19 105.46 2qee n GLY 158 Ca 0.16 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 2qee n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qee s LYS 159 N -2.41 4.22 -0.03 1.61 1.02 -0.76 -5.02 119.74 118.36 2qee s LYS 159 Ca 0.00 2.26 -0.00 0.00 0.02 0.00 0.00 55.97 58.24 2qee s LYS 159 Cb 0.00 -3.56 -0.04 0.00 -0.52 0.00 0.00 37.83 33.71 2qee s LYS 159 CO 0.00 -0.69 0.03 -0.65 -0.92 0.00 0.00 175.35 173.12 2qee s GLN 160 N 2.49 2.95 0.71 1.68 -1.52 -1.26 -4.60 119.66 120.10 2qee s GLN 160 Ca 0.72 -0.49 -0.14 0.00 -1.95 0.00 0.00 55.36 53.49 2qee s GLN 160 Cb -0.38 -2.78 0.03 0.00 -0.22 0.00 0.00 33.01 29.65 2qee s GLN 160 CO 0.31 0.66 1.14 -1.25 -0.25 0.00 0.00 175.29 175.90 2qee s PRO 161 N -1.36 2.42 0.59 2.91 0.04 -1.26 -5.01 135.00 133.32 2qee s PRO 161 Ca 0.18 1.49 -0.18 0.00 0.04 0.00 0.00 61.00 62.53 2qee s PRO 161 Cb -0.12 -1.89 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 2qee s PRO 161 CO 0.08 -1.56 -0.07 -3.47 0.04 0.00 0.00 177.00 172.02 2qee n ASP 162 N -2.75 -3.42 0.05 6.66 -0.08 -1.26 -4.86 116.55 110.88 2qee n ASP 162 Ca 0.11 0.61 0.11 0.00 -1.51 0.00 0.00 54.79 54.11 2qee n ASP 162 Cb 0.52 -0.91 0.44 0.00 2.34 0.00 0.00 41.12 43.51 2qee n ASP 162 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2qee n SER 163 N 2.15 0.29 0.08 1.67 3.41 -1.26 -1.79 113.62 118.17 2qee n SER 163 Ca 0.07 0.55 0.13 0.00 -0.26 0.00 0.00 58.87 59.37 2qee n SER 163 Cb 0.48 -0.62 0.40 0.00 -0.26 0.00 0.00 64.21 64.21 2qee n SER 163 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qee n ARG 164 N -1.80 0.21 -4.70 4.33 1.74 -1.26 -4.81 116.66 110.37 2qee n ARG 164 Ca 0.04 0.15 -0.33 0.00 -0.77 0.00 0.00 57.85 56.94 2qee n ARG 164 Cb 0.26 -1.72 -0.14 0.00 -1.02 0.00 0.00 32.46 29.83 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 -3.09 2.82 0.03 -1.55 0.08 -0.74 -0.05 117.98 115.48 2qee s PHE 165 Ca 0.11 -0.69 0.08 0.00 0.12 0.00 0.00 56.93 56.54 2qee s PHE 165 Cb 0.14 -1.86 -0.03 0.00 -0.57 0.00 0.00 43.02 40.70 2qee s PHE 165 CO 0.61 -0.25 -0.22 -1.01 -0.10 0.00 0.00 175.22 174.25 2qee s HIS 166 N 0.45 2.45 0.33 0.36 3.76 0.67 -4.69 115.29 118.63 2qee s HIS 166 Ca -0.09 -0.33 -0.12 0.00 -0.15 0.00 0.00 55.06 54.37 2qee s HIS 166 Cb -0.16 -1.45 -0.07 0.00 1.11 0.00 0.00 32.58 32.01 2qee s HIS 166 CO 0.05 0.17 0.70 0.00 -0.85 0.00 0.00 174.74 174.80 2qee s ALA 167 N -0.83 3.40 -0.03 -1.40 0.00 -1.26 0.02 121.76 121.66 2qee s ALA 167 Ca 0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 51.96 51.92 2qee s ALA 167 Cb -0.10 -2.65 0.02 0.00 0.00 0.00 0.00 23.12 20.39 2qee s ALA 167 CO 0.03 0.23 0.07 0.00 0.00 0.00 0.00 175.76 176.09 2qee s ALA 168 N -2.11 -0.10 -0.50 0.00 0.00 -1.23 -0.99 121.76 116.84 2qee s ALA 168 Ca 0.51 0.33 -0.24 0.00 0.00 0.00 0.00 51.96 52.56 2qee s ALA 168 Cb -0.10 -0.23 0.04 0.00 0.00 0.00 0.00 23.12 22.82 2qee s ALA 168 CO 0.24 -0.08 0.86 -1.17 0.00 0.00 0.00 175.76 175.61 2qee s LEU 169 N 0.63 4.21 -0.11 0.00 2.96 -0.63 -0.83 118.68 124.91 2qee s LEU 169 Ca -0.05 -0.24 -0.29 0.00 -0.22 0.00 0.00 54.13 53.33 2qee s LEU 169 Cb -0.07 -2.90 -0.01 0.00 0.50 0.00 0.00 46.19 43.70 2qee s LEU 169 CO -0.02 -1.07 0.97 -0.60 -1.32 0.00 0.00 176.35 174.31 2qee s ARG 170 N 3.59 4.41 -0.01 1.98 3.52 0.10 -1.17 118.95 131.36 2qee s ARG 170 Ca 0.30 1.33 0.04 0.00 -0.13 0.00 0.00 55.73 57.27 2qee s ARG 170 Cb -0.12 -3.54 0.10 0.00 -1.56 0.00 0.00 34.95 29.82 2qee s ARG 170 CO 0.21 -0.30 1.08 1.28 -0.81 0.00 0.00 175.30 176.76 2qee n LEU 171 N 4.99 2.29 -0.21 -0.88 4.77 0.12 -4.49 117.00 123.58 2qee n LEU 171 Ca 0.08 -2.08 0.02 0.00 -0.03 0.00 0.00 56.01 53.99 2qee n LEU 171 Cb 0.49 -0.09 0.12 0.00 -2.33 0.00 0.00 43.42 41.61 2qee n LEU 171 CO 0.51 0.57 0.88 0.44 -1.33 0.00 0.00 177.39 178.47 2qee h ASP 172 N 0.53 -0.13 -0.17 -1.43 5.19 -1.94 -0.51 116.42 117.97 2qee h ASP 172 Ca 0.00 0.14 -0.03 0.00 -0.62 0.00 0.00 57.03 56.52 2qee h ASP 172 Cb 0.61 0.22 -0.01 0.00 0.18 0.00 0.00 39.33 40.32 2qee h ASP 172 CO 0.00 -0.06 0.03 -0.65 -3.12 0.00 0.00 179.24 175.45 2qee h PRO 173 N 0.19 0.36 -0.06 3.56 0.11 -1.94 0.11 132.00 134.33 2qee h PRO 173 Ca 0.34 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.35 2qee h PRO 173 Cb 0.55 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.60 2qee h PRO 173 CO -0.49 0.37 -0.13 1.25 -0.21 0.00 0.00 178.00 178.79 2qee h LEU 174 N 0.36 0.22 0.14 2.35 5.85 -1.46 -2.05 115.31 120.73 2qee h LEU 174 Ca 0.09 -0.57 -0.29 0.00 0.84 0.00 0.00 57.88 57.94 2qee h LEU 174 Cb 0.19 -0.06 0.03 0.00 0.37 0.00 0.00 40.66 41.19 2qee h LEU 174 CO 0.00 0.75 -1.23 -0.07 -0.34 0.00 0.00 178.44 177.55 2qee h LEU 175 N -0.30 0.83 0.00 2.25 4.07 -0.99 -3.27 115.31 117.89 2qee h LEU 175 Ca 0.00 -0.85 0.00 0.00 0.08 0.00 0.00 57.88 57.11 2qee h LEU 175 Cb 0.71 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.19 2qee h LEU 175 CO 0.03 1.60 -1.45 0.59 -1.08 0.00 0.00 178.44 178.13 2qee n ASN 176 N -3.83 0.54 -2.78 -0.43 3.02 0.36 -3.54 115.26 108.59 2qee n ASN 176 Ca -0.14 -0.52 -0.02 0.00 -0.03 0.00 0.00 54.58 53.87 2qee n ASN 176 Cb 0.98 1.44 0.05 0.00 -0.61 0.00 0.00 39.78 41.64 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 -1.86 1.80 -0.12 3.52 1.02 -0.78 -4.96 120.64 119.27 2qee n GLU 177 Ca 0.00 -3.53 -0.06 0.00 -0.02 0.00 0.00 57.16 53.55 2qee n GLU 177 Cb 0.44 -1.62 0.02 0.00 -0.02 0.00 0.00 31.44 30.26 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 2.61 0.28 -0.68 -0.32 3.20 -1.60 0.13 116.97 120.59 2qee h TYR 178 Ca -0.11 0.02 0.13 0.00 3.14 0.00 0.00 58.73 61.91 2qee h TYR 178 Cb 1.28 -0.07 -0.13 0.00 1.54 0.00 0.00 36.73 39.35 2qee h TYR 178 CO 0.52 0.12 -0.21 0.93 -1.64 0.00 0.00 178.16 177.88 2qee h GLU 179 N 0.32 -0.04 -0.07 1.82 4.39 -1.91 0.36 114.58 119.46 2qee h GLU 179 Ca 0.17 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.69 2qee h GLU 179 Cb 0.13 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.79 2qee h GLU 179 CO -0.16 -0.02 -0.76 1.96 -1.16 0.00 0.00 179.01 178.86 2qee h GLN 180 N -0.04 0.41 0.00 2.33 7.50 -1.83 -3.32 115.11 120.17 2qee h GLN 180 Ca 0.32 -0.35 -0.07 0.00 0.50 0.00 0.00 58.65 59.05 2qee h GLN 180 Cb 0.52 0.08 -0.01 0.00 0.05 0.00 0.00 27.48 28.12 2qee h GLN 180 CO -0.72 1.00 -0.39 1.15 -1.50 0.00 0.00 178.83 178.37 2qee h THR 181 N 0.27 0.51 0.00 -0.54 2.02 0.80 -3.31 112.91 112.66 2qee h THR 181 Ca -0.04 -1.73 -0.01 0.00 0.77 0.00 0.00 66.41 65.40 2qee h THR 181 Cb 1.35 2.22 -0.00 0.00 -1.74 0.00 0.00 68.15 69.98 2qee h THR 181 CO 0.13 0.29 -0.04 0.07 0.37 0.00 0.00 175.52 176.35 2qee h LYS 182 N 0.00 0.00 -0.24 6.66 2.10 -0.46 -1.68 116.57 122.94 2qee h LYS 182 Ca -0.01 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.50 2qee h LYS 182 Cb 1.25 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.57 2qee h LYS 182 CO 0.04 0.04 -0.42 0.45 -2.00 0.00 0.00 179.45 177.55 2qee h HIS 183 N 0.00 0.71 -0.22 0.07 3.86 -1.78 -1.91 115.15 115.88 2qee h HIS 183 Ca -0.00 -0.21 -0.20 0.00 -1.16 0.00 0.00 60.37 58.80 2qee h HIS 183 Cb 0.08 -0.15 0.01 0.00 1.06 0.00 0.00 27.41 28.41 2qee h HIS 183 CO 0.00 0.91 -0.63 0.00 0.86 0.00 0.00 177.93 179.07 2qee h ARG 184 N 0.48 0.82 -0.59 2.45 3.08 -1.53 -1.22 114.38 117.88 2qee h ARG 184 Ca 0.04 -0.59 0.08 0.00 0.07 0.00 0.00 59.98 59.58 2qee h ARG 184 Cb 0.94 0.10 -0.07 0.00 0.08 0.00 0.00 29.97 31.02 2qee h ARG 184 CO 0.08 1.21 0.24 -0.07 -1.07 0.00 0.00 179.97 180.36 2qee h LEU 185 N 0.58 0.26 -0.50 3.04 3.38 -1.29 -0.15 115.31 120.63 2qee h LEU 185 Ca -0.02 0.07 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 2qee h LEU 185 Cb 1.25 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2qee h LEU 185 CO 0.14 0.17 -0.57 0.08 0.09 0.00 0.00 178.44 178.34 2qee h ARG 186 N 0.43 0.55 -0.80 1.13 0.11 -1.21 0.54 114.38 115.13 2qee h ARG 186 Ca 0.29 -0.36 0.18 0.00 0.10 0.00 0.00 59.98 60.19 2qee h ARG 186 Cb 0.32 0.05 -0.05 0.00 1.11 0.00 0.00 29.97 31.39 2qee h ARG 186 CO -0.27 0.97 0.54 -0.44 0.10 0.00 0.00 179.97 180.87 2qee h ASP 187 N 0.42 0.32 -0.14 0.08 3.32 -0.75 -0.69 116.42 118.97 2qee h ASP 187 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2qee h ASP 187 Cb 1.12 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.63 2qee h ASP 187 CO 0.11 0.15 0.00 0.79 -1.72 0.00 0.00 179.24 178.56 2qee n TRP 188 N -4.46 0.18 -0.47 4.55 8.01 -0.11 -4.91 117.44 120.24 2qee n TRP 188 Ca 0.16 -0.09 0.00 0.00 -1.31 0.00 0.00 57.50 56.26 2qee n TRP 188 Cb 0.65 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.95 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 1.03 0.75 3.49 6.99 0.00 -0.27 -5.02 105.19 112.16 2qee n GLY 189 Ca 0.15 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.42 1.61 2.02 0.10 -4.96 117.35 115.77 2qee s TYR 190 Ca 0.00 -0.29 -0.12 0.00 -0.37 0.00 0.00 57.07 56.29 2qee s TYR 190 Cb 0.00 -3.35 0.07 0.00 -0.40 0.00 0.00 41.96 38.28 2qee s TYR 190 CO 0.00 -0.91 2.21 1.63 -1.57 0.00 0.00 175.55 176.91 2qee n LYS 191 N 6.13 3.26 -2.71 -0.62 4.76 -1.26 -3.03 118.16 124.69 2qee n LYS 191 Ca -0.04 -2.88 -0.40 0.00 -2.87 0.00 0.00 58.31 52.12 2qee n LYS 191 Cb 0.47 -3.10 -0.06 0.00 -1.84 0.00 0.00 35.03 30.51 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 2.03 3.99 0.53 -0.18 -7.23 -1.26 -4.51 120.40 113.77 2qee s VAL 192 Ca 0.48 2.00 0.00 0.00 -1.81 0.00 0.00 61.98 62.64 2qee s VAL 192 Cb 0.13 -4.27 0.02 0.00 0.56 0.00 0.00 36.38 32.83 2qee s VAL 192 CO -0.06 0.47 0.77 0.20 -0.31 0.00 0.00 175.10 176.16 2qee s ASN 193 N -1.15 5.44 0.35 4.85 0.01 -1.26 -4.97 114.94 118.20 2qee s ASN 193 Ca 0.42 0.15 0.10 0.00 -0.71 0.00 0.00 52.86 52.83 2qee s ASN 193 Cb -0.27 -1.14 0.64 0.00 0.41 0.00 0.00 41.25 40.90 2qee s ASN 193 CO 0.33 -1.03 1.80 0.44 -1.51 0.00 0.00 177.10 177.13 2qee h ASP 194 N 0.11 0.10 -2.91 -1.22 5.19 -2.03 -3.43 116.42 112.24 2qee h ASP 194 Ca -0.44 -0.04 -0.57 0.00 -0.62 0.00 0.00 57.03 55.36 2qee h ASP 194 Cb 1.28 -0.03 -0.03 0.00 0.18 0.00 0.00 39.33 40.73 2qee h ASP 194 CO 0.55 0.46 -0.40 -1.83 -3.12 0.00 0.00 179.24 174.90 2qee s GLU 195 N -4.24 3.51 -1.20 3.56 -1.05 -1.26 -5.02 118.70 113.00 2qee s GLU 195 Ca -0.04 -0.34 -0.19 0.00 -0.15 0.00 0.00 54.97 54.26 2qee s GLU 195 Cb 0.14 -2.92 0.08 0.00 -0.44 0.00 0.00 34.13 30.99 2qee s GLU 195 CO 0.74 0.50 1.60 -0.46 0.95 0.00 0.00 175.26 178.59 2qee s TRP 196 N -1.69 2.80 0.10 4.83 -0.11 -1.26 -4.67 118.94 118.94 2qee s TRP 196 Ca 0.38 -1.45 0.00 0.00 1.22 0.00 0.00 56.10 56.25 2qee s TRP 196 Cb -0.12 -4.67 0.00 0.00 -1.50 0.00 0.00 33.47 27.18 2qee s TRP 196 CO 0.27 -1.79 0.02 0.27 -4.62 0.00 0.00 176.95 171.11 2qee n ASN 197 N 8.16 1.99 0.03 5.86 0.23 -1.26 -4.96 115.26 125.30 2qee n ASN 197 Ca 0.42 -1.41 0.03 0.00 -0.53 0.00 0.00 54.58 53.08 2qee n ASN 197 Cb 0.47 0.05 0.39 0.00 -2.08 0.00 0.00 39.78 38.61 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 0.47 0.62 -3.83 4.57 -1.99 -0.98 114.58 113.44 2qee h GLU 198 Ca -0.08 -0.06 -0.03 0.00 -1.18 0.00 0.00 59.36 58.01 2qee h GLU 198 Cb 0.25 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2qee h GLU 198 CO 0.13 0.40 -0.31 0.78 -1.18 0.00 0.00 179.01 178.83 2qee h GLY 199 N 0.64 -0.89 0.38 1.92 0.00 -1.93 -0.64 103.07 102.54 2qee h GLY 199 Ca 0.12 0.34 0.04 0.00 0.00 0.00 0.00 47.33 47.82 2qee h GLY 199 CO -0.01 -0.32 -0.23 1.76 0.00 0.00 0.00 176.54 177.74 2qee h SER 200 N -0.85 -0.70 -0.48 0.19 0.02 -1.71 -1.78 113.55 108.24 2qee h SER 200 Ca -0.08 0.11 0.10 0.00 -0.84 0.00 0.00 61.79 61.07 2qee h SER 200 Cb 0.66 0.30 -0.09 0.00 0.14 0.00 0.00 62.40 63.41 2qee h SER 200 CO 0.13 -0.29 -0.15 0.40 -1.14 0.00 0.00 176.83 175.78 2qee h ILE 201 N -0.32 0.47 -0.26 3.27 2.04 -1.11 -0.83 117.51 120.76 2qee h ILE 201 Ca 0.08 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.86 2qee h ILE 201 Cb 0.44 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2qee h ILE 201 CO -0.26 0.00 -0.20 1.56 0.00 0.00 0.00 178.15 179.25 2qee h GLN 202 N -0.03 0.48 0.05 2.37 1.08 -0.74 -1.30 115.11 117.01 2qee h GLN 202 Ca 0.23 -0.16 -0.26 0.00 -1.45 0.00 0.00 58.65 57.01 2qee h GLN 202 Cb 0.39 -0.04 0.01 0.00 -0.05 0.00 0.00 27.48 27.80 2qee h GLN 202 CO -0.52 0.65 -1.09 0.93 -0.95 0.00 0.00 178.83 177.86 2qee h GLU 203 N 0.43 0.51 -0.54 1.46 4.39 -0.75 0.01 114.58 120.09 2qee h GLU 203 Ca 0.07 -0.62 -0.01 0.00 0.34 0.00 0.00 59.36 59.14 2qee h GLU 203 Cb 0.59 0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 29.41 2qee h GLU 203 CO 0.04 1.24 0.30 0.28 -1.16 0.00 0.00 179.01 179.72 2qee h VAL 204 N 0.26 1.18 -0.95 3.13 2.07 -1.09 -0.93 116.25 119.93 2qee h VAL 204 Ca -0.13 -0.45 0.05 0.00 0.82 0.00 0.00 66.70 66.99 2qee h VAL 204 Cb 1.75 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 31.95 2qee h VAL 204 CO 0.20 0.19 0.61 0.11 0.02 0.00 0.00 177.57 178.70 2qee h LYS 205 N 0.73 1.10 -0.67 1.57 1.57 -1.08 -1.26 116.57 118.53 2qee h LYS 205 Ca 0.19 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 2qee h LYS 205 Cb 0.04 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 2qee h LYS 205 CO -0.03 0.73 0.24 -0.09 -0.57 0.00 0.00 179.45 179.73 2qee h ARG 206 N 1.14 1.00 -0.36 3.15 2.43 -0.71 0.15 114.38 121.16 2qee h ARG 206 Ca 0.40 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 2qee h ARG 206 Cb 0.10 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.47 2qee h ARG 206 CO -0.15 0.83 0.13 0.35 -1.51 0.00 0.00 179.97 179.62 2qee h PHE 207 N 0.97 0.57 0.13 2.20 3.57 -0.65 0.12 116.94 123.84 2qee h PHE 207 Ca 0.22 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 2qee h PHE 207 Cb 0.22 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.80 2qee h PHE 207 CO 0.02 0.53 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.49 2qee h LEU 208 N 0.44 -0.15 -0.82 0.59 3.38 -0.90 -2.07 115.31 115.77 2qee h LEU 208 Ca 0.12 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2qee h LEU 208 Cb 0.21 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2qee h LEU 208 CO -0.01 -0.07 0.41 0.74 0.09 0.00 0.00 178.44 179.60 2qee h THR 209 N -0.21 1.25 -0.39 0.22 2.02 -0.61 -0.33 112.91 114.86 2qee h THR 209 Ca -0.02 -0.69 0.03 0.00 0.77 0.00 0.00 66.41 66.50 2qee h THR 209 Cb 0.17 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.73 2qee h THR 209 CO 0.03 0.30 0.19 0.44 0.37 0.00 0.00 175.52 176.85 2qee h ASP 210 N 1.16 0.28 0.27 4.18 3.32 -0.68 -1.10 116.42 123.85 2qee h ASP 210 Ca 0.28 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.24 2qee h ASP 210 Cb 0.10 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2qee h ASP 210 CO -0.04 0.21 -0.46 -0.50 -1.72 0.00 0.00 179.24 176.73 2qee h TRP 211 N 0.40 0.28 -0.42 4.55 4.06 -0.94 -1.55 115.95 122.33 2qee h TRP 211 Ca 0.17 -0.08 0.01 0.00 2.06 0.00 0.00 58.89 61.04 2qee h TRP 211 Cb 0.08 -0.06 -0.02 0.00 -1.00 0.00 0.00 29.16 28.15 2qee h TRP 211 CO -0.10 0.66 0.27 0.82 -3.56 0.00 0.00 178.44 176.53 2qee h ILE 212 N 0.19 1.10 -0.26 1.49 2.04 -0.83 0.21 117.51 121.45 2qee h ILE 212 Ca 0.01 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.70 2qee h ILE 212 Cb 0.89 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 2qee h ILE 212 CO 0.07 0.10 0.11 -0.08 0.00 0.00 0.00 178.15 178.36 2qee h GLU 213 N 0.56 0.24 -0.15 2.37 4.81 -0.93 0.24 114.58 121.71 2qee h GLU 213 Ca 0.15 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.31 2qee h GLU 213 Cb -0.06 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 2qee h GLU 213 CO -0.04 0.16 -0.12 -0.09 -0.73 0.00 0.00 179.01 178.19 2qee h ARG 214 N 0.25 0.35 0.00 1.92 2.43 -0.99 -3.35 114.38 114.99 2qee h ARG 214 Ca 0.11 -0.18 -0.23 0.00 -0.81 0.00 0.00 59.98 58.87 2qee h ARG 214 Cb 0.05 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 2qee h ARG 214 CO -0.09 0.71 -1.36 0.52 -1.51 0.00 0.00 179.97 178.25 2qee h MET 215 N 0.00 0.00 -6.41 0.20 2.86 -0.57 -3.49 114.93 107.53 2qee h MET 215 Ca 0.03 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.19 2qee h MET 215 Cb 0.63 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.32 2qee h MET 215 CO 0.03 0.59 -0.94 -3.47 1.06 0.00 0.00 176.91 174.19 2qee n ASP 216 N -3.12 -3.68 -4.78 1.22 2.03 0.82 -4.59 116.55 104.46 2qee n ASP 216 Ca -0.09 -1.06 -0.35 0.00 0.52 0.00 0.00 54.79 53.81 2qee n ASP 216 Cb 0.96 -3.04 -0.02 0.00 -0.72 0.00 0.00 41.12 38.30 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 -6.35 3.65 0.39 -0.67 0.04 -1.26 -4.61 135.00 126.19 2qee s PRO 217 Ca 0.34 1.56 0.21 0.00 0.04 0.00 0.00 61.00 63.15 2qee s PRO 217 Cb -0.13 -2.17 0.27 0.00 0.04 0.00 0.00 34.50 32.51 2qee s PRO 217 CO 0.89 -0.59 1.57 -0.39 0.04 0.00 0.00 177.00 178.51 2qee h VAL 218 N 1.55 0.27 -2.84 -0.36 -1.51 -1.41 -3.47 116.25 108.47 2qee h VAL 218 Ca -0.50 -1.37 0.07 0.00 -1.23 0.00 0.00 66.70 63.68 2qee h VAL 218 Cb 1.24 2.12 -0.08 0.00 -2.13 0.00 0.00 31.29 32.45 2qee h VAL 218 CO 0.59 0.15 0.29 -0.72 -1.23 0.00 0.00 177.57 176.65 2qee s TYR 219 N -3.14 -0.27 -0.08 5.19 -0.85 -1.26 -4.32 117.35 112.62 2qee s TYR 219 Ca 0.06 -0.09 -0.00 0.00 -0.52 0.00 0.00 57.07 56.52 2qee s TYR 219 Cb 0.06 0.65 -0.03 0.00 0.38 0.00 0.00 41.96 43.02 2qee s TYR 219 CO 0.69 -1.04 -0.06 -1.64 -1.52 0.00 0.00 175.55 171.99 2qee s MET 220 N -3.72 2.92 0.07 -3.49 -1.94 -0.73 -1.61 119.30 110.81 2qee s MET 220 Ca 0.09 -0.54 0.05 0.00 -1.71 0.00 0.00 55.69 53.58 2qee s MET 220 Cb -0.04 -2.66 -0.03 0.00 2.01 0.00 0.00 34.83 34.12 2qee s MET 220 CO 0.01 0.59 -0.13 0.00 -0.01 0.00 0.00 175.02 175.48 2qee s ALA 221 N -0.61 1.11 -0.08 3.03 0.00 -0.32 0.58 121.76 125.47 2qee s ALA 221 Ca 0.09 -1.00 -0.13 0.00 0.00 0.00 0.00 51.96 50.92 2qee s ALA 221 Cb -0.12 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 22.96 2qee s ALA 221 CO 0.02 0.12 0.33 0.54 0.00 0.00 0.00 175.76 176.77 2qee s VAL 222 N -1.41 0.03 -0.06 0.00 0.11 -0.47 -0.71 120.40 117.88 2qee s VAL 222 Ca -0.02 -0.21 -0.04 0.00 -2.93 0.00 0.00 61.98 58.78 2qee s VAL 222 Cb -0.09 -0.54 -0.04 0.00 -1.53 0.00 0.00 36.38 34.18 2qee s VAL 222 CO 0.02 -0.12 0.14 -0.44 -3.33 0.00 0.00 175.10 171.37 2qee s SER 223 N -0.49 6.19 0.04 3.54 0.01 -1.26 -1.01 113.70 120.72 2qee s SER 223 Ca -0.06 0.36 0.02 0.00 1.31 0.00 0.00 55.95 57.57 2qee s SER 223 Cb -0.04 -1.94 -0.02 0.00 0.21 0.00 0.00 66.02 64.23 2qee s SER 223 CO 0.02 0.34 -0.07 -0.76 0.41 0.00 0.00 173.24 173.18 2qee s LEU 224 N -1.43 2.27 0.69 2.44 1.43 0.52 -4.93 118.68 119.66 2qee s LEU 224 Ca 0.20 -0.57 -0.11 0.00 -1.03 0.00 0.00 54.13 52.63 2qee s LEU 224 Cb -0.12 -0.10 0.01 0.00 0.03 0.00 0.00 46.19 46.01 2qee s LEU 224 CO 0.10 -0.24 1.07 -2.16 0.23 0.00 0.00 176.35 175.35 2qee s PRO 225 N -1.69 2.91 0.60 1.29 0.04 -1.26 -0.54 135.00 136.35 2qee s PRO 225 Ca -0.10 0.42 0.30 0.00 0.04 0.00 0.00 61.00 61.65 2qee s PRO 225 Cb -0.09 -2.06 1.71 0.00 0.04 0.00 0.00 34.50 34.10 2qee s PRO 225 CO -0.00 -0.97 2.12 -1.35 0.04 0.00 0.00 177.00 176.84 2qee h PRO 226 N -0.57 0.00 -0.02 0.56 0.11 -1.76 -1.35 132.00 128.96 2qee h PRO 226 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2qee h PRO 226 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2qee h PRO 226 CO 0.63 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.67 2qee n THR 227 N -3.71 0.03 -1.65 -1.15 -2.24 -1.26 -3.92 114.28 100.38 2qee n THR 227 Ca 0.01 -0.06 -0.53 0.00 -2.27 0.00 0.00 64.05 61.21 2qee n THR 227 Cb 0.30 -0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 68.26 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 -0.64 1.87 -4.01 4.78 7.35 -0.51 -4.98 117.46 121.32 2qee n PHE 228 Ca 0.16 0.49 -0.11 0.00 -0.76 0.00 0.00 57.45 57.23 2qee n PHE 228 Cb 0.12 -2.43 -0.12 0.00 0.35 0.00 0.00 39.48 37.40 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 1.88 0.45 -0.20 -2.13 1.04 -1.26 -4.69 113.70 108.79 2qee s SER 229 Ca 0.89 -0.42 -0.13 0.00 0.48 0.00 0.00 55.95 56.78 2qee s SER 229 Cb -0.93 0.05 0.06 0.00 0.10 0.00 0.00 66.02 65.30 2qee s SER 229 CO 0.52 -0.19 0.49 0.12 0.98 0.00 0.00 173.24 175.16 2qee s PHE 230 N -1.12 -0.69 0.84 5.02 2.19 -1.26 -4.41 117.98 118.54 2qee s PHE 230 Ca -0.10 1.49 -0.12 0.00 0.33 0.00 0.00 56.93 58.53 2qee s PHE 230 Cb -0.08 0.33 0.10 0.00 -1.31 0.00 0.00 43.02 42.06 2qee s PHE 230 CO -0.00 -0.37 1.17 -2.14 1.83 0.00 0.00 175.22 175.71 2qee s PRO 231 N 1.20 1.50 -0.21 10.12 0.02 -1.26 -4.20 135.00 142.16 2qee s PRO 231 Ca -0.07 1.61 -0.17 0.00 0.02 0.00 0.00 61.00 62.39 2qee s PRO 231 Cb -0.07 -1.77 0.06 0.00 0.02 0.00 0.00 34.50 32.74 2qee s PRO 231 CO -0.11 -2.29 0.53 -2.00 -0.33 0.00 0.00 177.00 172.80 2qee s GLU 232 N -4.40 0.59 -1.25 5.54 2.12 -1.26 -5.05 118.70 114.99 2qee s GLU 232 Ca 0.69 0.81 -0.14 0.00 0.36 0.00 0.00 54.97 56.70 2qee s GLU 232 Cb -0.25 0.22 0.15 0.00 0.26 0.00 0.00 34.13 34.51 2qee s GLU 232 CO 0.53 -0.10 1.58 0.39 -0.54 0.00 0.00 175.26 177.12 2qee n GLU 233 N 3.26 3.35 -4.19 4.30 -0.58 -1.26 -3.96 120.64 121.56 2qee n GLU 233 Ca -0.16 -3.66 -0.12 0.00 -0.42 0.00 0.00 57.16 52.80 2qee n GLU 233 Cb 0.56 -3.13 -0.10 0.00 -0.57 0.00 0.00 31.44 28.21 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 2.87 0.22 0.21 1.62 1.04 -1.26 -5.00 113.70 113.40 2qee s SER 234 Ca 0.45 -1.38 -0.10 0.00 0.48 0.00 0.00 55.95 55.40 2qee s SER 234 Cb 0.01 0.40 0.21 0.00 0.10 0.00 0.00 66.02 66.74 2qee s SER 234 CO 0.02 -0.87 1.84 0.78 0.98 0.00 0.00 173.24 175.98 2qee h ASN 235 N 2.57 0.69 -0.20 7.02 2.35 -1.90 -0.34 115.58 125.77 2qee h ASN 235 Ca -0.35 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.42 2qee h ASN 235 Cb 1.25 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 39.46 2qee h ASN 235 CO 0.51 0.47 0.10 -0.09 -1.65 0.00 0.00 177.43 176.77 2qee h ARG 236 N 0.83 0.21 -0.46 0.81 2.43 -1.90 -0.67 114.38 115.62 2qee h ARG 236 Ca 0.29 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.38 2qee h ARG 236 Cb 0.06 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 2qee h ARG 236 CO -0.13 0.14 0.01 0.78 -1.51 0.00 0.00 179.97 179.26 2qee h GLY 237 N 0.22 0.82 0.93 2.80 0.00 -1.58 -1.61 103.07 104.64 2qee h GLY 237 Ca 0.08 -0.53 -0.14 0.00 0.00 0.00 0.00 47.33 46.74 2qee h GLY 237 CO -0.05 0.49 -0.45 3.21 0.00 0.00 0.00 176.54 179.75 2qee h ARG 238 N 0.71 0.59 -0.48 4.80 3.08 -0.85 -2.51 114.38 119.72 2qee h ARG 238 Ca 0.14 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.76 2qee h ARG 238 Cb 0.42 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 2qee h ARG 238 CO 0.02 1.04 0.24 0.82 -1.07 0.00 0.00 179.97 181.02 2qee h ILE 239 N 0.25 1.18 -0.13 2.04 2.04 -0.98 0.75 117.51 122.66 2qee h ILE 239 Ca -0.01 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 2qee h ILE 239 Cb 1.06 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 2qee h ILE 239 CO 0.10 0.20 0.08 0.40 0.00 0.00 0.00 178.15 178.92 2qee h ILE 240 N 0.63 1.07 -0.06 -0.67 2.04 -1.35 0.93 117.51 120.10 2qee h ILE 240 Ca 0.17 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2qee h ILE 240 Cb 0.09 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2qee h ILE 240 CO -0.02 0.06 0.00 -0.09 0.00 0.00 0.00 178.15 178.10 2qee h ARG 241 N 0.13 0.10 0.00 2.37 2.43 -1.30 -0.75 114.38 117.36 2qee h ARG 241 Ca 0.05 -0.03 -0.25 0.00 -0.81 0.00 0.00 59.98 58.94 2qee h ARG 241 Cb 0.04 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.54 2qee h ARG 241 CO -0.01 0.37 -1.47 -0.44 -1.51 0.00 0.00 179.97 176.91 2qee h ASP 242 N -0.18 0.00 0.00 -3.80 3.32 -0.88 -3.41 116.42 111.47 2qee h ASP 242 Ca 0.02 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2qee h ASP 242 Cb 0.32 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.87 2qee h ASP 242 CO 0.00 0.90 -0.29 0.00 -1.72 0.00 0.00 179.24 178.13 2qee h LEU 244 N -0.04 -0.36 -0.09 0.00 7.12 -0.85 -2.30 115.31 118.79 2qee h LEU 244 Ca -0.01 -0.10 -0.00 0.00 0.13 0.00 0.00 57.88 57.90 2qee h LEU 244 Cb 0.28 0.09 -0.00 0.00 -0.53 0.00 0.00 40.66 40.50 2qee h LEU 244 CO -0.00 -0.11 0.05 -0.07 -0.13 0.00 0.00 178.44 178.17 2qee h LEU 245 N -0.61 0.11 -0.62 2.25 3.38 -1.36 0.63 115.31 119.09 2qee h LEU 245 Ca -0.04 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.89 2qee h LEU 245 Cb 0.44 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 2qee h LEU 245 CO 0.07 0.16 0.36 -0.65 0.09 0.00 0.00 178.44 178.47 2qee h PRO 246 N 0.06 0.67 -0.22 1.13 0.11 -1.78 -0.95 132.00 131.03 2qee h PRO 246 Ca 0.03 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 2qee h PRO 246 Cb 0.07 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.01 2qee h PRO 246 CO -0.01 0.45 0.10 0.28 -0.21 0.00 0.00 178.00 178.61 2qee h VAL 247 N 0.69 1.14 -0.76 3.15 2.07 -1.21 -1.27 116.25 120.06 2qee h VAL 247 Ca 0.26 -0.40 0.07 0.00 0.82 0.00 0.00 66.70 67.46 2qee h VAL 247 Cb 0.09 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.81 2qee h VAL 247 CO -0.14 0.14 0.44 0.00 0.02 0.00 0.00 177.57 178.03 2qee h ALA 248 N 0.96 1.06 -0.36 1.67 0.00 -0.59 -1.54 119.26 120.46 2qee h ALA 248 Ca 0.07 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2qee h ALA 248 Cb 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2qee h ALA 248 CO -0.01 0.11 -0.15 1.49 0.00 0.00 0.00 179.25 180.69 2qee h GLU 249 N 0.78 0.73 -0.51 0.00 4.81 -0.93 0.26 114.58 119.71 2qee h GLU 249 Ca 0.35 -0.31 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2qee h GLU 249 Cb 0.25 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2qee h GLU 249 CO -0.21 0.91 0.32 -0.22 -0.73 0.00 0.00 179.01 179.08 2qee h LYS 250 N 0.52 0.69 -0.01 1.92 3.64 -0.83 -2.42 116.57 120.09 2qee h LYS 250 Ca 0.08 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2qee h LYS 250 Cb 0.68 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2qee h LYS 250 CO 0.05 0.49 -0.19 0.72 -2.27 0.00 0.00 179.45 178.25 2qee n HIS 251 N -4.70 0.00 -3.67 1.91 8.25 -0.62 -4.94 115.22 111.45 2qee n HIS 251 Ca 0.03 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.25 2qee n HIS 251 Cb 0.04 -0.12 0.06 0.00 1.12 0.00 0.00 29.99 31.09 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 -0.63 -3.72 -4.50 0.41 4.05 0.71 -5.00 115.26 106.58 2qee n ASN 252 Ca 0.14 -0.69 -0.34 0.00 0.45 0.00 0.00 54.58 54.14 2qee n ASN 252 Cb 0.33 -4.51 -0.12 0.00 1.23 0.00 0.00 39.78 36.71 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 -3.41 3.91 0.82 -1.44 1.01 -0.05 -4.87 121.20 117.17 2qee s ILE 253 Ca 0.33 -0.35 -0.12 0.00 0.00 0.00 0.00 60.65 60.52 2qee s ILE 253 Cb -0.16 -2.72 0.09 0.00 0.01 0.00 0.00 42.46 39.69 2qee s ILE 253 CO 0.78 0.49 1.15 -2.84 0.00 0.00 0.00 174.94 174.52 2qee s PRO 254 N 0.38 1.67 -0.26 2.79 0.02 -1.26 -4.58 135.00 133.76 2qee s PRO 254 Ca -0.04 1.52 -0.07 0.00 0.02 0.00 0.00 61.00 62.43 2qee s PRO 254 Cb -0.14 -1.80 -0.02 0.00 0.02 0.00 0.00 34.50 32.56 2qee s PRO 254 CO 0.03 -2.14 0.07 0.12 -0.33 0.00 0.00 177.00 174.74 2qee s PHE 255 N -2.51 3.09 -0.22 6.54 5.36 -0.18 -1.78 117.98 128.27 2qee s PHE 255 Ca 0.68 -0.56 -0.15 0.00 -0.96 0.00 0.00 56.93 55.93 2qee s PHE 255 Cb -0.23 -2.24 -0.04 0.00 -0.34 0.00 0.00 43.02 40.17 2qee s PHE 255 CO 0.53 -0.42 0.35 0.00 -1.46 0.00 0.00 175.22 174.23 2qee s ALA 256 N 1.59 3.57 -0.16 11.12 0.00 0.20 -1.16 121.76 136.90 2qee s ALA 256 Ca 0.06 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.38 2qee s ALA 256 Cb -0.15 -2.60 0.02 0.00 0.00 0.00 0.00 23.12 20.38 2qee s ALA 256 CO 0.03 -0.37 -0.21 -1.64 0.00 0.00 0.00 175.76 173.57 2qee s MET 257 N 1.46 3.01 -0.39 0.00 -1.94 0.42 -1.37 119.30 120.49 2qee s MET 257 Ca 0.16 -0.84 -0.04 0.00 -1.71 0.00 0.00 55.69 53.26 2qee s MET 257 Cb -0.15 -2.52 0.09 0.00 2.01 0.00 0.00 34.83 34.26 2qee s MET 257 CO 0.08 -0.13 0.18 -1.64 -0.01 0.00 0.00 175.02 173.50 2qee s MET 258 N 1.10 2.26 -0.12 2.03 -1.94 -0.18 -2.30 119.30 120.14 2qee s MET 258 Ca 0.00 -1.61 -0.02 0.00 -1.71 0.00 0.00 55.69 52.36 2qee s MET 258 Cb -0.14 -3.56 -0.03 0.00 2.01 0.00 0.00 34.83 33.11 2qee s MET 258 CO -0.09 -0.95 -0.05 0.42 -0.01 0.00 0.00 175.02 174.35 2qee s ILE 259 N 1.24 3.83 0.00 2.53 1.01 -0.36 -0.36 121.20 129.10 2qee s ILE 259 Ca 0.04 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.29 2qee s ILE 259 Cb -0.22 -2.64 0.00 0.00 0.01 0.00 0.00 42.46 39.61 2qee s ILE 259 CO -0.02 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.06 2qee n GLY 260 N 3.07 0.49 3.73 6.18 0.00 0.29 -0.25 105.19 118.71 2qee n GLY 260 Ca -0.18 0.00 -0.40 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 -0.96 4.84 -0.37 1.61 0.11 -1.09 -1.61 120.40 122.93 2qee s VAL 261 Ca 0.00 1.61 -0.07 0.00 -2.93 0.00 0.00 61.98 60.59 2qee s VAL 261 Cb 0.00 -4.11 0.06 0.00 -1.53 0.00 0.00 36.38 30.80 2qee s VAL 261 CO 0.00 0.31 0.16 -0.75 -3.33 0.00 0.00 175.10 171.50 2qee s LYS 262 N 0.29 2.55 0.33 1.54 2.20 -0.27 -4.00 119.74 122.39 2qee s LYS 262 Ca 0.39 -1.34 -0.26 0.00 -0.36 0.00 0.00 55.97 54.41 2qee s LYS 262 Cb -0.20 -3.57 -0.10 0.00 -1.51 0.00 0.00 37.83 32.45 2qee s LYS 262 CO 0.22 -0.80 0.99 0.15 -0.36 0.00 0.00 175.35 175.55 2qee s LYS 263 N 1.38 4.50 -1.36 4.03 -0.14 -1.26 -0.30 119.74 126.59 2qee s LYS 263 Ca 0.01 1.44 -0.02 0.00 -1.36 0.00 0.00 55.97 56.03 2qee s LYS 263 Cb -0.21 -2.80 0.01 0.00 -1.68 0.00 0.00 37.83 33.15 2qee s LYS 263 CO 0.02 0.18 0.70 0.54 -0.76 0.00 0.00 175.35 176.03 2qee n ARG 264 N 0.52 -4.75 0.25 1.68 1.74 -1.23 -4.87 116.66 110.01 2qee n ARG 264 Ca 0.02 0.58 0.14 0.00 -0.77 0.00 0.00 57.85 57.83 2qee n ARG 264 Cb 0.49 -5.13 0.53 0.00 -1.02 0.00 0.00 32.46 27.34 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 -1.89 0.15 -2.77 1.55 -1.51 -1.26 -3.34 116.25 107.16 2qee h VAL 265 Ca -0.61 -0.77 -0.61 0.00 -1.23 0.00 0.00 66.70 63.48 2qee h VAL 265 Cb 1.36 1.67 -0.40 0.00 -2.13 0.00 0.00 31.29 31.80 2qee h VAL 265 CO 0.59 0.06 -0.77 -2.28 -1.23 0.00 0.00 177.57 173.94 2qee s HIS 266 N -3.57 2.17 0.26 5.19 5.65 -0.95 -5.03 115.29 119.01 2qee s HIS 266 Ca 0.02 -2.69 -0.02 0.00 0.25 0.00 0.00 55.06 52.62 2qee s HIS 266 Cb 0.09 -1.78 0.47 0.00 -1.18 0.00 0.00 32.58 30.18 2qee s HIS 266 CO 0.59 -0.72 1.80 -1.35 -0.65 0.00 0.00 174.74 174.41 2qee h PRO 267 N 5.84 0.75 0.00 2.88 0.11 -1.85 -1.96 132.00 137.77 2qee h PRO 267 Ca 0.16 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.22 2qee h PRO 267 Cb 0.86 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.80 2qee h PRO 267 CO 0.52 0.50 -0.00 0.00 -0.21 0.00 0.00 178.00 178.80 2qee h ALA 268 N 1.50 1.22 0.00 -0.75 0.00 -1.95 -1.21 119.26 118.06 2qee h ALA 268 Ca 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2qee h ALA 268 Cb 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2qee h ALA 268 CO -0.29 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.25 2qee n LEU 269 N -3.40 0.00 0.00 0.00 4.77 -0.73 -4.99 117.00 112.65 2qee n LEU 269 Ca -0.03 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 2qee n LEU 269 Cb 0.08 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 2qee n LEU 269 CO 0.23 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.88 2qee n GLY 270 N 1.10 3.72 0.38 -0.72 0.00 -0.46 -1.48 105.19 107.73 2qee n GLY 270 Ca 0.14 -0.02 0.20 0.00 0.00 0.00 0.00 46.02 46.34 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 -0.08 1.61 3.32 -1.94 0.97 116.42 120.30 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 -2.43 2.53 1.15 3.45 0.00 -0.55 -4.12 120.51 120.53 2qee n ALA 272 Ca 0.08 -0.21 0.13 0.00 0.00 0.00 0.00 53.44 53.43 2qee n ALA 272 Cb 0.58 -1.10 0.30 0.00 0.00 0.00 0.00 19.45 19.23 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 0.77 0.62 3.92 0.00 0.00 0.34 -4.83 105.19 106.00 2qee n GLY 273 Ca 0.08 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.92 6.39 0.00 1.61 1.01 -1.26 -1.03 116.67 121.48 2qee s ASP 274 Ca 0.33 0.35 0.00 0.00 0.71 0.00 0.00 52.55 53.94 2qee s ASP 274 Cb 0.20 -1.99 0.00 0.00 1.01 0.00 0.00 42.92 42.14 2qee s ASP 274 CO 0.31 0.12 0.00 0.33 0.21 0.00 0.00 175.17 176.14 2qee n PHE 275 N 0.10 0.00 -4.08 4.23 7.35 0.58 -4.92 117.46 120.72 2qee n PHE 275 Ca -0.05 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.54 2qee n PHE 275 Cb 0.52 0.00 -0.11 0.00 0.35 0.00 0.00 39.48 40.24 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 -0.94 0.46 -0.02 -2.13 0.11 -1.26 -1.11 120.40 115.50 2qee s VAL 276 Ca 0.00 -1.36 -0.16 0.00 -2.93 0.00 0.00 61.98 57.53 2qee s VAL 276 Cb 0.00 -0.94 0.03 0.00 -1.53 0.00 0.00 36.38 33.94 2qee s VAL 276 CO 0.00 -0.61 0.34 -0.83 -3.33 0.00 0.00 175.10 170.67 2qee s GLY 277 N -2.10 -0.19 0.28 6.54 0.00 -0.63 -4.83 107.32 106.39 2qee s GLY 277 Ca -0.03 0.43 -0.29 0.00 0.00 0.00 0.00 44.72 44.82 2qee s GLY 277 CO -0.02 0.21 1.32 1.25 0.00 0.00 0.00 173.10 175.85 2qee s LYS 278 N -1.25 4.37 0.19 2.90 2.20 -1.26 -4.43 119.74 122.46 2qee s LYS 278 Ca -0.13 2.17 0.05 0.00 -0.36 0.00 0.00 55.97 57.70 2qee s LYS 278 Cb -0.05 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 33.12 2qee s LYS 278 CO 0.04 -0.21 0.17 0.00 -0.36 0.00 0.00 175.35 174.99 2qee s ALA 279 N -0.66 3.61 0.44 3.13 0.00 -1.26 -4.78 121.76 122.25 2qee s ALA 279 Ca 0.52 -1.26 -0.24 0.00 0.00 0.00 0.00 51.96 50.98 2qee s ALA 279 Cb -0.39 -1.38 -0.08 0.00 0.00 0.00 0.00 23.12 21.27 2qee s ALA 279 CO 0.47 0.42 1.23 0.45 0.00 0.00 0.00 175.76 178.34 2qee s SER 280 N -3.35 6.18 0.00 0.00 0.15 -1.25 -4.94 113.70 110.48 2qee s SER 280 Ca 0.32 2.49 0.28 0.00 0.70 0.00 0.00 55.95 59.73 2qee s SER 280 Cb -0.09 -2.62 1.01 0.00 -1.71 0.00 0.00 66.02 62.61 2qee s SER 280 CO 0.24 -0.92 1.75 0.23 1.20 0.00 0.00 173.24 175.74 2qee n MET 281 N -0.22 0.26 -0.25 5.44 2.81 -1.26 -4.40 117.12 119.49 2qee n MET 281 Ca 0.06 -0.09 -0.04 0.00 -1.81 0.00 0.00 57.70 55.82 2qee n MET 281 Cb 0.46 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.54 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 0.22 0.77 -0.34 7.83 3.32 -1.92 -0.04 116.42 126.26 2qee h ASP 282 Ca 0.00 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.94 2qee h ASP 282 Cb 0.45 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2qee h ASP 282 CO 0.00 0.54 -0.17 1.23 -1.72 0.00 0.00 179.24 179.13 2qee h GLY 283 N 0.91 0.77 0.96 2.75 0.00 -1.77 -0.45 103.07 106.24 2qee h GLY 283 Ca 0.27 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 2qee h GLY 283 CO -0.09 0.63 0.19 -2.08 0.00 0.00 0.00 176.54 175.19 2qee h VAL 284 N 0.48 1.21 -0.59 4.60 2.07 -1.75 -1.49 116.25 120.77 2qee h VAL 284 Ca 0.07 -0.63 0.07 0.00 0.82 0.00 0.00 66.70 67.03 2qee h VAL 284 Cb 0.70 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 31.17 2qee h VAL 284 CO 0.05 0.24 0.28 -0.08 0.02 0.00 0.00 177.57 178.08 2qee h GLU 285 N 0.61 0.51 0.10 1.57 4.81 -0.89 -1.64 114.58 119.65 2qee h GLU 285 Ca 0.16 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2qee h GLU 285 Cb 0.19 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.46 2qee h GLU 285 CO -0.01 0.33 -0.05 1.25 -0.73 0.00 0.00 179.01 179.80 2qee h HIS 286 N 0.52 -0.12 -0.35 0.92 2.76 -0.90 -1.43 115.15 116.54 2qee h HIS 286 Ca 0.28 -0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.51 2qee h HIS 286 Cb 0.24 0.04 -0.06 0.00 1.55 0.00 0.00 27.41 29.19 2qee h HIS 286 CO -0.12 -0.05 -0.00 -0.07 -1.30 0.00 0.00 177.93 176.39 2qee h LEU 287 N -0.17 -0.15 -0.39 0.26 3.38 -1.06 0.72 115.31 117.90 2qee h LEU 287 Ca -0.01 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2qee h LEU 287 Cb 0.13 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2qee h LEU 287 CO 0.02 -0.04 0.24 -0.07 0.09 0.00 0.00 178.44 178.69 2qee h LEU 288 N 0.09 0.47 -0.17 1.67 3.38 -1.15 -1.13 115.31 118.47 2qee h LEU 288 Ca 0.17 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 2qee h LEU 288 Cb 0.24 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2qee h LEU 288 CO -0.29 0.37 -0.10 -0.09 0.09 0.00 0.00 178.44 178.42 2qee h ARG 289 N 0.52 0.37 0.00 1.13 2.43 -1.04 -3.34 114.38 114.45 2qee h ARG 289 Ca 0.14 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2qee h ARG 289 Cb -0.02 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 2qee h ARG 289 CO -0.03 0.69 -0.59 0.39 -1.51 0.00 0.00 179.97 178.93 2qee n GLU 290 N -4.59 0.28 -3.18 0.20 -0.58 0.23 -4.10 120.64 108.90 2qee n GLU 290 Ca -0.05 0.09 -0.26 0.00 -0.42 0.00 0.00 57.16 56.52 2qee n GLU 290 Cb 0.32 -1.69 -0.06 0.00 -0.57 0.00 0.00 31.44 29.45 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 -2.10 3.23 0.29 -0.32 4.01 -0.43 -4.92 117.16 116.91 2qee n TYR 291 Ca 0.03 -4.02 0.16 0.00 -0.16 0.00 0.00 57.90 53.91 2qee n TYR 291 Cb 0.44 -0.50 0.74 0.00 -0.31 0.00 0.00 39.34 39.70 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 3.57 0.00 -0.36 -0.72 0.13 -1.71 -1.60 132.00 131.31 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 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2qee h PRO 292 CO 0.77 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.63 2qee n ASN 293 N -2.64 2.75 -4.71 1.44 5.03 -1.26 -4.87 115.26 111.00 2qee n ASN 293 Ca -0.00 -1.91 -0.29 0.00 0.87 0.00 0.00 54.58 53.24 2qee n ASN 293 Cb 0.16 -0.23 -0.07 0.00 -1.02 0.00 0.00 39.78 38.61 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 -1.39 5.14 -0.00 6.41 -0.87 -0.60 -4.76 114.94 118.86 2qee s ASN 294 Ca 0.36 -0.16 0.06 0.00 -1.57 0.00 0.00 52.86 51.54 2qee s ASN 294 Cb 0.20 -1.25 -0.03 0.00 -0.02 0.00 0.00 41.25 40.15 2qee s ASN 294 CO 0.28 0.16 -0.17 -0.54 -2.57 0.00 0.00 177.10 174.26 2qee s LYS 295 N -2.46 2.26 -0.05 -0.60 1.02 -1.26 -4.85 119.74 113.80 2qee s LYS 295 Ca 0.27 -0.85 0.01 0.00 0.02 0.00 0.00 55.97 55.42 2qee s LYS 295 Cb -0.11 -2.25 0.02 0.00 -0.52 0.00 0.00 37.83 34.96 2qee s LYS 295 CO 0.19 0.58 -0.07 -0.06 -0.92 0.00 0.00 175.35 175.07 2qee s PHE 296 N -0.81 0.98 -0.18 3.18 0.08 -0.05 -1.01 117.98 120.17 2qee s PHE 296 Ca 0.13 -0.31 -0.07 0.00 0.12 0.00 0.00 56.93 56.80 2qee s PHE 296 Cb -0.10 -0.80 -0.04 0.00 -0.57 0.00 0.00 43.02 41.51 2qee s PHE 296 CO 0.03 -0.22 0.04 -0.51 -0.10 0.00 0.00 175.22 174.46 2qee s LEU 297 N 0.84 3.70 0.00 -0.37 1.43 -0.31 -0.99 118.68 122.99 2qee s LEU 297 Ca -0.12 0.04 0.04 0.00 -1.03 0.00 0.00 54.13 53.05 2qee s LEU 297 Cb -0.15 -1.93 -0.01 0.00 0.03 0.00 0.00 46.19 44.13 2qee s LEU 297 CO 0.01 0.17 -0.11 -0.69 0.23 0.00 0.00 176.35 175.96 2qee s VAL 298 N 0.38 0.89 0.03 -1.59 1.01 -0.44 -0.44 120.40 120.24 2qee s VAL 298 Ca 0.02 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.45 2qee s VAL 298 Cb -0.13 -0.76 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 2qee s VAL 298 CO 0.01 0.19 -0.06 0.28 0.00 0.00 0.00 175.10 175.52 2qee s THR 299 N -0.38 0.37 0.12 3.92 -1.32 -0.97 -1.96 115.64 115.42 2qee s THR 299 Ca 0.03 -0.81 0.07 0.00 -1.21 0.00 0.00 61.69 59.77 2qee s THR 299 Cb -0.05 -0.43 -0.04 0.00 -1.51 0.00 0.00 72.50 70.47 2qee s THR 299 CO -0.00 -0.30 -0.16 -0.04 -2.21 0.00 0.00 174.62 171.91 2qee s MET 300 N -1.18 1.05 -0.04 7.08 -1.94 -1.26 -1.22 119.30 121.79 2qee s MET 300 Ca -0.09 -1.22 0.15 0.00 -1.71 0.00 0.00 55.69 52.81 2qee s MET 300 Cb -0.08 -1.03 -0.21 0.00 2.01 0.00 0.00 34.83 35.52 2qee s MET 300 CO -0.00 0.21 0.63 -0.11 -0.01 0.00 0.00 175.02 175.73 2qee n LEU 301 N 0.65 0.74 -4.73 -0.03 7.94 0.65 -4.64 117.00 117.59 2qee n LEU 301 Ca -0.16 0.35 -0.41 0.00 -1.11 0.00 0.00 56.01 54.67 2qee n LEU 301 Cb 0.56 0.18 -0.04 0.00 0.53 0.00 0.00 43.42 44.66 2qee n LEU 301 CO 0.26 0.33 0.71 -0.55 -1.11 0.00 0.00 177.39 177.03 2qee s SER 302 N -5.90 7.40 0.29 1.96 0.15 -1.26 -4.51 113.70 111.83 2qee s SER 302 Ca -0.05 1.85 0.04 0.00 0.70 0.00 0.00 55.95 58.49 2qee s SER 302 Cb 0.08 -2.59 0.70 0.00 -1.71 0.00 0.00 66.02 62.50 2qee s SER 302 CO 0.82 -0.16 1.77 -0.09 1.20 0.00 0.00 173.24 176.78 2qee h ARG 303 N 5.77 0.68 0.00 5.44 2.43 -1.95 -1.93 114.38 124.83 2qee h ARG 303 Ca -0.43 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2qee h ARG 303 Cb 1.21 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 2qee h ARG 303 CO 0.73 0.45 0.00 0.39 -1.51 0.00 0.00 179.97 180.03 2qee n GLU 304 N -4.81 0.19 0.05 0.20 4.71 -1.26 -2.24 120.64 117.46 2qee n GLU 304 Ca 0.22 0.07 0.12 0.00 -0.01 0.00 0.00 57.16 57.56 2qee n GLU 304 Cb 0.56 -1.50 0.18 0.00 -1.01 0.00 0.00 31.44 29.67 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 -1.39 0.64 -0.07 1.62 5.03 -0.73 -4.67 115.26 115.70 2qee n ASN 305 Ca 0.09 0.04 -0.13 0.00 0.87 0.00 0.00 54.58 55.46 2qee n ASN 305 Cb 0.24 0.21 -0.06 0.00 -1.02 0.00 0.00 39.78 39.15 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 0.45 -0.02 3.52 1.08 -1.52 -0.81 115.11 117.81 2qee h GLN 306 Ca 0.00 -0.21 -0.00 0.00 -1.45 0.00 0.00 58.65 56.98 2qee h GLN 306 Cb 0.70 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.12 2qee h GLN 306 CO 0.00 0.76 0.00 1.25 -0.95 0.00 0.00 178.83 179.90 2qee h HIS 307 N 0.13 0.03 -0.13 2.96 2.76 -1.83 -1.90 115.15 117.17 2qee h HIS 307 Ca 0.04 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.19 2qee h HIS 307 Cb 0.65 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.60 2qee h HIS 307 CO 0.07 0.24 0.02 1.05 -1.30 0.00 0.00 177.93 178.01 2qee h GLU 308 N -0.19 0.17 -0.80 5.26 4.11 -1.84 -1.15 114.58 120.15 2qee h GLU 308 Ca 0.01 -0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 2qee h GLU 308 Cb 0.22 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 2qee h GLU 308 CO -0.00 0.17 0.50 1.25 0.07 0.00 0.00 179.01 181.00 2qee h LEU 309 N 0.17 0.94 -0.61 3.06 5.85 -0.82 -0.41 115.31 123.49 2qee h LEU 309 Ca 0.04 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2qee h LEU 309 Cb 0.09 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 2qee h LEU 309 CO -0.00 0.71 0.33 0.58 -0.34 0.00 0.00 178.44 179.72 2qee h VAL 310 N 1.09 1.20 -0.60 1.05 2.07 -0.44 -1.33 116.25 119.29 2qee h VAL 310 Ca 0.29 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2qee h VAL 310 Cb -0.07 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 2qee h VAL 310 CO -0.06 0.22 0.31 0.58 0.02 0.00 0.00 177.57 178.63 2qee h VAL 311 N 0.83 1.19 -0.18 2.57 2.07 -0.87 -1.87 116.25 119.99 2qee h VAL 311 Ca 0.21 -0.51 -0.15 0.00 0.82 0.00 0.00 66.70 67.08 2qee h VAL 311 Cb 0.05 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 2qee h VAL 311 CO -0.03 0.22 -0.51 0.25 0.02 0.00 0.00 177.57 177.52 2qee h LEU 312 N 0.84 0.54 -1.18 2.57 5.85 -0.49 -1.37 115.31 122.06 2qee h LEU 312 Ca 0.21 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.69 2qee h LEU 312 Cb 0.06 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 2qee h LEU 312 CO -0.03 0.95 0.56 0.00 -0.34 0.00 0.00 178.44 179.58 2qee h ALA 313 N 1.06 1.47 -0.26 1.25 0.00 -0.63 -0.37 119.26 121.78 2qee h ALA 313 Ca 0.02 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.94 2qee h ALA 313 Cb 1.02 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2qee h ALA 313 CO 0.09 0.45 0.18 0.00 0.00 0.00 0.00 179.25 179.98 2qee h ARG 314 N 1.07 0.07 0.00 0.00 3.08 -0.48 -3.07 114.38 115.04 2qee h ARG 314 Ca 0.34 -0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.14 2qee h ARG 314 Cb 0.01 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2qee h ARG 314 CO -0.10 0.04 -1.24 0.87 -1.07 0.00 0.00 179.97 178.48 2qee h LYS 315 N 0.07 0.01 -3.90 0.04 1.79 -0.79 -3.46 116.57 110.33 2qee h LYS 315 Ca 0.12 -0.01 -0.54 0.00 -2.18 0.00 0.00 60.65 58.04 2qee h LYS 315 Cb 0.39 0.00 -0.39 0.00 -1.58 0.00 0.00 32.23 30.66 2qee h LYS 315 CO -0.01 0.84 -0.78 -0.06 -1.08 0.00 0.00 179.45 178.36 2qee s PHE 316 N -2.67 1.45 -0.23 -1.35 0.08 -0.93 -5.00 117.98 109.33 2qee s PHE 316 Ca -0.01 -1.03 0.28 0.00 0.12 0.00 0.00 56.93 56.29 2qee s PHE 316 Cb 0.09 -1.20 1.17 0.00 -0.57 0.00 0.00 43.02 42.52 2qee s PHE 316 CO 0.82 -0.62 1.83 0.66 -0.10 0.00 0.00 175.22 177.81 2qee h SER 317 N 8.16 0.00 -0.20 1.36 4.64 -1.89 -2.23 113.55 123.38 2qee h SER 317 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2qee h SER 317 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2qee h SER 317 CO 0.36 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.86 2qee n ASN 318 N -2.56 1.49 -4.62 4.97 6.94 -1.26 -4.73 115.26 115.48 2qee n ASN 318 Ca 0.01 -1.80 -0.35 0.00 -0.02 0.00 0.00 54.58 52.42 2qee n ASN 318 Cb 0.24 -0.13 -0.10 0.00 -2.36 0.00 0.00 39.78 37.43 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 -1.34 3.85 -0.18 -4.53 2.96 -0.84 -0.87 118.68 117.72 2qee s LEU 319 Ca 0.27 0.06 0.00 0.00 -0.22 0.00 0.00 54.13 54.24 2qee s LEU 319 Cb 0.14 -1.99 0.01 0.00 0.50 0.00 0.00 46.19 44.85 2qee s LEU 319 CO 0.21 0.12 -0.16 -0.32 -1.32 0.00 0.00 176.35 174.88 2qee s MET 320 N 0.67 3.10 0.12 1.98 -2.45 -0.16 -4.94 119.30 117.63 2qee s MET 320 Ca 0.05 -0.78 -0.03 0.00 -1.25 0.00 0.00 55.69 53.67 2qee s MET 320 Cb -0.13 -2.66 -0.05 0.00 1.25 0.00 0.00 34.83 33.24 2qee s MET 320 CO 0.02 -0.17 0.33 0.96 1.05 0.00 0.00 175.02 177.21 2qee s ILE 321 N 1.24 5.23 -0.07 10.11 -4.36 -1.26 -1.33 121.20 130.76 2qee s ILE 321 Ca 0.03 -0.11 -0.05 0.00 -0.26 0.00 0.00 60.65 60.26 2qee s ILE 321 Cb -0.14 -3.63 0.02 0.00 1.25 0.00 0.00 42.46 39.96 2qee s ILE 321 CO -0.09 0.05 0.17 0.72 0.24 0.00 0.00 174.94 176.04 2qee s PHE 322 N -1.63 -0.19 0.17 1.37 -0.12 -0.83 -2.41 117.98 114.34 2qee s PHE 322 Ca 0.39 0.48 0.00 0.00 -0.05 0.00 0.00 56.93 57.75 2qee s PHE 322 Cb -0.12 0.04 0.00 0.00 -0.63 0.00 0.00 43.02 42.31 2qee s PHE 322 CO 0.26 -0.11 0.00 0.41 -0.05 0.00 0.00 175.22 175.73 2qee n GLY 323 N 3.22 -2.17 3.01 1.99 0.00 -0.07 -4.38 105.19 106.78 2qee n GLY 323 Ca -0.15 -1.36 -0.31 0.00 0.00 0.00 0.00 46.02 44.20 2qee n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qee s TRP 325 N 0.48 3.47 0.00 0.00 -0.00 -1.26 -3.62 118.94 118.01 2qee s TRP 325 Ca 0.13 1.51 0.00 0.00 -0.00 0.00 0.00 56.10 57.74 2qee s TRP 325 Cb -0.22 -3.16 0.00 0.00 -0.00 0.00 0.00 33.47 30.09 2qee s TRP 325 CO -0.05 -0.26 0.00 1.87 -0.00 0.00 0.00 176.95 178.51 2qee n TRP 326 N 5.24 0.00 0.37 5.86 -0.00 -1.26 -0.41 117.44 127.23 2qee n TRP 326 Ca 0.08 0.00 0.07 0.00 -0.00 0.00 0.00 57.50 57.65 2qee n TRP 326 Cb 0.48 0.00 0.31 0.00 -0.00 0.00 0.00 31.31 32.11 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 0.22 1.24 5.87 3.72 -1.26 -0.79 117.46 126.47 2qee n PHE 327 Ca 0.00 0.09 0.13 0.00 -0.05 0.00 0.00 57.45 57.62 2qee n PHE 327 Cb 0.00 -0.65 0.35 0.00 -0.94 0.00 0.00 39.48 38.24 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 -1.71 0.97 -2.12 -1.08 2.81 0.45 -4.57 117.12 111.87 2qee n MET 328 Ca 0.02 -0.60 -0.38 0.00 -1.81 0.00 0.00 57.70 54.93 2qee n MET 328 Cb 0.14 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.17 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 -0.48 7.42 -4.09 7.83 5.15 0.03 -3.63 115.26 127.49 2qee n ASN 329 Ca 0.13 -3.50 -0.20 0.00 -0.60 0.00 0.00 54.58 50.40 2qee n ASN 329 Cb 0.36 -1.21 -0.14 0.00 -0.53 0.00 0.00 39.78 38.26 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 -0.56 1.46 0.29 1.20 0.01 -1.26 -4.95 114.94 111.13 2qee s ASN 330 Ca 0.49 -0.29 0.02 0.00 -0.71 0.00 0.00 52.86 52.37 2qee s ASN 330 Cb 0.28 -0.14 0.72 0.00 0.41 0.00 0.00 41.25 42.52 2qee s ASN 330 CO -0.20 0.11 1.62 -0.65 -1.51 0.00 0.00 177.10 176.47 2qee h PRO 331 N 5.57 0.13 -0.59 -0.60 0.11 -1.97 0.19 132.00 134.85 2qee h PRO 331 Ca -0.34 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.72 2qee h PRO 331 Cb 1.17 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2qee h PRO 331 CO 0.48 0.09 0.20 1.49 -0.21 0.00 0.00 178.00 180.04 2qee h GLU 332 N 0.14 0.87 0.10 1.05 4.57 -1.97 -0.82 114.58 118.52 2qee h GLU 332 Ca 0.56 -0.16 -0.16 0.00 -1.18 0.00 0.00 59.36 58.42 2qee h GLU 332 Cb 1.15 -0.14 0.01 0.00 -0.16 0.00 0.00 28.75 29.61 2qee h GLU 332 CO -0.73 0.74 -0.76 0.82 -1.18 0.00 0.00 179.01 177.91 2qee h ILE 333 N 0.85 1.46 -0.79 2.32 1.08 -1.41 -2.87 117.51 118.15 2qee h ILE 333 Ca 0.20 -2.45 0.18 0.00 -0.39 0.00 0.00 64.86 62.39 2qee h ILE 333 Cb 0.23 3.10 -0.11 0.00 -3.07 0.00 0.00 36.82 36.96 2qee h ILE 333 CO -0.01 0.67 0.26 0.40 -0.69 0.00 0.00 178.15 178.78 2qee h ILE 334 N -0.54 0.52 0.12 -0.67 2.04 -0.59 0.11 117.51 118.50 2qee h ILE 334 Ca -0.15 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2qee h ILE 334 Cb 1.49 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2qee h ILE 334 CO 0.08 0.06 -0.06 -1.13 0.00 0.00 0.00 178.15 177.10 2qee h ASN 335 N 0.34 -0.14 -0.75 1.72 -1.24 -1.22 -0.43 115.58 113.86 2qee h ASN 335 Ca 0.46 -0.25 -0.04 0.00 0.71 0.00 0.00 56.30 57.18 2qee h ASN 335 Cb 0.80 0.04 -0.03 0.00 0.73 0.00 0.00 38.32 39.86 2qee h ASN 335 CO -0.50 0.19 0.33 1.05 -1.29 0.00 0.00 177.43 177.20 2qee h GLU 336 N -0.48 1.11 -0.31 6.67 4.11 -1.25 -1.51 114.58 122.92 2qee h GLU 336 Ca -0.02 -0.18 -0.03 0.00 0.07 0.00 0.00 59.36 59.20 2qee h GLU 336 Cb 0.38 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2qee h GLU 336 CO 0.03 0.89 0.08 0.52 0.07 0.00 0.00 179.01 180.59 2qee h MET 337 N 1.07 0.49 -0.57 1.06 2.86 -0.72 -1.52 114.93 117.60 2qee h MET 337 Ca 0.25 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 2qee h MET 337 Cb 0.17 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 2qee h MET 337 CO -0.03 0.56 0.13 1.15 1.06 0.00 0.00 176.91 179.79 2qee h THR 338 N 0.34 1.23 -0.26 2.22 2.02 -0.92 0.02 112.91 117.56 2qee h THR 338 Ca 0.10 -0.84 -0.09 0.00 0.77 0.00 0.00 66.41 66.34 2qee h THR 338 Cb 0.28 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 2qee h THR 338 CO 0.00 0.32 -0.18 0.03 0.37 0.00 0.00 175.52 176.06 2qee h ARG 339 N 0.84 0.59 -0.65 6.66 3.08 -1.12 -0.67 114.38 123.11 2qee h ARG 339 Ca 0.18 -0.28 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 2qee h ARG 339 Cb 0.31 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 2qee h ARG 339 CO -0.00 0.86 0.31 0.52 -1.07 0.00 0.00 179.97 180.59 2qee h MET 340 N 0.31 0.94 -0.05 0.04 2.86 -1.08 -0.06 114.93 117.90 2qee h MET 340 Ca 0.05 -0.14 -0.00 0.00 -2.06 0.00 0.00 59.70 57.55 2qee h MET 340 Cb 0.71 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 2qee h MET 340 CO 0.05 0.75 0.01 0.00 1.06 0.00 0.00 176.91 178.78 2qee h ARG 341 N 0.90 0.08 -0.38 1.72 3.08 -0.83 -2.41 114.38 116.53 2qee h ARG 341 Ca 0.22 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.16 2qee h ARG 341 Cb 0.12 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2qee h ARG 341 CO -0.03 0.29 -0.17 1.98 -1.07 0.00 0.00 179.97 180.98 2qee h MET 342 N -0.15 0.71 -0.25 0.04 4.05 -1.00 0.23 114.93 118.56 2qee h MET 342 Ca 0.01 -0.25 -0.05 0.00 -0.28 0.00 0.00 59.70 59.13 2qee h MET 342 Cb 0.25 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.98 2qee h MET 342 CO 0.00 0.84 -0.06 0.93 0.23 0.00 0.00 176.91 178.85 2qee h GLU 343 N 0.63 0.38 0.00 0.39 5.08 -0.83 -0.56 114.58 119.68 2qee h GLU 343 Ca 0.10 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2qee h GLU 343 Cb 0.64 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2qee h GLU 343 CO 0.04 0.46 -1.08 -1.33 -1.00 0.00 0.00 179.01 176.11 2qee n MET 344 N -4.28 1.49 0.00 2.33 2.81 -0.92 -4.56 117.12 113.98 2qee n MET 344 Ca 0.00 -0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.84 2qee n MET 344 Cb 0.25 -1.26 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 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 -1.61 0.74 0.00 4.03 4.77 0.78 -4.86 117.00 120.85 2qee n LEU 345 Ca 0.01 -0.74 0.00 0.00 -0.03 0.00 0.00 56.01 55.25 2qee n LEU 345 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2qee n LEU 345 CO 0.31 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 2qee n GLY 346 N -0.05 3.64 1.48 -0.72 0.00 -0.22 -1.18 105.19 108.14 2qee n GLY 346 Ca 0.00 0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.15 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 1.77 -1.19 2.61 -2.24 -1.26 -4.37 114.28 109.61 2qee n THR 347 Ca 0.00 -1.22 -0.19 0.00 -2.27 0.00 0.00 64.05 60.37 2qee n THR 347 Cb 0.00 0.15 -0.09 0.00 -2.10 0.00 0.00 70.33 68.29 2qee n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qee n SER 348 N 1.02 5.93 -3.73 3.42 3.41 -0.32 -4.73 113.62 118.62 2qee n SER 348 Ca 0.25 -2.87 -0.09 0.00 -0.26 0.00 0.00 58.87 55.90 2qee n SER 348 Cb 0.85 -1.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.48 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 -0.57 0.31 -0.36 7.33 -0.12 -1.26 -4.83 117.98 118.47 2qee s PHE 349 Ca 0.56 -0.71 -0.06 0.00 -0.05 0.00 0.00 56.93 56.67 2qee s PHE 349 Cb 0.32 0.35 0.06 0.00 -0.63 0.00 0.00 43.02 43.12 2qee s PHE 349 CO -0.10 -1.14 0.14 0.42 -0.05 0.00 0.00 175.22 174.49 2qee s ILE 350 N -3.65 3.71 0.40 -4.49 1.01 -1.01 -4.67 121.20 112.49 2qee s ILE 350 Ca 0.20 -1.36 0.11 0.00 0.00 0.00 0.00 60.65 59.61 2qee s ILE 350 Cb -0.02 -3.21 0.15 0.00 0.01 0.00 0.00 42.46 39.39 2qee s ILE 350 CO 0.10 -0.32 1.91 1.55 0.00 0.00 0.00 174.94 178.19 2qee h PRO 351 N 8.21 0.14 -2.74 2.79 0.13 -1.87 -0.16 132.00 138.51 2qee h PRO 351 Ca -0.21 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 64.80 2qee h PRO 351 Cb 1.07 -0.02 -0.18 0.00 0.13 0.00 0.00 31.00 32.00 2qee h PRO 351 CO 0.64 0.33 -0.07 -1.14 -0.23 0.00 0.00 178.00 177.54 2qee s GLN 352 N -4.59 0.88 0.10 0.86 2.00 -1.26 -3.41 119.66 114.24 2qee s GLN 352 Ca -0.05 -0.13 -0.00 0.00 -2.00 0.00 0.00 55.36 53.18 2qee s GLN 352 Cb 0.15 0.40 -0.04 0.00 0.80 0.00 0.00 33.01 34.32 2qee s GLN 352 CO 0.72 -0.28 -0.00 -3.38 -0.50 0.00 0.00 175.29 171.85 2qee s HIS 353 N -1.76 0.76 -0.10 1.67 -3.43 -1.26 -4.67 115.29 106.51 2qee s HIS 353 Ca -0.10 -1.10 0.15 0.00 -0.80 0.00 0.00 55.06 53.22 2qee s HIS 353 Cb -0.02 -0.47 -0.22 0.00 -1.43 0.00 0.00 32.58 30.44 2qee s HIS 353 CO 0.03 -0.37 0.53 -1.13 -2.00 0.00 0.00 174.74 171.80 2qee n SER 354 N -0.02 0.62 -2.25 7.38 3.41 -1.24 -4.72 113.62 116.81 2qee n SER 354 Ca -0.10 0.29 -0.16 0.00 -0.26 0.00 0.00 58.87 58.64 2qee n SER 354 Cb 0.62 0.31 -0.02 0.00 -0.26 0.00 0.00 64.21 64.86 2qee n SER 354 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qee n ASP 355 N -2.92 -4.64 -4.74 4.04 -0.08 -0.37 -4.86 116.55 102.97 2qee n ASP 355 Ca -0.19 0.16 -0.42 0.00 -1.51 0.00 0.00 54.79 52.83 2qee n ASP 355 Cb 1.03 -3.96 -0.02 0.00 2.34 0.00 0.00 41.12 40.51 2qee n ASP 355 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qee n ALA 356 N -1.59 2.51 -0.03 -1.67 0.00 -1.26 -4.45 120.51 114.01 2qee n ALA 356 Ca -0.18 0.38 0.03 0.00 0.00 0.00 0.00 53.44 53.67 2qee n ALA 356 Cb 0.62 -2.46 -0.14 0.00 0.00 0.00 0.00 19.45 17.46 2qee n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qee n ARG 357 N 2.48 0.76 -5.06 0.00 1.74 -1.26 0.36 116.66 115.67 2qee n ARG 357 Ca 0.10 -0.12 -0.30 0.00 -0.77 0.00 0.00 57.85 56.76 2qee n ARG 357 Cb 0.36 -1.45 -0.17 0.00 -1.02 0.00 0.00 32.46 30.18 2qee n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2qee s VAL 358 N -3.02 1.81 0.25 1.55 1.01 -1.26 -4.33 120.40 116.41 2qee s VAL 358 Ca -0.08 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 60.93 2qee s VAL 358 Cb 0.10 -1.58 0.32 0.00 0.00 0.00 0.00 36.38 35.23 2qee s VAL 358 CO 0.77 0.51 1.61 0.25 0.00 0.00 0.00 175.10 178.23 2qee h LEU 359 N 6.68 -0.61 -0.98 3.92 5.85 -1.23 0.14 115.31 129.07 2qee h LEU 359 Ca -0.24 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.71 2qee h LEU 359 Cb 1.22 0.45 0.00 0.00 0.37 0.00 0.00 40.66 42.70 2qee h LEU 359 CO 0.47 -0.25 0.00 -0.33 -0.34 0.00 0.00 178.44 177.99 2qee h GLU 360 N 0.03 0.00 -0.04 1.25 3.07 -1.93 -2.37 114.58 114.59 2qee h GLU 360 Ca 0.41 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 59.28 2qee h GLU 360 Cb 0.67 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.58 2qee h GLU 360 CO -0.78 0.00 0.05 1.96 -1.40 0.00 0.00 179.01 178.83 2qee h GLN 361 N 0.00 0.00 -0.73 2.33 4.20 -1.37 -0.10 115.11 119.45 2qee h GLN 361 Ca 0.00 0.00 0.15 0.00 0.06 0.00 0.00 58.65 58.86 2qee h GLN 361 Cb 0.40 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.13 2qee h GLN 361 CO 0.00 0.00 0.49 -0.07 -0.67 0.00 0.00 178.83 178.58 2qee h LEU 362 N 0.00 0.35 0.56 1.46 3.38 -1.59 -0.71 115.31 118.75 2qee h LEU 362 Ca 0.02 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2qee h LEU 362 Cb 0.11 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.81 2qee h LEU 362 CO -0.00 0.18 -0.27 0.40 0.09 0.00 0.00 178.44 178.84 2qee h ILE 363 N 0.37 0.42 0.05 1.22 2.04 -1.24 -2.44 117.51 117.93 2qee h ILE 363 Ca 0.36 -0.17 -0.23 0.00 1.00 0.00 0.00 64.86 65.81 2qee h ILE 363 Cb 0.86 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2qee h ILE 363 CO -0.10 0.03 -1.04 0.10 0.00 0.00 0.00 178.15 177.13 2qee h TYR 364 N -0.86 0.44 -0.64 1.37 -0.00 -1.58 -1.79 116.97 113.92 2qee h TYR 364 Ca -0.08 -0.27 0.03 0.00 0.00 0.00 0.00 58.73 58.41 2qee h TYR 364 Cb 0.62 -0.04 -0.04 0.00 0.00 0.00 0.00 36.73 37.27 2qee h TYR 364 CO -0.02 1.14 0.39 0.87 -0.00 0.00 0.00 178.16 180.55 2qee h LYS 365 N 0.12 0.74 0.03 0.10 1.79 -1.20 0.12 116.57 118.28 2qee h LYS 365 Ca -0.09 -0.04 -0.22 0.00 -2.18 0.00 0.00 60.65 58.12 2qee h LYS 365 Cb 1.71 -0.17 0.02 0.00 -1.58 0.00 0.00 32.23 32.22 2qee h LYS 365 CO 0.17 0.49 -0.89 -1.49 -1.08 0.00 0.00 179.45 176.65 2qee h TRP 366 N 0.77 0.84 -0.21 -1.35 4.06 -1.44 -2.52 115.95 116.08 2qee h TRP 366 Ca 0.26 -0.48 -0.01 0.00 2.06 0.00 0.00 58.89 60.72 2qee h TRP 366 Cb 0.04 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.10 2qee h TRP 366 CO -0.05 1.31 0.09 0.45 -3.56 0.00 0.00 178.44 176.68 2qee h HIS 367 N 0.12 0.32 -0.31 0.49 3.86 -1.17 0.14 115.15 118.60 2qee h HIS 367 Ca -0.12 -0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 58.96 2qee h HIS 367 Cb 1.58 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.94 2qee h HIS 367 CO 0.13 0.35 -0.26 0.45 0.86 0.00 0.00 177.93 179.46 2qee h HIS 368 N 0.20 0.69 -0.11 2.45 3.86 -0.84 -2.66 115.15 118.74 2qee h HIS 368 Ca 0.07 -0.16 -0.23 0.00 -1.16 0.00 0.00 60.37 58.89 2qee h HIS 368 Cb 0.16 -0.17 0.01 0.00 1.06 0.00 0.00 27.41 28.48 2qee h HIS 368 CO -0.01 0.81 -0.84 0.77 0.86 0.00 0.00 177.93 179.51 2qee h SER 369 N 0.53 0.90 -0.81 2.45 0.02 -1.37 -3.24 113.55 112.03 2qee h SER 369 Ca 0.07 -0.62 -0.03 0.00 -0.84 0.00 0.00 61.79 60.37 2qee h SER 369 Cb 0.72 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.96 2qee h SER 369 CO 0.06 1.42 0.38 0.11 -1.14 0.00 0.00 176.83 177.65 2qee h LYS 370 N 0.48 1.18 -0.70 3.45 1.57 -0.65 0.17 116.57 122.07 2qee h LYS 370 Ca -0.07 -0.18 0.01 0.00 -1.87 0.00 0.00 60.65 58.54 2qee h LYS 370 Cb 1.48 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 33.54 2qee h LYS 370 CO 0.17 0.92 0.46 0.66 -0.57 0.00 0.00 179.45 181.09 2qee h SER 371 N 1.17 0.80 -0.09 0.86 4.64 -1.53 0.16 113.55 119.55 2qee h SER 371 Ca 0.28 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.56 2qee h SER 371 Cb 0.13 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.02 2qee h SER 371 CO -0.03 0.57 -0.01 0.40 -0.87 0.00 0.00 176.83 176.90 2qee h ILE 372 N 0.94 1.26 -0.85 0.95 2.04 -1.51 -2.20 117.51 118.15 2qee h ILE 372 Ca 0.26 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 2qee h ILE 372 Cb -0.10 1.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 2qee h ILE 372 CO -0.06 0.23 0.52 0.40 0.00 0.00 0.00 178.15 179.24 2qee h ILE 373 N -0.12 1.23 -0.57 -0.67 2.04 -0.76 -1.72 117.51 116.94 2qee h ILE 373 Ca 0.03 -0.50 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 2qee h ILE 373 Cb 0.37 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 2qee h ILE 373 CO 0.01 0.24 0.34 0.00 0.00 0.00 0.00 178.15 178.73 2qee h ALA 374 N 1.40 0.73 -0.50 1.87 0.00 -0.59 -0.46 119.26 121.71 2qee h ALA 374 Ca 0.31 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.19 2qee h ALA 374 Cb -0.06 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.45 2qee h ALA 374 CO -0.06 0.23 0.21 0.93 0.00 0.00 0.00 179.25 180.56 2qee h GLU 375 N 0.77 0.40 -0.21 0.00 5.08 -0.73 0.90 114.58 120.80 2qee h GLU 375 Ca 0.20 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 2qee h GLU 375 Cb 0.00 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2qee h GLU 375 CO -0.04 0.27 0.06 0.28 -1.00 0.00 0.00 179.01 178.58 2qee h VAL 376 N 0.42 1.20 -0.61 3.13 2.07 -0.95 -1.65 116.25 119.86 2qee h VAL 376 Ca 0.23 -0.65 0.06 0.00 0.82 0.00 0.00 66.70 67.16 2qee h VAL 376 Cb 0.20 1.23 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 2qee h VAL 376 CO -0.20 0.20 0.32 -0.07 0.02 0.00 0.00 177.57 177.84 2qee h LEU 377 N 0.16 0.46 -0.15 2.57 3.38 -0.78 -1.03 115.31 119.92 2qee h LEU 377 Ca 0.07 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.08 2qee h LEU 377 Cb 0.26 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2qee h LEU 377 CO -0.00 0.30 0.05 0.40 0.09 0.00 0.00 178.44 179.28 2qee h ILE 378 N 0.60 0.97 -0.29 1.22 2.04 -0.60 0.15 117.51 121.59 2qee h ILE 378 Ca 0.28 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 66.13 2qee h ILE 378 Cb 0.19 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 2qee h ILE 378 CO -0.19 0.02 0.09 0.44 0.00 0.00 0.00 178.15 178.52 2qee h ASP 379 N 0.12 0.10 -0.58 1.72 3.32 -0.93 0.13 116.42 120.30 2qee h ASP 379 Ca 0.06 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.07 2qee h ASP 379 Cb 0.03 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2qee h ASP 379 CO -0.06 0.09 0.08 0.11 -1.72 0.00 0.00 179.24 177.74 2qee h LYS 380 N 0.22 0.97 -0.58 3.56 6.56 -0.85 -0.86 116.57 125.59 2qee h LYS 380 Ca 0.13 -0.27 -0.08 0.00 -1.06 0.00 0.00 60.65 59.37 2qee h LYS 380 Cb 0.10 -0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 31.63 2qee h LYS 380 CO -0.14 0.93 0.05 1.88 -2.06 0.00 0.00 179.45 180.11 2qee h TYR 381 N 0.87 1.06 -0.90 -1.35 0.05 -0.61 -2.76 116.97 113.33 2qee h TYR 381 Ca 0.18 -0.16 0.05 0.00 0.05 0.00 0.00 58.73 58.84 2qee h TYR 381 Cb 0.43 -0.28 -0.06 0.00 1.01 0.00 0.00 36.73 37.83 2qee h TYR 381 CO 0.03 0.93 0.58 0.22 -1.05 0.00 0.00 178.16 178.87 2qee h ASP 382 N 0.88 0.93 -0.77 3.88 3.58 -0.49 0.13 116.42 124.55 2qee h ASP 382 Ca 0.17 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.58 2qee h ASP 382 Cb 0.48 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.30 2qee h ASP 382 CO 0.02 0.62 0.30 0.44 -2.88 0.00 0.00 179.24 177.73 2qee h ASP 383 N 1.08 1.08 0.75 2.28 3.32 -0.96 0.54 116.42 124.51 2qee h ASP 383 Ca 0.38 -0.18 -0.20 0.00 0.02 0.00 0.00 57.03 57.05 2qee h ASP 383 Cb 0.09 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 2qee h ASP 383 CO -0.15 0.97 -0.92 0.16 -1.72 0.00 0.00 179.24 177.58 2qee h ILE 384 N 1.13 1.57 -0.58 0.35 3.07 -1.11 -2.71 117.51 119.23 2qee h ILE 384 Ca 0.26 -2.88 0.06 0.00 1.55 0.00 0.00 64.86 63.84 2qee h ILE 384 Cb 0.24 2.61 -0.05 0.00 -0.27 0.00 0.00 36.82 39.34 2qee h ILE 384 CO -0.02 0.83 0.30 -0.07 -1.05 0.00 0.00 178.15 178.14 2qee h LEU 385 N 0.05 0.43 -1.81 0.16 4.07 -0.41 -1.54 115.31 116.26 2qee h LEU 385 Ca -0.03 0.03 0.01 0.00 0.08 0.00 0.00 57.88 57.97 2qee h LEU 385 Cb 1.59 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 43.27 2qee h LEU 385 CO 0.13 0.28 0.14 1.56 -1.08 0.00 0.00 178.44 179.48 2qee h GLN 386 N 0.57 0.25 -0.00 1.13 4.20 -0.79 -0.71 115.11 119.75 2qee h GLN 386 Ca 0.26 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.96 2qee h GLN 386 Cb 0.18 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.90 2qee h GLN 386 CO -0.18 0.16 0.00 0.00 -0.67 0.00 0.00 178.83 178.14 2qee n ALA 387 N -2.51 2.66 -0.00 3.87 0.00 -0.73 -4.90 120.51 118.90 2qee n ALA 387 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2qee n ALA 387 Cb 0.10 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.11 2qee n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qee n GLY 388 N 0.93 0.19 3.77 0.00 0.00 -0.27 -5.07 105.19 104.74 2qee n GLY 388 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 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 3.10 -0.34 1.61 -0.11 -0.66 -4.99 118.94 115.56 2qee s TRP 389 Ca 0.00 1.56 -0.10 0.00 1.22 0.00 0.00 56.10 58.78 2qee s TRP 389 Cb 0.00 -3.39 0.01 0.00 -1.50 0.00 0.00 33.47 28.59 2qee s TRP 389 CO 0.00 -1.27 0.17 -1.21 -4.62 0.00 0.00 176.95 170.02 2qee s GLU 390 N -2.23 3.03 -0.11 5.86 2.02 -1.26 -4.17 118.70 121.84 2qee s GLU 390 Ca 0.56 -0.93 -0.12 0.00 0.02 0.00 0.00 54.97 54.50 2qee s GLU 390 Cb -0.31 -3.63 -0.05 0.00 0.10 0.00 0.00 34.13 30.24 2qee s GLU 390 CO 0.39 -0.57 0.26 0.54 0.02 0.00 0.00 175.26 175.90 2qee s VAL 391 N 1.57 5.30 0.26 2.63 0.11 -1.26 -5.09 120.40 123.92 2qee s VAL 391 Ca 0.03 0.49 0.01 0.00 -2.93 0.00 0.00 61.98 59.58 2qee s VAL 391 Cb -0.18 -3.57 -0.04 0.00 -1.53 0.00 0.00 36.38 31.06 2qee s VAL 391 CO 0.06 0.51 0.45 0.42 -3.33 0.00 0.00 175.10 173.21 2qee s THR 392 N -0.39 5.17 0.38 5.04 -4.23 -1.26 -4.48 115.64 115.88 2qee s THR 392 Ca 0.17 -0.49 0.06 0.00 -1.18 0.00 0.00 61.69 60.25 2qee s THR 392 Cb -0.13 -3.80 0.24 0.00 1.34 0.00 0.00 72.50 70.15 2qee s THR 392 CO 0.06 -0.34 2.01 -0.08 -0.54 0.00 0.00 174.62 175.74 2qee h GLU 393 N 1.43 0.59 -0.25 3.99 4.81 -1.98 -1.16 114.58 122.00 2qee h GLU 393 Ca -0.49 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 58.61 2qee h GLU 393 Cb 1.21 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 2qee h GLU 393 CO 0.64 0.43 -0.16 0.93 -0.73 0.00 0.00 179.01 180.12 2qee h GLU 394 N 0.60 0.42 -0.37 1.92 4.39 -1.99 -0.64 114.58 118.91 2qee h GLU 394 Ca 0.15 -0.13 -0.14 0.00 0.34 0.00 0.00 59.36 59.59 2qee h GLU 394 Cb 0.01 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 2qee h GLU 394 CO -0.03 0.58 -0.32 0.93 -1.16 0.00 0.00 179.01 179.01 2qee h GLU 395 N 0.39 0.87 -0.35 2.33 5.08 -1.64 -1.74 114.58 119.52 2qee h GLU 395 Ca 0.07 -0.44 0.01 0.00 -1.00 0.00 0.00 59.36 58.00 2qee h GLU 395 Cb 0.51 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2qee h GLU 395 CO 0.03 1.08 0.21 0.82 -1.00 0.00 0.00 179.01 180.16 2qee h ILE 396 N 0.67 1.05 -0.76 3.13 2.04 -1.10 -1.06 117.51 121.48 2qee h ILE 396 Ca 0.06 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 2qee h ILE 396 Cb 0.90 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 2qee h ILE 396 CO 0.08 0.08 0.43 0.11 0.00 0.00 0.00 178.15 178.85 2qee h LYS 397 N 0.43 1.05 0.04 2.37 1.57 -0.96 -0.50 116.57 120.56 2qee h LYS 397 Ca 0.13 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2qee h LYS 397 Cb -0.01 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.08 2qee h LYS 397 CO -0.05 0.76 -0.02 -0.09 -0.57 0.00 0.00 179.45 179.47 2qee h ARG 398 N 1.06 -0.05 -0.65 3.15 2.43 -1.05 -0.67 114.38 118.60 2qee h ARG 398 Ca 0.27 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.37 2qee h ARG 398 Cb 0.00 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 2qee h ARG 398 CO -0.05 0.11 0.13 -0.44 -1.51 0.00 0.00 179.97 178.22 2qee h ASP 399 N -0.20 1.01 -0.50 -3.80 3.32 -0.49 -0.79 116.42 114.97 2qee h ASP 399 Ca -0.01 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.78 2qee h ASP 399 Cb 0.18 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 2qee h ASP 399 CO 0.01 1.00 0.24 0.58 -1.72 0.00 0.00 179.24 179.34 2qee h VAL 400 N 0.98 1.19 -0.94 -1.35 2.07 -1.10 -1.38 116.25 115.72 2qee h VAL 400 Ca 0.20 -0.55 0.04 0.00 0.82 0.00 0.00 66.70 67.21 2qee h VAL 400 Cb 0.40 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 2qee h VAL 400 CO 0.01 0.22 0.61 0.00 0.02 0.00 0.00 177.57 178.42 2qee h ALA 401 N 1.08 1.25 -0.07 1.67 0.00 -0.64 -1.32 119.26 121.23 2qee h ALA 401 Ca 0.17 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.06 2qee h ALA 401 Cb 0.12 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2qee h ALA 401 CO -0.02 0.47 -0.06 -0.44 0.00 0.00 0.00 179.25 179.20 2qee h ASP 402 N 1.17 -0.18 -0.50 0.00 3.32 -0.64 0.15 116.42 119.74 2qee h ASP 402 Ca 0.38 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.41 2qee h ASP 402 Cb 0.02 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2qee h ASP 402 CO -0.13 -0.08 0.07 -0.07 -1.72 0.00 0.00 179.24 177.31 2qee h LEU 403 N -0.07 0.80 0.00 1.55 3.38 -0.90 0.14 115.31 120.20 2qee h LEU 403 Ca 0.05 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2qee h LEU 403 Cb 0.14 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2qee h LEU 403 CO -0.11 0.86 -0.77 0.49 0.09 0.00 0.00 178.44 179.00 2qee n PHE 404 N -4.40 0.12 0.03 1.13 3.72 -0.53 -4.16 117.46 113.36 2qee n PHE 404 Ca 0.01 0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2qee n PHE 404 Cb 0.26 -0.29 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 2qee n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2qee n SER 405 N -1.69 -0.44 0.06 4.37 2.88 -0.33 -1.24 113.62 117.23 2qee n SER 405 Ca 0.04 0.10 -0.04 0.00 -1.33 0.00 0.00 58.87 57.64 2qee n SER 405 Cb 0.37 0.76 0.16 0.00 -0.75 0.00 0.00 64.21 64.75 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 0.35 -0.52 -1.46 3.08 -0.70 -2.76 114.38 112.37 2qee h ARG 406 Ca 0.00 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 2qee h ARG 406 Cb 0.00 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 2qee h ARG 406 CO 0.00 0.73 0.22 -0.91 -1.07 0.00 0.00 179.97 178.94 2qee h ASN 407 N 0.28 0.66 0.15 7.04 2.35 -0.94 -0.73 115.58 124.40 2qee h ASN 407 Ca 0.02 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2qee h ASN 407 Cb 0.90 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.11 2qee h ASN 407 CO 0.07 0.59 -0.07 0.15 -1.65 0.00 0.00 177.43 176.53 2qee h PHE 408 N 0.73 -0.18 -0.29 1.19 3.57 -1.71 -2.13 116.94 118.11 2qee h PHE 408 Ca 0.18 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 2qee h PHE 408 Cb 0.13 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 2qee h PHE 408 CO 0.01 0.04 -0.21 -1.49 -2.23 0.00 0.00 178.31 174.43 2qee h TRP 409 N -0.39 0.61 -0.67 0.41 4.06 -1.35 -0.44 115.95 118.18 2qee h TRP 409 Ca -0.02 -0.12 -0.02 0.00 2.06 0.00 0.00 58.89 60.79 2qee h TRP 409 Cb 0.31 -0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.28 2qee h TRP 409 CO -0.01 0.72 0.34 -0.09 -3.56 0.00 0.00 178.44 175.84 2qee h ARG 410 N 0.49 0.95 -0.15 0.49 2.43 -1.15 0.63 114.38 118.07 2qee h ARG 410 Ca 0.08 -0.13 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 2qee h ARG 410 Cb 0.63 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2qee h ARG 410 CO 0.05 0.74 -0.21 0.35 -1.51 0.00 0.00 179.97 179.38 2qee h PHE 411 N 0.93 0.51 0.00 2.20 3.57 -0.63 -2.89 116.94 120.63 2qee h PHE 411 Ca 0.23 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2qee h PHE 411 Cb 0.09 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.73 2qee h PHE 411 CO 0.00 0.84 0.00 -0.39 -2.23 0.00 0.00 178.31 176.53 2qee h VAL 412 N 0.04 0.00 -2.26 1.41 -1.51 -1.08 -3.47 116.25 109.39 2qee h VAL 412 Ca 0.02 -0.37 -0.06 0.00 -1.23 0.00 0.00 66.70 65.06 2qee h VAL 412 Cb 0.78 1.22 0.02 0.00 -2.13 0.00 0.00 31.29 31.18 2qee h VAL 412 CO 0.05 0.00 -0.11 0.61 -1.23 0.00 0.00 177.57 176.89 2qee n GLY 413 N 0.35 0.47 1.38 5.19 0.00 0.05 -4.83 105.19 107.80 2qee n GLY 413 Ca 0.03 -0.44 -0.06 0.00 0.00 0.00 0.00 46.02 45.54 2qee n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qee n ARG 414 N -1.38 0.27 0.00 1.61 1.74 -0.24 -5.04 116.66 113.62 2qee n ARG 414 Ca -0.03 -1.19 0.00 0.00 -0.77 0.00 0.00 57.85 55.86 2qee n ARG 414 Cb 0.52 1.12 0.00 0.00 -1.02 0.00 0.00 32.46 33.08 2qee n ARG 414 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40