#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qee s LEU 1 N 0.00 4.40 0.71 1.04 1.43 -1.26 -5.07 118.68 119.93 2qee s LEU 1 Ca 0.00 1.38 -0.13 0.00 -1.03 0.00 0.00 54.13 54.34 2qee s LEU 1 Cb 0.00 -3.41 0.02 0.00 0.03 0.00 0.00 46.19 42.84 2qee s LEU 1 CO 0.00 0.10 1.11 -0.94 0.23 0.00 0.00 176.35 176.85 2qee s SER 2 N -1.52 4.80 -0.60 2.29 1.04 -1.26 -4.93 113.70 113.51 2qee s SER 2 Ca 0.39 1.97 -0.27 0.00 0.48 0.00 0.00 55.95 58.53 2qee s SER 2 Cb -0.18 -2.54 0.03 0.00 0.10 0.00 0.00 66.02 63.43 2qee s SER 2 CO 0.21 -1.84 1.13 -0.63 0.98 0.00 0.00 173.24 173.09 2qee s ILE 3 N -2.50 4.08 -0.44 -1.02 1.01 -1.26 -4.86 121.20 116.20 2qee s ILE 3 Ca 0.66 0.60 0.23 0.00 0.00 0.00 0.00 60.65 62.14 2qee s ILE 3 Cb -0.20 -4.71 0.03 0.00 0.01 0.00 0.00 42.46 37.60 2qee s ILE 3 CO 0.47 -1.37 1.20 -0.55 0.00 0.00 0.00 174.94 174.69 2qee h ASN 4 N 9.56 0.00 -5.15 3.58 -1.07 -1.97 -3.48 115.58 117.05 2qee h ASN 4 Ca -0.26 -0.11 -0.07 0.00 0.07 0.00 0.00 56.30 55.93 2qee h ASN 4 Cb 1.06 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 37.18 2qee h ASN 4 CO 1.18 0.06 -0.22 -0.94 0.07 0.00 0.00 177.43 177.58 2qee s SER 5 N -4.84 -0.05 0.27 6.14 1.04 -1.26 -5.02 113.70 109.98 2qee s SER 5 Ca 0.03 -0.58 0.03 0.00 0.48 0.00 0.00 55.95 55.91 2qee s SER 5 Cb 0.11 0.43 0.38 0.00 0.10 0.00 0.00 66.02 67.04 2qee s SER 5 CO 0.75 -0.85 1.67 -0.09 0.98 0.00 0.00 173.24 175.71 2qee h ARG 6 N 2.51 0.38 -0.64 4.02 2.43 -1.98 0.06 114.38 121.16 2qee h ARG 6 Ca -0.33 -0.18 -0.04 0.00 -0.81 0.00 0.00 59.98 58.62 2qee h ARG 6 Cb 1.23 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.75 2qee h ARG 6 CO 0.49 0.71 0.23 0.93 -1.51 0.00 0.00 179.97 180.81 2qee h GLU 7 N 0.32 0.97 -0.37 0.20 3.07 -1.99 0.21 114.58 116.98 2qee h GLU 7 Ca 0.03 -0.19 -0.13 0.00 -0.50 0.00 0.00 59.36 58.57 2qee h GLU 7 Cb 0.81 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.57 2qee h GLU 7 CO 0.07 0.84 -0.29 0.28 -1.40 0.00 0.00 179.01 178.50 2qee h VAL 8 N 0.90 1.28 -0.38 3.13 2.07 -1.90 -2.69 116.25 118.67 2qee h VAL 8 Ca 0.21 -1.45 0.07 0.00 0.82 0.00 0.00 66.70 66.34 2qee h VAL 8 Cb 0.25 1.38 -0.06 0.00 -1.52 0.00 0.00 31.29 31.34 2qee h VAL 8 CO -0.01 0.48 0.01 0.25 0.02 0.00 0.00 177.57 178.33 2qee h LEU 9 N 0.66 -0.12 -0.59 2.57 5.85 -0.73 -1.81 115.31 121.15 2qee h LEU 9 Ca 0.07 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.89 2qee h LEU 9 Cb 0.87 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 2qee h LEU 9 CO 0.08 -0.03 0.37 0.00 -0.34 0.00 0.00 178.44 178.52 2qee h ALA 10 N 1.32 0.76 -0.63 1.25 0.00 -0.37 0.65 119.26 122.24 2qee h ALA 10 Ca 0.18 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2qee h ALA 10 Cb 0.25 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2qee h ALA 10 CO -0.29 0.12 0.29 0.93 0.00 0.00 0.00 179.25 180.29 2qee h GLU 11 N 0.73 0.92 -0.65 0.00 4.39 -1.17 -1.02 114.58 117.79 2qee h GLU 11 Ca 0.23 -0.14 -0.06 0.00 0.34 0.00 0.00 59.36 59.73 2qee h GLU 11 Cb -0.01 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 2qee h GLU 11 CO -0.09 0.75 0.16 0.87 -1.16 0.00 0.00 179.01 179.54 2qee h LYS 12 N 0.87 1.02 -0.09 2.33 1.57 -0.71 -0.44 116.57 121.13 2qee h LYS 12 Ca 0.22 -0.23 -0.16 0.00 -1.87 0.00 0.00 60.65 58.61 2qee h LYS 12 Cb 0.14 -0.14 0.01 0.00 0.08 0.00 0.00 32.23 32.32 2qee h LYS 12 CO -0.02 0.90 -0.56 0.28 -0.57 0.00 0.00 179.45 179.48 2qee h VAL 13 N 0.97 1.37 -0.40 0.50 2.07 -0.58 -1.51 116.25 118.66 2qee h VAL 13 Ca 0.21 -1.89 -0.01 0.00 0.82 0.00 0.00 66.70 65.83 2qee h VAL 13 Cb 0.34 2.25 -0.02 0.00 -1.52 0.00 0.00 31.29 32.34 2qee h VAL 13 CO 0.00 0.57 0.22 0.11 0.02 0.00 0.00 177.57 178.49 2qee h LYS 14 N 0.12 0.56 -0.47 1.57 1.57 -1.13 0.12 116.57 118.91 2qee h LYS 14 Ca -0.05 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.72 2qee h LYS 14 Cb 1.21 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 33.37 2qee h LYS 14 CO 0.11 0.46 0.20 -0.91 -0.57 0.00 0.00 179.45 178.75 2qee h ASN 15 N 0.52 0.26 -0.02 0.86 -0.26 -1.08 0.33 115.58 116.20 2qee h ASN 15 Ca 0.14 0.04 -0.00 0.00 -0.56 0.00 0.00 56.30 55.92 2qee h ASN 15 Cb 0.06 -0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.32 2qee h ASN 15 CO -0.02 0.19 0.01 0.00 -1.06 0.00 0.00 177.43 176.55 2qee h ALA 16 N 1.28 0.03 0.04 -0.83 0.00 -0.80 0.19 119.26 119.16 2qee h ALA 16 Ca 0.21 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qee h ALA 16 Cb 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2qee h ALA 16 CO -0.18 -0.40 -0.06 0.28 0.00 0.00 0.00 179.25 178.89 2qee h VAL 17 N -0.11 0.84 -0.91 0.00 2.07 -0.63 -1.62 116.25 115.88 2qee h VAL 17 Ca 0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.60 2qee h VAL 17 Cb 0.15 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 2qee h VAL 17 CO -0.00 0.00 0.57 0.78 0.02 0.00 0.00 177.57 178.94 2qee h ASN 18 N -0.13 0.89 1.69 0.57 2.35 -0.80 -2.81 115.58 117.35 2qee h ASN 18 Ca 0.01 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2qee h ASN 18 Cb 0.14 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.35 2qee h ASN 18 CO -0.04 0.56 0.00 0.78 -1.65 0.00 0.00 177.43 177.08 2qee h ASN 19 N 1.02 0.00 -2.95 5.81 2.35 -0.77 -3.45 115.58 117.58 2qee h ASN 19 Ca 0.40 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.58 2qee h ASN 19 Cb 0.21 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.53 2qee h ASN 19 CO -0.19 0.00 0.88 -1.58 -1.65 0.00 0.00 177.43 174.89 2qee s GLN 20 N -3.29 4.24 0.38 0.81 2.00 -0.63 -4.99 119.66 118.19 2qee s GLN 20 Ca 0.06 1.60 -0.27 0.00 -2.00 0.00 0.00 55.36 54.75 2qee s GLN 20 Cb 0.07 -3.73 -0.09 0.00 0.80 0.00 0.00 33.01 30.05 2qee s GLN 20 CO 0.63 -0.69 1.26 -2.14 -0.50 0.00 0.00 175.29 173.85 2qee s PRO 21 N 3.42 4.10 -0.14 1.67 0.02 -1.26 -4.93 135.00 137.88 2qee s PRO 21 Ca 0.52 2.07 -0.06 0.00 0.02 0.00 0.00 61.00 63.55 2qee s PRO 21 Cb -0.20 -2.82 -0.04 0.00 0.02 0.00 0.00 34.50 31.46 2qee s PRO 21 CO 0.13 -0.35 0.08 0.08 -0.33 0.00 0.00 177.00 176.60 2qee s VAL 22 N -1.27 4.95 -0.31 3.83 1.01 0.28 -4.63 120.40 124.25 2qee s VAL 22 Ca 0.55 0.01 -0.20 0.00 0.00 0.00 0.00 61.98 62.34 2qee s VAL 22 Cb -0.36 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 2qee s VAL 22 CO 0.47 0.55 0.60 -0.89 0.00 0.00 0.00 175.10 175.82 2qee s THR 23 N -0.43 4.96 -0.59 3.92 2.01 -0.29 -0.96 115.64 124.26 2qee s THR 23 Ca 0.10 0.74 -0.19 0.00 0.31 0.00 0.00 61.69 62.64 2qee s THR 23 Cb -0.12 -3.98 0.10 0.00 0.01 0.00 0.00 72.50 68.50 2qee s THR 23 CO 0.02 -0.15 0.73 -0.62 -0.69 0.00 0.00 174.62 173.91 2qee s ASP 24 N 1.67 6.19 0.00 3.53 -1.08 0.11 -4.70 116.67 122.39 2qee s ASP 24 Ca 0.23 -1.33 0.17 0.00 -0.52 0.00 0.00 52.55 51.10 2qee s ASP 24 Cb -0.15 -2.32 0.52 0.00 -1.46 0.00 0.00 42.92 39.51 2qee s ASP 24 CO 0.12 -1.14 1.40 1.15 0.52 0.00 0.00 175.17 177.23 2qee n MET 25 N 6.50 1.90 -3.46 4.34 0.00 -1.26 -0.87 117.12 124.28 2qee n MET 25 Ca -0.08 -1.39 -0.06 0.00 0.00 0.00 0.00 57.70 56.17 2qee n MET 25 Cb 0.43 -1.36 -0.07 0.00 0.00 0.00 0.00 33.22 32.22 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 -1.59 -1.00 0.26 3.17 5.65 -1.26 -4.71 115.29 115.81 2qee s HIS 26 Ca 0.30 1.39 0.02 0.00 0.25 0.00 0.00 55.06 57.02 2qee s HIS 26 Cb 0.16 0.30 -0.04 0.00 -1.18 0.00 0.00 32.58 31.82 2qee s HIS 26 CO 0.22 -0.66 0.19 0.95 -0.65 0.00 0.00 174.74 174.79 2qee s THR 27 N 2.66 0.03 -0.33 0.89 -4.23 -0.06 -1.37 115.64 113.24 2qee s THR 27 Ca 0.07 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.65 2qee s THR 27 Cb -0.14 -2.50 0.46 0.00 1.34 0.00 0.00 72.50 71.66 2qee s THR 27 CO -0.16 0.00 1.35 1.41 -0.54 0.00 0.00 174.62 176.68 2qee n HIS 28 N -0.43 2.10 -3.37 3.99 8.25 0.16 -2.39 115.22 123.53 2qee n HIS 28 Ca 0.04 -2.11 -0.19 0.00 -0.26 0.00 0.00 57.72 55.21 2qee n HIS 28 Cb 0.65 -0.49 -0.00 0.00 1.12 0.00 0.00 29.99 31.26 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 -3.51 3.88 0.02 2.41 1.43 -1.20 -4.57 118.68 117.13 2qee s LEU 29 Ca 0.50 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 53.34 2qee s LEU 29 Cb 0.42 -2.71 -0.02 0.00 0.03 0.00 0.00 46.19 43.91 2qee s LEU 29 CO 0.01 -0.51 -0.04 -0.36 0.23 0.00 0.00 176.35 175.69 2qee s PHE 30 N -2.22 0.30 0.17 0.29 0.08 -1.26 -4.35 117.98 111.00 2qee s PHE 30 Ca 0.47 -0.41 -0.32 0.00 0.12 0.00 0.00 56.93 56.79 2qee s PHE 30 Cb -0.09 -0.20 -0.16 0.00 -0.57 0.00 0.00 43.02 41.99 2qee s PHE 30 CO 0.31 -0.13 1.08 0.45 -0.10 0.00 0.00 175.22 176.84 2qee n SER 31 N 1.90 1.01 0.27 1.36 2.88 -1.26 -4.79 113.62 114.99 2qee n SER 31 Ca -0.21 1.15 0.14 0.00 -1.33 0.00 0.00 58.87 58.62 2qee n SER 31 Cb 0.56 -1.18 0.77 0.00 -0.75 0.00 0.00 64.21 63.61 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 2.99 0.00 0.00 -1.46 0.13 -1.94 -1.25 132.00 130.47 2qee h PRO 32 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2qee h PRO 32 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2qee h PRO 32 CO 0.68 0.09 0.00 0.27 -0.23 0.00 0.00 178.00 178.81 2qee n ASN 33 N -3.51 0.37 0.00 1.44 6.94 -1.26 -1.09 115.26 118.14 2qee n ASN 33 Ca -0.02 0.62 0.14 0.00 -0.02 0.00 0.00 54.58 55.30 2qee n ASN 33 Cb 0.23 -0.68 0.73 0.00 -2.36 0.00 0.00 39.78 37.70 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 -1.94 0.00 -2.89 -2.53 3.01 -0.47 -5.01 117.46 107.64 2qee n PHE 34 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 2qee n PHE 34 Cb 0.14 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 39.36 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 1.08 0.29 0.27 1.37 0.00 -0.25 -4.39 105.19 103.57 2qee n GLY 35 Ca 0.14 -1.19 0.17 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.47 114.58 116.17 2qee h GLU 36 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2qee h GLU 36 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2qee h GLU 36 CO 0.00 0.00 0.00 -0.84 -1.16 0.00 0.00 179.01 177.01 2qee h ILE 37 N 0.00 0.00 -3.57 3.13 3.07 -1.97 -3.37 117.51 114.79 2qee h ILE 37 Ca 0.00 -0.12 -0.56 0.00 1.55 0.00 0.00 64.86 65.73 2qee h ILE 37 Cb 0.39 0.91 -0.07 0.00 -0.27 0.00 0.00 36.82 37.78 2qee h ILE 37 CO 0.00 0.00 0.97 -0.22 -1.05 0.00 0.00 178.15 177.85 2qee s LEU 38 N -5.37 3.61 0.03 0.16 2.96 -0.93 -4.79 118.68 114.34 2qee s LEU 38 Ca -0.02 0.54 -0.21 0.00 -0.22 0.00 0.00 54.13 54.22 2qee s LEU 38 Cb 0.10 -3.53 -0.06 0.00 0.50 0.00 0.00 46.19 43.20 2qee s LEU 38 CO 0.36 -1.32 0.62 -0.76 -1.32 0.00 0.00 176.35 173.93 2qee s LEU 39 N 4.77 4.46 0.01 -0.68 1.43 -1.26 -5.01 118.68 122.40 2qee s LEU 39 Ca 0.51 1.26 -0.28 0.00 -1.03 0.00 0.00 54.13 54.60 2qee s LEU 39 Cb -0.09 -2.98 0.07 0.00 0.03 0.00 0.00 46.19 43.21 2qee s LEU 39 CO 0.32 0.14 0.63 -1.66 0.23 0.00 0.00 176.35 176.00 2qee s TRP 40 N -0.47 -0.58 0.00 0.29 1.48 -1.26 -0.39 118.94 118.01 2qee s TRP 40 Ca 0.32 0.84 0.00 0.00 -1.06 0.00 0.00 56.10 56.20 2qee s TRP 40 Cb -0.19 0.41 0.00 0.00 -1.16 0.00 0.00 33.47 32.53 2qee s TRP 40 CO 0.19 -0.65 0.00 -0.40 -4.06 0.00 0.00 176.95 172.03 2qee n ASP 41 N 0.61 0.00 -0.12 -2.66 5.68 -1.26 -4.63 116.55 114.17 2qee n ASP 41 Ca -0.19 0.00 -0.03 0.00 -0.50 0.00 0.00 54.79 54.07 2qee n ASP 41 Cb 0.59 0.00 0.18 0.00 -1.14 0.00 0.00 41.12 40.75 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 1.23 -0.67 2.12 6.09 -1.95 0.14 117.51 124.47 2qee h ILE 42 Ca 0.00 -0.89 -0.07 0.00 -1.37 0.00 0.00 64.86 62.53 2qee h ILE 42 Cb 0.00 0.76 -0.03 0.00 0.47 0.00 0.00 36.82 38.02 2qee h ILE 42 CO 0.00 0.32 0.15 0.44 -3.07 0.00 0.00 178.15 176.00 2qee h ASP 43 N 0.77 1.03 -0.20 2.19 3.32 -1.95 -0.11 116.42 121.46 2qee h ASP 43 Ca 0.16 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 2qee h ASP 43 Cb 0.36 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2qee h ASP 43 CO 0.01 1.00 0.10 -0.33 -1.72 0.00 0.00 179.24 178.30 2qee h GLU 44 N 1.01 0.29 -0.42 3.56 4.39 -1.66 -1.45 114.58 120.30 2qee h GLU 44 Ca 0.21 -0.04 0.08 0.00 0.34 0.00 0.00 59.36 59.95 2qee h GLU 44 Cb 0.38 -0.05 -0.08 0.00 -0.10 0.00 0.00 28.75 28.90 2qee h GLU 44 CO 0.00 0.32 -0.06 -0.07 -1.16 0.00 0.00 179.01 178.04 2qee h LEU 45 N 0.20 -0.30 -1.26 1.33 3.38 -0.61 -2.19 115.31 115.86 2qee h LEU 45 Ca 0.07 0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.08 2qee h LEU 45 Cb 0.12 0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2qee h LEU 45 CO -0.01 -0.11 -0.37 -0.07 0.09 0.00 0.00 178.44 177.98 2qee h LEU 46 N 0.04 0.00 -2.24 1.67 3.38 -0.85 -2.96 115.31 114.35 2qee h LEU 46 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2qee h LEU 46 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2qee h LEU 46 CO -0.40 0.37 0.00 0.35 0.09 0.00 0.00 178.44 178.85 2qee n THR 47 N -4.08 0.74 -1.45 0.22 -2.24 -0.56 -4.67 114.28 102.23 2qee n THR 47 Ca -0.02 -0.79 -0.47 0.00 -2.27 0.00 0.00 64.05 60.50 2qee n THR 47 Cb 0.41 0.52 -0.02 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 1.30 -0.03 0.27 4.78 9.36 -0.84 -4.70 117.16 127.30 2qee n TYR 48 Ca 0.20 0.87 0.11 0.00 3.32 0.00 0.00 57.90 62.40 2qee n TYR 48 Cb 0.53 -2.04 0.73 0.00 -0.63 0.00 0.00 39.34 37.94 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 1.26 0.00 -0.81 2.98 2.07 -1.91 -1.27 115.15 117.46 2qee h HIS 49 Ca -0.32 0.00 0.05 0.00 -2.85 0.00 0.00 60.37 57.25 2qee h HIS 49 Cb 1.41 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 31.34 2qee h HIS 49 CO 0.43 0.07 0.53 1.88 -3.07 0.00 0.00 177.93 177.77 2qee h TYR 50 N 0.00 0.94 0.00 6.12 -1.99 -1.94 -2.36 116.97 117.74 2qee h TYR 50 Ca -0.00 0.02 -0.19 0.00 2.00 0.00 0.00 58.73 60.57 2qee h TYR 50 Cb 0.15 -0.31 -0.03 0.00 2.00 0.00 0.00 36.73 38.54 2qee h TYR 50 CO 0.00 0.52 -0.91 -0.07 -0.00 0.00 0.00 178.16 177.71 2qee h LEU 51 N 0.95 0.00 -0.16 3.88 3.38 -1.53 -2.92 115.31 118.90 2qee h LEU 51 Ca 0.33 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.34 2qee h LEU 51 Cb 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2qee h LEU 51 CO -0.11 0.88 -0.06 0.58 0.09 0.00 0.00 178.44 179.82 2qee h VAL 52 N 0.00 0.80 -0.48 1.22 2.07 -1.13 0.56 116.25 119.29 2qee h VAL 52 Ca -0.02 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.59 2qee h VAL 52 Cb 1.68 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 32.18 2qee h VAL 52 CO 0.11 0.00 0.06 0.00 0.02 0.00 0.00 177.57 177.77 2qee h ALA 53 N 1.13 0.51 -0.28 1.67 0.00 -1.42 -1.84 119.26 119.03 2qee h ALA 53 Ca 0.08 0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.94 2qee h ALA 53 Cb 0.15 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2qee h ALA 53 CO -0.18 -0.34 -0.51 0.93 0.00 0.00 0.00 179.25 179.15 2qee h GLU 54 N 0.19 0.79 -0.42 0.00 5.08 -1.29 -3.04 114.58 115.89 2qee h GLU 54 Ca 0.24 -0.48 -0.10 0.00 -1.00 0.00 0.00 59.36 58.02 2qee h GLU 54 Cb 0.34 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2qee h GLU 54 CO -0.35 1.11 -0.15 -0.24 -1.00 0.00 0.00 179.01 178.38 2qee h VAL 55 N 0.62 1.26 0.00 3.13 3.04 -0.63 -2.25 116.25 121.43 2qee h VAL 55 Ca 0.02 -1.24 -0.01 0.00 -1.01 0.00 0.00 66.70 64.47 2qee h VAL 55 Cb 1.10 1.10 -0.00 0.00 -2.01 0.00 0.00 31.29 31.48 2qee h VAL 55 CO 0.11 0.42 -0.02 0.24 -1.01 0.00 0.00 177.57 177.31 2qee h MET 56 N 0.71 0.00 0.00 4.17 2.86 -1.23 0.11 114.93 121.55 2qee h MET 56 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2qee h MET 56 Cb 0.65 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.31 2qee h MET 56 CO 0.05 0.02 0.00 0.00 1.06 0.00 0.00 176.91 178.04 2qee h ARG 57 N 0.00 0.00 0.00 1.72 3.08 -1.31 -3.36 114.38 114.51 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 0.07 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 2qee h ARG 57 CO 0.00 0.00 -1.54 0.91 -1.07 0.00 0.00 179.97 178.28 2qee n TRP 58 N -2.61 0.00 -2.70 3.04 7.02 -0.11 -5.07 117.44 117.02 2qee n TRP 58 Ca 0.02 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.16 2qee n TRP 58 Cb 0.27 -0.36 -0.06 0.00 -2.42 0.00 0.00 31.31 28.74 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 -2.19 4.22 -0.73 -0.99 -1.32 0.21 -4.95 115.64 109.89 2qee s THR 59 Ca -0.13 1.35 0.25 0.00 -1.21 0.00 0.00 61.69 61.96 2qee s THR 59 Cb 0.04 -3.56 0.17 0.00 -1.51 0.00 0.00 72.50 67.63 2qee s THR 59 CO 0.21 -0.33 1.57 0.47 -2.21 0.00 0.00 174.62 174.34 2qee n ASP 60 N -0.83 0.70 -4.73 8.08 8.00 -1.26 -4.86 116.55 121.64 2qee n ASP 60 Ca 0.08 0.33 -0.42 0.00 0.71 0.00 0.00 54.79 55.49 2qee n ASP 60 Cb 0.54 -0.31 -0.02 0.00 -0.02 0.00 0.00 41.12 41.30 2qee n ASP 60 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qee s VAL 61 N -3.12 2.30 0.64 2.53 1.01 -1.26 -4.97 120.40 117.52 2qee s VAL 61 Ca 0.09 0.23 -0.14 0.00 0.00 0.00 0.00 61.98 62.16 2qee s VAL 61 Cb 0.13 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 2qee s VAL 61 CO 0.65 0.03 1.06 -0.94 0.00 0.00 0.00 175.10 175.90 2qee s SER 62 N 0.78 5.62 0.30 3.32 1.04 -1.26 -4.86 113.70 118.65 2qee s SER 62 Ca 0.67 1.73 -0.01 0.00 0.48 0.00 0.00 55.95 58.81 2qee s SER 62 Cb -0.46 -2.52 0.46 0.00 0.10 0.00 0.00 66.02 63.61 2qee s SER 62 CO 0.39 -1.28 1.96 -0.29 0.98 0.00 0.00 173.24 175.01 2qee h ILE 63 N -0.05 1.18 -0.32 -1.02 6.09 -1.97 -0.59 117.51 120.84 2qee h ILE 63 Ca -0.46 -0.38 -0.02 0.00 -1.37 0.00 0.00 64.86 62.63 2qee h ILE 63 Cb 1.21 -0.01 -0.01 0.00 0.47 0.00 0.00 36.82 38.48 2qee h ILE 63 CO 0.57 0.20 0.10 -0.33 -3.07 0.00 0.00 178.15 175.62 2qee h GLU 64 N 1.10 0.49 -0.89 2.19 3.07 -1.94 -1.93 114.58 116.67 2qee h GLU 64 Ca 0.32 -0.10 0.04 0.00 -0.50 0.00 0.00 59.36 59.12 2qee h GLU 64 Cb -0.06 -0.07 -0.05 0.00 -0.84 0.00 0.00 28.75 27.72 2qee h GLU 64 CO -0.08 0.53 0.58 0.00 -1.40 0.00 0.00 179.01 178.64 2qee h ALA 65 N 0.94 1.46 -0.28 3.43 0.00 -1.83 -1.84 119.26 121.15 2qee h ALA 65 Ca 0.10 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2qee h ALA 65 Cb 0.24 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2qee h ALA 65 CO -0.00 0.44 0.16 0.35 0.00 0.00 0.00 179.25 180.19 2qee h PHE 66 N 1.08 0.37 -0.14 0.00 3.57 -0.78 -2.15 116.94 118.90 2qee h PHE 66 Ca 0.36 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.78 2qee h PHE 66 Cb 0.07 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 2qee h PHE 66 CO -0.00 0.30 -0.24 -1.49 -2.23 0.00 0.00 178.31 174.64 2qee h TRP 67 N 0.34 0.27 -0.18 0.41 -0.00 -1.10 -2.56 115.95 113.13 2qee h TRP 67 Ca 0.10 -0.05 -0.05 0.00 -0.00 0.00 0.00 58.89 58.89 2qee h TRP 67 Cb 0.04 -0.07 -0.01 0.00 -0.00 0.00 0.00 29.16 29.12 2qee h TRP 67 CO -0.04 0.48 -0.12 0.00 -0.00 0.00 0.00 178.44 178.76 2qee h ALA 68 N 1.53 1.48 -2.90 1.49 0.00 -0.98 -3.45 119.26 116.43 2qee h ALA 68 Ca 0.04 -0.21 -0.56 0.00 0.00 0.00 0.00 54.91 54.17 2qee h ALA 68 Cb 0.56 -0.09 0.17 0.00 0.00 0.00 0.00 17.79 18.42 2qee h ALA 68 CO 0.04 0.37 0.23 -1.33 0.00 0.00 0.00 179.25 178.56 2qee n MET 69 N -4.27 0.88 -1.22 0.00 2.81 -0.84 -5.02 117.12 109.45 2qee n MET 69 Ca -0.00 0.35 -0.30 0.00 -1.81 0.00 0.00 57.70 55.94 2qee n MET 69 Cb 0.27 -2.29 0.13 0.00 -0.71 0.00 0.00 33.22 30.62 2qee n MET 69 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2qee s SER 70 N -1.37 3.71 0.19 7.83 1.04 -1.26 -4.81 113.70 119.02 2qee s SER 70 Ca 0.78 1.55 -0.12 0.00 0.48 0.00 0.00 55.95 58.64 2qee s SER 70 Cb -0.39 -2.24 0.15 0.00 0.10 0.00 0.00 66.02 63.64 2qee s SER 70 CO 0.45 -2.50 1.81 0.50 0.98 0.00 0.00 173.24 174.47 2qee h LYS 71 N -1.45 0.59 -0.57 4.02 3.64 -1.96 -0.71 116.57 120.13 2qee h LYS 71 Ca -0.48 -0.04 0.09 0.00 -1.27 0.00 0.00 60.65 58.95 2qee h LYS 71 Cb 1.27 -0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 32.89 2qee h LYS 71 CO 0.54 0.39 0.19 -0.09 -2.27 0.00 0.00 179.45 178.21 2qee h ARG 72 N 0.61 0.35 -0.45 1.90 2.43 -1.93 0.02 114.38 117.31 2qee h ARG 72 Ca 0.24 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.28 2qee h ARG 72 Cb 0.09 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2qee h ARG 72 CO -0.13 0.23 -0.16 0.93 -1.51 0.00 0.00 179.97 179.32 2qee h GLU 73 N 0.36 0.85 0.03 0.20 5.08 -1.74 -1.10 114.58 118.26 2qee h GLU 73 Ca 0.29 -0.32 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2qee h GLU 73 Cb 0.36 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2qee h GLU 73 CO -0.31 0.95 -0.07 1.96 -1.00 0.00 0.00 179.01 180.55 2qee h GLN 74 N 0.75 -0.13 -0.69 2.33 4.20 -0.87 -1.69 115.11 119.02 2qee h GLN 74 Ca 0.11 0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.92 2qee h GLN 74 Cb 0.69 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 28.43 2qee h GLN 74 CO 0.05 -0.09 0.34 0.00 -0.67 0.00 0.00 178.83 178.46 2qee h ALA 75 N 0.82 0.94 -0.64 3.87 0.00 -0.86 -0.57 119.26 122.81 2qee h ALA 75 Ca 0.02 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2qee h ALA 75 Cb 0.15 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2qee h ALA 75 CO -0.05 -0.06 0.20 -0.44 0.00 0.00 0.00 179.25 178.91 2qee h ASP 76 N 0.58 0.93 -0.08 0.00 3.32 -1.03 0.95 116.42 121.10 2qee h ASP 76 Ca 0.34 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2qee h ASP 76 Cb 0.34 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 2qee h ASP 76 CO -0.26 0.89 0.01 0.25 -1.72 0.00 0.00 179.24 178.41 2qee h LEU 77 N 0.93 0.14 -0.63 1.55 5.85 -1.01 -0.77 115.31 121.36 2qee h LEU 77 Ca 0.21 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 2qee h LEU 77 Cb 0.29 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 2qee h LEU 77 CO -0.01 0.39 0.33 0.40 -0.34 0.00 0.00 178.44 179.21 2qee h ILE 78 N -0.12 1.21 0.07 4.05 2.04 -0.94 0.51 117.51 124.33 2qee h ILE 78 Ca 0.02 -0.55 0.02 0.00 1.00 0.00 0.00 64.86 65.35 2qee h ILE 78 Cb 0.31 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 2qee h ILE 78 CO 0.00 0.23 -0.19 -0.25 0.00 0.00 0.00 178.15 177.95 2qee h TRP 79 N 0.86 -0.49 -0.59 1.37 2.91 -0.76 -0.31 115.95 118.95 2qee h TRP 79 Ca 0.22 0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.24 2qee h TRP 79 Cb 0.07 0.21 -0.03 0.00 -0.51 0.00 0.00 29.16 28.90 2qee h TRP 79 CO -0.00 -0.27 0.31 1.49 -1.03 0.00 0.00 178.44 178.93 2qee h GLU 80 N -0.34 0.83 0.07 2.65 4.57 -0.71 -1.33 114.58 120.32 2qee h GLU 80 Ca 0.04 -0.11 -0.25 0.00 -1.18 0.00 0.00 59.36 57.86 2qee h GLU 80 Cb 0.38 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 2qee h GLU 80 CO -0.13 0.65 -1.10 0.93 -1.18 0.00 0.00 179.01 178.18 2qee h GLU 81 N 0.79 0.30 0.00 1.92 4.39 -0.75 0.01 114.58 121.24 2qee h GLU 81 Ca 0.20 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.49 2qee h GLU 81 Cb 0.07 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2qee h GLU 81 CO -0.03 1.15 -1.40 1.28 -1.16 0.00 0.00 179.01 178.85 2qee n LEU 82 N -3.61 0.16 -0.04 1.33 4.77 -0.14 -3.87 117.00 115.61 2qee n LEU 82 Ca -0.07 -0.12 -0.04 0.00 -0.03 0.00 0.00 56.01 55.74 2qee n LEU 82 Cb 0.94 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.99 2qee n LEU 82 CO 0.52 0.04 -0.73 0.49 -1.33 0.00 0.00 177.39 176.38 2qee n PHE 83 N -1.83 0.00 -0.09 -1.77 3.72 -0.56 -3.34 117.46 113.60 2qee n PHE 83 Ca -0.01 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.16 2qee n PHE 83 Cb 0.33 -0.29 -0.12 0.00 -0.94 0.00 0.00 39.48 38.46 2qee n PHE 83 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 2qee n ILE 84 N -2.54 1.58 0.19 4.37 2.08 -0.87 -4.39 119.36 119.78 2qee n ILE 84 Ca -0.12 -0.23 0.10 0.00 0.56 0.00 0.00 62.75 63.05 2qee n ILE 84 Cb 0.66 -1.93 0.13 0.00 -0.75 0.00 0.00 39.64 37.75 2qee n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2qee h LYS 85 N -0.76 0.00 -4.37 0.38 1.57 -1.17 -3.44 116.57 108.78 2qee h LYS 85 Ca -0.44 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.13 2qee h LYS 85 Cb 1.52 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.65 2qee h LYS 85 CO -0.19 0.11 -0.71 1.03 -0.57 0.00 0.00 179.45 179.12 2qee s ARG 86 N -3.16 0.55 0.26 3.15 3.00 -1.25 -5.05 118.95 116.45 2qee s ARG 86 Ca 0.06 -0.93 -0.29 0.00 0.00 0.00 0.00 55.73 54.57 2qee s ARG 86 Cb 0.06 -0.07 -0.09 0.00 0.00 0.00 0.00 34.95 34.84 2qee s ARG 86 CO 0.69 -0.02 1.25 -1.12 0.00 0.00 0.00 175.30 176.10 2qee s SER 87 N -2.10 6.95 -0.52 0.23 0.01 -1.26 -3.53 113.70 113.48 2qee s SER 87 Ca -0.04 2.46 -0.06 0.00 1.31 0.00 0.00 55.95 59.62 2qee s SER 87 Cb -0.03 -2.63 -0.16 0.00 0.21 0.00 0.00 66.02 63.41 2qee s SER 87 CO -0.03 -0.43 2.81 -0.81 0.41 0.00 0.00 173.24 175.19 2qee n PRO 88 N 1.65 2.12 0.20 12.44 -0.04 -1.21 -4.63 135.00 145.54 2qee n PRO 88 Ca 0.02 -1.21 0.12 0.00 -0.04 0.00 0.00 63.50 62.39 2qee n PRO 88 Cb 0.43 -2.19 0.15 0.00 -0.04 0.00 0.00 33.50 31.85 2qee n PRO 88 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2qee h VAL 89 N 2.61 0.00 -4.19 0.52 -1.51 -1.89 -3.06 116.25 108.73 2qee h VAL 89 Ca 0.37 -0.99 -0.53 0.00 -1.23 0.00 0.00 66.70 64.31 2qee h VAL 89 Cb 0.81 1.93 0.19 0.00 -2.13 0.00 0.00 31.29 32.09 2qee h VAL 89 CO 0.82 0.00 0.30 -1.54 -1.23 0.00 0.00 177.57 175.92 2qee n SER 90 N -3.04 0.86 -0.27 4.19 3.41 -1.26 -4.69 113.62 112.82 2qee n SER 90 Ca 0.04 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.20 2qee n SER 90 Cb 0.53 -1.50 0.13 0.00 -0.26 0.00 0.00 64.21 63.11 2qee n SER 90 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2qee h GLU 91 N -1.07 0.79 -0.10 4.33 4.57 -1.97 0.18 114.58 121.31 2qee h GLU 91 Ca -0.46 -0.05 -0.15 0.00 -1.18 0.00 0.00 59.36 57.53 2qee h GLU 91 Cb 1.29 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 2qee h GLU 91 CO 0.45 0.52 -0.59 0.00 -1.18 0.00 0.00 179.01 178.21 2qee h ALA 92 N 1.39 0.81 0.02 2.92 0.00 -1.95 0.37 119.26 122.82 2qee h ALA 92 Ca 0.34 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2qee h ALA 92 Cb 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2qee h ALA 92 CO -0.19 0.72 -0.01 0.00 0.00 0.00 0.00 179.25 179.76 2qee h ARG 94 N -0.61 0.30 -0.67 0.00 2.43 -0.55 -1.39 114.38 113.89 2qee h ARG 94 Ca -0.00 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 2qee h ARG 94 Cb 0.57 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.99 2qee h ARG 94 CO 0.01 0.20 0.34 0.78 -1.51 0.00 0.00 179.97 179.78 2qee h GLY 95 N 0.31 0.99 0.72 2.80 0.00 -0.71 -1.23 103.07 105.95 2qee h GLY 95 Ca 0.53 -0.22 0.05 0.00 0.00 0.00 0.00 47.33 47.69 2qee h GLY 95 CO -0.57 0.09 0.37 -2.08 0.00 0.00 0.00 176.54 174.35 2qee h VAL 96 N 0.60 0.99 -0.52 4.60 2.07 -1.04 -1.55 116.25 121.40 2qee h VAL 96 Ca 0.32 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 2qee h VAL 96 Cb 0.29 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2qee h VAL 96 CO -0.24 0.13 0.26 -0.07 0.02 0.00 0.00 177.57 177.67 2qee h LEU 97 N 0.69 0.67 -1.30 2.57 3.38 -1.11 -1.04 115.31 119.17 2qee h LEU 97 Ca 0.28 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2qee h LEU 97 Cb 0.15 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2qee h LEU 97 CO -0.16 0.60 0.41 0.74 0.09 0.00 0.00 178.44 180.12 2qee h THR 98 N 0.69 1.18 -0.09 0.22 2.02 -0.92 0.19 112.91 116.21 2qee h THR 98 Ca 0.18 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 2qee h THR 98 Cb 0.10 0.23 -0.00 0.00 -1.74 0.00 0.00 68.15 66.74 2qee h THR 98 CO -0.02 0.18 -0.00 0.00 0.37 0.00 0.00 175.52 176.05 2qee h LEU 100 N -0.13 -0.60 -0.85 0.00 3.38 -0.79 -1.94 115.31 114.38 2qee h LEU 100 Ca 0.02 0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.12 2qee h LEU 100 Cb 0.36 0.29 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 2qee h LEU 100 CO 0.00 -0.23 0.56 -0.61 0.09 0.00 0.00 178.44 178.25 2qee h GLN 101 N -0.20 1.10 -0.32 1.13 4.15 -0.91 -0.23 115.11 119.84 2qee h GLN 101 Ca 0.12 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.45 2qee h GLN 101 Cb 0.39 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 2qee h GLN 101 CO -0.32 0.73 0.09 0.78 -1.93 0.00 0.00 178.83 178.17 2qee h GLY 102 N 1.14 0.49 0.88 2.39 0.00 -0.72 -1.52 103.07 105.73 2qee h GLY 102 Ca 0.31 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2qee h GLY 102 CO -0.07 0.23 -0.03 1.04 0.00 0.00 0.00 176.54 177.71 2qee n LEU 103 N -4.37 0.32 0.00 3.11 4.77 -0.69 -4.90 117.00 115.24 2qee n LEU 103 Ca 0.02 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2qee n LEU 103 Cb 0.17 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2qee n LEU 103 CO 0.37 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 2qee n GLY 104 N 1.14 0.55 3.50 -0.72 0.00 -0.57 -5.03 105.19 104.06 2qee n GLY 104 Ca 0.19 -0.56 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 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 4.12 -0.44 0.99 1.43 -0.18 -5.00 118.68 119.60 2qee s LEU 105 Ca 0.00 -0.34 -0.29 0.00 -1.03 0.00 0.00 54.13 52.47 2qee s LEU 105 Cb 0.00 -2.06 0.02 0.00 0.03 0.00 0.00 46.19 44.18 2qee s LEU 105 CO 0.00 -0.15 1.25 -0.62 0.23 0.00 0.00 176.35 177.05 2qee s ASP 106 N 1.68 6.53 0.59 2.29 -1.08 -1.26 -3.12 116.67 122.30 2qee s ASP 106 Ca 0.06 0.65 0.38 0.00 -0.52 0.00 0.00 52.55 53.13 2qee s ASP 106 Cb -0.17 -2.55 2.09 0.00 -1.46 0.00 0.00 42.92 40.83 2qee s ASP 106 CO 0.08 -1.30 2.17 -0.65 0.52 0.00 0.00 175.17 175.99 2qee h PRO 107 N 9.75 0.00 -0.04 4.34 0.11 -1.90 -2.56 132.00 141.70 2qee h PRO 107 Ca -0.25 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.87 2qee h PRO 107 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2qee h PRO 107 CO 1.11 0.00 0.03 0.00 -0.21 0.00 0.00 178.00 178.93 2qee h ALA 108 N 1.93 1.84 0.00 -0.75 0.00 -2.01 -2.50 119.26 117.77 2qee h ALA 108 Ca 0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2qee h ALA 108 Cb 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2qee h ALA 108 CO 0.00 -0.05 -0.92 1.79 0.00 0.00 0.00 179.25 180.07 2qee h THR 109 N 0.00 0.90 -2.65 0.00 1.35 -1.87 -3.47 112.91 107.17 2qee h THR 109 Ca 0.02 -2.39 -0.37 0.00 -0.55 0.00 0.00 66.41 63.12 2qee h THR 109 Cb 0.08 2.38 -0.05 0.00 -1.73 0.00 0.00 68.15 68.83 2qee h THR 109 CO -0.00 0.52 -0.44 0.54 -0.25 0.00 0.00 175.52 175.89 2qee n ARG 110 N -3.14 -1.72 -2.92 4.72 1.74 -0.94 -4.91 116.66 109.49 2qee n ARG 110 Ca -0.03 0.95 -0.44 0.00 -0.77 0.00 0.00 57.85 57.56 2qee n ARG 110 Cb 0.82 -5.51 0.00 0.00 -1.02 0.00 0.00 32.46 26.75 2qee n ARG 110 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2qee n ASP 111 N -1.72 5.26 -0.14 0.55 -0.08 -1.26 -4.84 116.55 114.33 2qee n ASP 111 Ca -0.21 -3.01 0.04 0.00 -1.51 0.00 0.00 54.79 50.10 2qee n ASP 111 Cb 0.65 -1.54 0.34 0.00 2.34 0.00 0.00 41.12 42.92 2qee n ASP 111 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2qee h LEU 112 N 9.11 0.67 -0.47 -2.67 5.85 -1.98 0.50 115.31 126.30 2qee h LEU 112 Ca 0.31 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 2qee h LEU 112 Cb 0.84 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 2qee h LEU 112 CO 1.27 0.46 0.21 1.56 -0.34 0.00 0.00 178.44 181.60 2qee h GLN 113 N 0.78 0.70 -0.67 1.25 1.08 -2.00 0.01 115.11 116.24 2qee h GLN 113 Ca 0.25 -0.12 -0.07 0.00 -1.45 0.00 0.00 58.65 57.27 2qee h GLN 113 Cb 0.05 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 2qee h GLN 113 CO -0.07 0.61 0.16 0.28 -0.95 0.00 0.00 178.83 178.86 2qee h VAL 114 N 0.62 1.26 -0.47 -0.54 2.07 -1.71 -2.56 116.25 114.93 2qee h VAL 114 Ca 0.16 -0.96 0.02 0.00 0.82 0.00 0.00 66.70 66.75 2qee h VAL 114 Cb 0.16 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 2qee h VAL 114 CO -0.02 0.36 0.27 1.88 0.02 0.00 0.00 177.57 180.09 2qee h TYR 115 N 1.02 0.51 -0.62 1.57 0.05 -0.27 -2.33 116.97 116.91 2qee h TYR 115 Ca 0.21 0.02 0.06 0.00 0.05 0.00 0.00 58.73 59.07 2qee h TYR 115 Cb 0.37 -0.16 -0.04 0.00 1.01 0.00 0.00 36.73 37.91 2qee h TYR 115 CO 0.03 0.29 0.41 0.00 -1.05 0.00 0.00 178.16 177.84 2qee h ARG 116 N 0.55 0.57 -0.36 4.88 3.08 -0.73 -2.32 114.38 120.06 2qee h ARG 116 Ca 0.19 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 2qee h ARG 116 Cb 0.03 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 2qee h ARG 116 CO -0.09 0.38 0.17 0.93 -1.07 0.00 0.00 179.97 180.29 2qee h GLU 117 N 0.59 0.50 -0.50 0.04 5.08 -1.02 -2.44 114.58 116.83 2qee h GLU 117 Ca 0.27 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.66 2qee h GLU 117 Cb 0.29 -0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.38 2qee h GLU 117 CO -0.08 0.39 0.13 -0.92 -1.00 0.00 0.00 179.01 177.53 2qee h TYR 118 N 0.50 0.22 0.05 4.33 3.20 -1.37 -3.04 116.97 120.88 2qee h TYR 118 Ca 0.13 0.03 -0.24 0.00 3.14 0.00 0.00 58.73 61.78 2qee h TYR 118 Cb 0.06 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 2qee h TYR 118 CO 0.00 0.03 -1.16 0.74 -1.64 0.00 0.00 178.16 176.14 2qee h PHE 119 N 0.28 0.19 0.00 -3.82 0.04 -1.56 -3.23 116.94 108.84 2qee h PHE 119 Ca 0.25 -0.14 0.00 0.00 2.80 0.00 0.00 57.97 60.88 2qee h PHE 119 Cb 0.31 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.46 2qee h PHE 119 CO -0.20 1.12 0.07 0.00 -0.60 0.00 0.00 178.31 178.70 2qee h ALA 120 N 0.83 1.05 -0.30 2.45 0.00 -1.34 -2.59 119.26 119.35 2qee h ALA 120 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2qee h ALA 120 Cb 1.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.66 2qee h ALA 120 CO 0.15 -0.05 0.00 0.36 0.00 0.00 0.00 179.25 179.71 2qee n LYS 121 N -2.33 3.17 -4.31 0.00 2.85 -1.22 -5.00 118.16 111.33 2qee n LYS 121 Ca -0.02 -2.87 -0.19 0.00 -1.05 0.00 0.00 58.31 54.18 2qee n LYS 121 Cb 0.11 -1.89 -0.11 0.00 -0.65 0.00 0.00 35.03 32.49 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 -2.79 1.21 0.50 -1.58 1.02 -0.98 -5.15 119.74 111.97 2qee s LYS 122 Ca 0.44 -1.41 -0.03 0.00 0.02 0.00 0.00 55.97 54.98 2qee s LYS 122 Cb 0.35 -1.12 -0.01 0.00 -0.52 0.00 0.00 37.83 36.53 2qee s LYS 122 CO 0.10 0.21 0.77 0.95 -0.92 0.00 0.00 175.35 176.45 2qee s THR 123 N -2.38 4.21 0.23 2.17 -4.23 -1.26 -4.96 115.64 109.42 2qee s THR 123 Ca 0.16 -0.15 -0.07 0.00 -1.18 0.00 0.00 61.69 60.44 2qee s THR 123 Cb -0.04 -3.60 0.20 0.00 1.34 0.00 0.00 72.50 70.40 2qee s THR 123 CO 0.05 -0.53 1.71 0.28 -0.54 0.00 0.00 174.62 175.60 2qee h SER 124 N 0.20 0.13 -0.68 3.99 0.02 -1.97 -1.61 113.55 113.62 2qee h SER 124 Ca -0.46 0.11 -0.06 0.00 -0.84 0.00 0.00 61.79 60.54 2qee h SER 124 Cb 1.24 0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.88 2qee h SER 124 CO 0.60 0.05 0.19 -0.33 -1.14 0.00 0.00 176.83 176.20 2qee h GLU 125 N 0.34 1.06 -0.34 3.45 3.07 -1.94 -0.06 114.58 120.17 2qee h GLU 125 Ca 0.37 -0.24 -0.04 0.00 -0.50 0.00 0.00 59.36 58.95 2qee h GLU 125 Cb 0.57 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 2qee h GLU 125 CO -0.42 0.93 0.07 0.93 -1.40 0.00 0.00 179.01 179.12 2qee h GLU 126 N 1.00 0.56 -0.89 2.33 5.08 -1.87 -1.96 114.58 118.82 2qee h GLU 126 Ca 0.22 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2qee h GLU 126 Cb 0.32 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 2qee h GLU 126 CO -0.00 0.62 0.59 0.37 -1.00 0.00 0.00 179.01 179.59 2qee h GLN 127 N 0.40 1.18 -0.25 2.33 5.75 -1.03 -0.10 115.11 123.39 2qee h GLN 127 Ca 0.10 -0.07 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 2qee h GLN 127 Cb 0.33 -0.26 -0.03 0.00 1.07 0.00 0.00 27.48 28.59 2qee h GLN 127 CO 0.00 0.78 0.09 0.28 -2.65 0.00 0.00 178.83 177.34 2qee h VAL 128 N 1.21 0.95 -0.66 2.39 2.07 -0.94 0.13 116.25 121.40 2qee h VAL 128 Ca 0.33 -0.07 0.03 0.00 0.82 0.00 0.00 66.70 67.80 2qee h VAL 128 Cb -0.13 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 2qee h VAL 128 CO -0.07 0.04 0.41 0.44 0.02 0.00 0.00 177.57 178.41 2qee h ASP 129 N 0.21 0.67 -0.08 0.57 3.32 -1.03 -0.95 116.42 119.12 2qee h ASP 129 Ca 0.11 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2qee h ASP 129 Cb 0.07 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 2qee h ASP 129 CO -0.10 0.47 0.04 0.74 -1.72 0.00 0.00 179.24 178.66 2qee h THR 130 N 0.81 1.11 -0.22 0.35 2.02 -0.71 -2.67 112.91 113.60 2qee h THR 130 Ca 0.26 -0.31 -0.11 0.00 0.77 0.00 0.00 66.41 67.03 2qee h THR 130 Cb 0.01 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2qee h THR 130 CO -0.10 0.09 -0.28 0.58 0.37 0.00 0.00 175.52 176.18 2qee h VAL 131 N 0.01 1.32 -0.18 3.16 2.07 -0.47 -0.36 116.25 121.81 2qee h VAL 131 Ca 0.03 -1.47 -0.05 0.00 0.82 0.00 0.00 66.70 66.03 2qee h VAL 131 Cb 0.11 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 2qee h VAL 131 CO -0.00 0.45 -0.10 -0.07 0.02 0.00 0.00 177.57 177.87 2qee h LEU 132 N 0.27 0.26 0.14 2.57 3.38 -1.23 0.61 115.31 121.31 2qee h LEU 132 Ca 0.03 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2qee h LEU 132 Cb 0.85 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2qee h LEU 132 CO 0.07 0.39 -0.07 -0.61 0.09 0.00 0.00 178.44 178.31 2qee h GLN 133 N 0.26 -0.18 -0.84 1.13 -0.00 -1.25 -1.22 115.11 113.01 2qee h GLN 133 Ca 0.06 0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.72 2qee h GLN 133 Cb 0.34 0.04 -0.04 0.00 0.00 0.00 0.00 27.48 27.82 2qee h GLN 133 CO 0.02 0.23 0.52 -0.07 0.00 0.00 0.00 178.83 179.52 2qee h LEU 134 N -0.64 1.00 -0.32 -2.39 3.38 -0.66 -2.10 115.31 113.58 2qee h LEU 134 Ca -0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2qee h LEU 134 Cb 0.48 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2qee h LEU 134 CO 0.03 0.77 -0.13 0.00 0.09 0.00 0.00 178.44 179.20 2qee n ALA 135 N -2.36 2.80 -3.84 1.53 0.00 0.17 -4.94 120.51 113.88 2qee n ALA 135 Ca 0.09 -0.30 -0.25 0.00 0.00 0.00 0.00 53.44 52.98 2qee n ALA 135 Cb 0.05 -1.29 0.01 0.00 0.00 0.00 0.00 19.45 18.22 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 -0.83 -1.61 -4.39 0.00 5.15 -0.68 -4.80 115.26 108.10 2qee n ASN 136 Ca 0.15 -0.88 -0.36 0.00 -0.60 0.00 0.00 54.58 52.89 2qee n ASN 136 Cb 0.29 -3.66 -0.13 0.00 -0.53 0.00 0.00 39.78 35.75 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 -3.68 3.96 -0.01 3.44 1.01 -0.55 -0.56 120.40 124.01 2qee s VAL 137 Ca 0.15 -0.31 0.07 0.00 0.00 0.00 0.00 61.98 61.89 2qee s VAL 137 Cb -0.08 -2.85 -0.24 0.00 0.00 0.00 0.00 36.38 33.22 2qee s VAL 137 CO 0.84 0.36 0.77 0.77 0.00 0.00 0.00 175.10 177.84 2qee h SER 138 N 8.19 0.11 -3.47 3.32 4.64 -1.34 -3.44 113.55 121.56 2qee h SER 138 Ca -0.39 -0.19 -0.25 0.00 -0.47 0.00 0.00 61.79 60.50 2qee h SER 138 Cb 1.17 -0.03 -0.31 0.00 -0.31 0.00 0.00 62.40 62.91 2qee h SER 138 CO 0.59 1.16 -0.61 -1.81 -0.87 0.00 0.00 176.83 175.29 2qee s ASP 139 N -6.44 -0.09 -0.17 4.97 1.01 -1.14 -4.75 116.67 110.05 2qee s ASP 139 Ca -0.06 0.27 0.01 0.00 0.71 0.00 0.00 52.55 53.48 2qee s ASP 139 Cb 0.08 0.17 0.01 0.00 1.01 0.00 0.00 42.92 44.19 2qee s ASP 139 CO 0.82 -0.14 -0.19 -0.69 0.21 0.00 0.00 175.17 175.19 2qee s VAL 140 N 1.06 2.20 -0.18 -1.27 1.01 0.24 -0.71 120.40 122.75 2qee s VAL 140 Ca -0.08 -0.91 -0.22 0.00 0.00 0.00 0.00 61.98 60.77 2qee s VAL 140 Cb -0.11 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 2qee s VAL 140 CO -0.05 0.53 0.69 -0.69 0.00 0.00 0.00 175.10 175.58 2qee s VAL 141 N 1.15 4.98 0.75 2.92 1.01 -0.05 -0.35 120.40 130.82 2qee s VAL 141 Ca 0.01 1.34 -0.06 0.00 0.00 0.00 0.00 61.98 63.27 2qee s VAL 141 Cb -0.14 -4.01 0.12 0.00 0.00 0.00 0.00 36.38 32.35 2qee s VAL 141 CO -0.09 0.10 1.05 -0.04 0.00 0.00 0.00 175.10 176.12 2qee s MET 142 N 1.89 1.68 -0.26 2.72 -1.94 0.60 -0.88 119.30 123.11 2qee s MET 142 Ca 0.32 -0.69 -0.01 0.00 -1.71 0.00 0.00 55.69 53.60 2qee s MET 142 Cb -0.16 -2.20 0.03 0.00 2.01 0.00 0.00 34.83 34.52 2qee s MET 142 CO 0.11 -1.53 -0.06 0.99 -0.01 0.00 0.00 175.02 174.53 2qee s THR 143 N -3.30 2.81 -0.22 2.05 2.01 -1.01 -3.35 115.64 114.64 2qee s THR 143 Ca 0.65 -1.17 -0.01 0.00 0.31 0.00 0.00 61.69 61.48 2qee s THR 143 Cb -0.07 -2.49 0.02 0.00 0.01 0.00 0.00 72.50 69.97 2qee s THR 143 CO 0.46 0.11 -0.11 0.20 -0.69 0.00 0.00 174.62 174.59 2qee s ASN 144 N 1.28 3.92 -0.38 3.53 -0.87 -0.08 -4.94 114.94 117.39 2qee s ASN 144 Ca -0.02 -0.77 -0.04 0.00 -1.57 0.00 0.00 52.86 50.46 2qee s ASN 144 Cb -0.18 -1.60 0.09 0.00 -0.02 0.00 0.00 41.25 39.54 2qee s ASN 144 CO -0.04 -0.07 0.17 -0.62 -2.57 0.00 0.00 177.10 173.96 2qee s ASP 145 N 1.32 5.26 0.01 -1.22 -1.08 -1.26 -0.71 116.67 118.98 2qee s ASP 145 Ca 0.02 -1.71 0.08 0.00 -0.52 0.00 0.00 52.55 50.42 2qee s ASP 145 Cb -0.15 -1.84 0.34 0.00 -1.46 0.00 0.00 42.92 39.81 2qee s ASP 145 CO -0.07 -0.47 1.25 -0.81 0.52 0.00 0.00 175.17 175.59 2qee n PRO 146 N 4.68 0.01 0.00 4.34 -0.04 -1.26 -1.57 135.00 141.16 2qee n PRO 146 Ca -0.07 0.38 0.13 0.00 -0.04 0.00 0.00 63.50 63.90 2qee n PRO 146 Cb 0.42 -1.52 0.37 0.00 -0.04 0.00 0.00 33.50 32.74 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 -1.53 0.03 -3.11 0.54 3.72 -1.26 -4.62 117.46 111.23 2qee n PHE 147 Ca 0.02 0.01 -0.41 0.00 -0.05 0.00 0.00 57.45 57.02 2qee n PHE 147 Cb 0.09 -0.36 -0.06 0.00 -0.94 0.00 0.00 39.48 38.20 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 -3.07 6.59 0.23 4.37 2.15 -0.61 -4.94 116.67 121.39 2qee s ASP 148 Ca 0.12 0.72 -0.08 0.00 0.43 0.00 0.00 52.55 53.74 2qee s ASP 148 Cb 0.18 -2.34 0.20 0.00 -0.30 0.00 0.00 42.92 40.66 2qee s ASP 148 CO 0.64 -0.36 1.86 0.44 -0.17 0.00 0.00 175.17 177.58 2qee h ASP 149 N 7.86 1.06 0.68 -0.34 3.32 -1.87 0.24 116.42 127.36 2qee h ASP 149 Ca -0.27 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 56.67 2qee h ASP 149 Cb 1.12 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 2qee h ASP 149 CO 0.77 0.82 -0.38 0.78 -1.72 0.00 0.00 179.24 179.51 2qee h ASN 150 N 1.20 -0.95 -0.89 6.45 2.35 -1.95 -2.76 115.58 119.03 2qee h ASN 150 Ca 0.31 0.05 0.03 0.00 -0.55 0.00 0.00 56.30 56.14 2qee h ASN 150 Cb -0.03 0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.56 2qee h ASN 150 CO -0.06 -0.61 0.57 -0.33 -1.65 0.00 0.00 177.43 175.35 2qee h GLU 151 N -0.99 1.08 -0.77 0.81 5.08 -1.65 -2.02 114.58 116.12 2qee h GLU 151 Ca -0.09 -0.07 0.12 0.00 -1.00 0.00 0.00 59.36 58.33 2qee h GLU 151 Cb 0.79 -0.24 -0.08 0.00 0.50 0.00 0.00 28.75 29.71 2qee h GLU 151 CO 0.11 0.72 0.37 -0.09 -1.00 0.00 0.00 179.01 179.12 2qee h ARG 152 N 1.12 0.57 -0.50 2.33 2.43 -0.49 -2.59 114.38 117.24 2qee h ARG 152 Ca 0.35 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 2qee h ARG 152 Cb -0.00 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 2qee h ARG 152 CO -0.12 0.37 0.26 0.82 -1.51 0.00 0.00 179.97 179.80 2qee h ILE 153 N 0.58 1.18 -0.76 1.20 2.04 -1.06 -1.09 117.51 119.60 2qee h ILE 153 Ca 0.40 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2qee h ILE 153 Cb 0.51 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 2qee h ILE 153 CO -0.33 0.20 0.47 -1.28 0.00 0.00 0.00 178.15 177.21 2qee h SER 154 N 0.66 0.89 -0.52 1.72 0.87 -1.46 -0.20 113.55 115.52 2qee h SER 154 Ca 0.17 -0.05 -0.06 0.00 -1.23 0.00 0.00 61.79 60.63 2qee h SER 154 Cb 0.08 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 2qee h SER 154 CO -0.03 0.68 0.11 -0.50 -0.53 0.00 0.00 176.83 176.56 2qee h TRP 155 N 1.03 0.93 -0.20 2.24 4.06 -1.27 -2.63 115.95 120.11 2qee h TRP 155 Ca 0.27 -0.10 -0.08 0.00 2.06 0.00 0.00 58.89 61.05 2qee h TRP 155 Cb -0.07 -0.27 -0.01 0.00 -1.00 0.00 0.00 29.16 27.81 2qee h TRP 155 CO -0.01 0.79 -0.21 -0.07 -3.56 0.00 0.00 178.44 175.38 2qee h LEU 156 N 0.85 0.34 0.00 -4.49 3.38 -0.43 -1.66 115.31 113.30 2qee h LEU 156 Ca 0.18 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2qee h LEU 156 Cb 0.35 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2qee h LEU 156 CO 0.00 0.57 0.00 -0.62 0.09 0.00 0.00 178.44 178.48 2qee n GLU 157 N -4.18 0.70 -0.97 1.13 1.02 -0.16 -4.89 120.64 113.30 2qee n GLU 157 Ca -0.00 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2qee n GLU 157 Cb 0.35 -1.50 0.00 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 0.61 0.56 3.67 0.62 0.00 -0.63 -5.00 105.19 105.02 2qee n GLY 158 Ca 0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.73 2qee n GLY 158 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qee n LYS 159 N -2.88 2.10 -4.47 1.61 5.02 -1.02 -5.00 118.16 113.53 2qee n LYS 159 Ca 0.00 0.76 -0.32 0.00 -2.02 0.00 0.00 58.31 56.73 2qee n LYS 159 Cb 0.00 -2.52 -0.10 0.00 -0.02 0.00 0.00 35.03 32.38 2qee n LYS 159 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2qee s GLN 160 N 0.93 2.55 0.62 1.97 -1.52 -1.26 -4.68 119.66 118.27 2qee s GLN 160 Ca 0.79 -0.72 -0.17 0.00 -1.95 0.00 0.00 55.36 53.32 2qee s GLN 160 Cb -0.69 -2.50 -0.02 0.00 -0.22 0.00 0.00 33.01 29.58 2qee s GLN 160 CO 0.38 0.60 1.13 -1.25 -0.25 0.00 0.00 175.29 175.90 2qee s PRO 161 N -1.40 2.94 0.40 2.91 0.04 -1.26 -4.98 135.00 133.65 2qee s PRO 161 Ca 0.17 1.50 -0.22 0.00 0.04 0.00 0.00 61.00 62.49 2qee s PRO 161 Cb -0.11 -1.96 -0.15 0.00 0.04 0.00 0.00 34.50 32.32 2qee s PRO 161 CO 0.07 -1.16 0.27 -3.47 0.04 0.00 0.00 177.00 172.75 2qee n ASP 162 N -2.05 -2.10 0.11 6.66 -0.08 -1.26 -4.86 116.55 112.97 2qee n ASP 162 Ca 0.11 0.86 0.10 0.00 -1.51 0.00 0.00 54.79 54.35 2qee n ASP 162 Cb 0.51 -0.97 0.45 0.00 2.34 0.00 0.00 41.12 43.45 2qee n ASP 162 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2qee n SER 163 N 1.93 0.48 0.11 1.67 3.41 -1.26 -1.05 113.62 118.91 2qee n SER 163 Ca 0.12 0.65 0.13 0.00 -0.26 0.00 0.00 58.87 59.51 2qee n SER 163 Cb 0.39 -0.74 0.32 0.00 -0.26 0.00 0.00 64.21 63.92 2qee n SER 163 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2qee h ARG 164 N 0.00 0.00 -5.55 4.33 3.08 -1.89 -3.45 114.38 110.89 2qee h ARG 164 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.40 2qee h ARG 164 Cb 0.22 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 30.09 2qee h ARG 164 CO 0.00 0.00 -0.62 -0.06 -1.07 0.00 0.00 179.97 178.22 2qee s PHE 165 N -3.13 3.15 0.08 3.04 0.08 -0.21 -0.59 117.98 120.39 2qee s PHE 165 Ca 0.09 0.01 0.10 0.00 0.12 0.00 0.00 56.93 57.24 2qee s PHE 165 Cb 0.12 -1.93 -0.03 0.00 -0.57 0.00 0.00 43.02 40.61 2qee s PHE 165 CO 0.64 0.22 -0.26 -1.01 -0.10 0.00 0.00 175.22 174.71 2qee s HIS 166 N -0.13 2.27 0.32 0.36 3.76 0.53 -4.73 115.29 117.67 2qee s HIS 166 Ca 0.05 -0.40 -0.11 0.00 -0.15 0.00 0.00 55.06 54.45 2qee s HIS 166 Cb -0.13 -1.31 -0.07 0.00 1.11 0.00 0.00 32.58 32.18 2qee s HIS 166 CO 0.02 0.20 0.68 0.00 -0.85 0.00 0.00 174.74 174.79 2qee s ALA 167 N -0.90 3.43 -0.02 -1.40 0.00 -1.26 -0.29 121.76 121.31 2qee s ALA 167 Ca 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 2qee s ALA 167 Cb -0.10 -2.60 0.02 0.00 0.00 0.00 0.00 23.12 20.44 2qee s ALA 167 CO 0.03 0.24 0.05 0.00 0.00 0.00 0.00 175.76 176.09 2qee s ALA 168 N -2.09 -0.07 -0.47 0.00 0.00 -1.21 -0.92 121.76 117.00 2qee s ALA 168 Ca 0.50 0.24 -0.23 0.00 0.00 0.00 0.00 51.96 52.47 2qee s ALA 168 Cb -0.11 -0.16 0.03 0.00 0.00 0.00 0.00 23.12 22.88 2qee s ALA 168 CO 0.25 -0.06 0.78 -1.17 0.00 0.00 0.00 175.76 175.55 2qee s LEU 169 N 0.45 4.32 -0.02 0.00 2.96 -0.76 -0.91 118.68 124.74 2qee s LEU 169 Ca -0.04 -0.25 -0.27 0.00 -0.22 0.00 0.00 54.13 53.35 2qee s LEU 169 Cb -0.05 -2.87 -0.04 0.00 0.50 0.00 0.00 46.19 43.74 2qee s LEU 169 CO -0.02 -0.95 0.84 -0.60 -1.32 0.00 0.00 176.35 174.31 2qee s ARG 170 N 3.28 4.51 0.00 1.98 3.52 0.11 -0.98 118.95 131.37 2qee s ARG 170 Ca 0.28 1.17 0.00 0.00 -0.13 0.00 0.00 55.73 57.05 2qee s ARG 170 Cb -0.13 -3.44 0.00 0.00 -1.56 0.00 0.00 34.95 29.82 2qee s ARG 170 CO 0.21 0.05 0.75 1.28 -0.81 0.00 0.00 175.30 176.78 2qee n LEU 171 N 3.67 1.44 -0.24 -0.88 4.77 0.08 -4.47 117.00 121.37 2qee n LEU 171 Ca 0.02 -1.44 0.03 0.00 -0.03 0.00 0.00 56.01 54.59 2qee n LEU 171 Cb 0.51 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.73 2qee n LEU 171 CO 0.49 0.36 0.81 0.44 -1.33 0.00 0.00 177.39 178.17 2qee h ASP 172 N 0.00 -0.36 -0.09 -1.43 5.19 -1.93 0.25 116.42 118.04 2qee h ASP 172 Ca 0.00 0.18 -0.04 0.00 -0.62 0.00 0.00 57.03 56.55 2qee h ASP 172 Cb 0.37 0.33 -0.01 0.00 0.18 0.00 0.00 39.33 40.20 2qee h ASP 172 CO 0.00 -0.16 -0.04 -0.65 -3.12 0.00 0.00 179.24 175.26 2qee h PRO 173 N 0.09 0.33 -0.16 3.56 0.11 -1.94 0.16 132.00 134.15 2qee h PRO 173 Ca 0.37 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 66.31 2qee h PRO 173 Cb 0.63 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.68 2qee h PRO 173 CO -0.63 0.40 -0.34 1.25 -0.21 0.00 0.00 178.00 178.47 2qee h LEU 174 N 0.32 0.57 0.17 2.35 5.85 -1.32 -2.20 115.31 121.06 2qee h LEU 174 Ca 0.07 -0.56 -0.33 0.00 0.84 0.00 0.00 57.88 57.90 2qee h LEU 174 Cb 0.29 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.16 2qee h LEU 174 CO 0.01 1.03 -1.60 -0.07 -0.34 0.00 0.00 178.44 177.47 2qee h LEU 175 N 0.14 0.55 0.00 2.25 4.07 -1.00 -3.29 115.31 118.02 2qee h LEU 175 Ca 0.00 -0.74 0.00 0.00 0.08 0.00 0.00 57.88 57.22 2qee h LEU 175 Cb 0.94 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.50 2qee h LEU 175 CO 0.07 1.61 -1.58 0.59 -1.08 0.00 0.00 178.44 178.06 2qee n ASN 176 N -3.55 0.60 -2.53 -0.43 3.02 0.55 -3.91 115.26 109.02 2qee n ASN 176 Ca -0.19 -0.32 -0.04 0.00 -0.03 0.00 0.00 54.58 54.00 2qee n ASN 176 Cb 1.06 1.61 0.05 0.00 -0.61 0.00 0.00 39.78 41.89 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 -1.95 1.98 -0.30 3.52 1.02 -0.83 -4.92 120.64 119.15 2qee n GLU 177 Ca -0.01 -3.53 0.00 0.00 -0.02 0.00 0.00 57.16 53.60 2qee n GLU 177 Cb 0.45 -1.63 0.19 0.00 -0.02 0.00 0.00 31.44 30.43 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 2.37 1.10 -0.98 -0.32 3.20 -1.61 -0.45 116.97 120.28 2qee h TYR 178 Ca -0.04 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.00 2qee h TYR 178 Cb 1.37 -0.37 -0.09 0.00 1.54 0.00 0.00 36.73 39.18 2qee h TYR 178 CO 0.55 0.67 0.62 0.93 -1.64 0.00 0.00 178.16 179.28 2qee h GLU 179 N 1.16 0.84 0.24 1.82 4.39 -1.91 0.22 114.58 121.35 2qee h GLU 179 Ca 0.34 -0.05 -0.34 0.00 0.34 0.00 0.00 59.36 59.65 2qee h GLU 179 Cb -0.06 -0.19 0.03 0.00 -0.10 0.00 0.00 28.75 28.43 2qee h GLU 179 CO -0.09 0.56 -1.53 1.96 -1.16 0.00 0.00 179.01 178.75 2qee h GLN 180 N 0.87 0.51 0.00 2.33 7.50 -1.71 -3.37 115.11 121.24 2qee h GLN 180 Ca 0.50 -0.87 -0.13 0.00 0.50 0.00 0.00 58.65 58.65 2qee h GLN 180 Cb 0.64 0.32 -0.02 0.00 0.05 0.00 0.00 27.48 28.48 2qee h GLN 180 CO -0.27 1.41 -0.64 1.15 -1.50 0.00 0.00 178.83 178.98 2qee h THR 181 N 0.12 1.36 -0.37 -0.54 2.02 -0.48 -3.20 112.91 111.83 2qee h THR 181 Ca -0.28 -2.25 0.06 0.00 0.77 0.00 0.00 66.41 64.72 2qee h THR 181 Cb 2.14 2.24 -0.02 0.00 -1.74 0.00 0.00 68.15 70.78 2qee h THR 181 CO 0.25 0.62 0.25 0.07 0.37 0.00 0.00 175.52 177.09 2qee h LYS 182 N 0.00 0.21 -0.62 6.66 2.10 -0.76 0.34 116.57 124.51 2qee h LYS 182 Ca -0.01 -0.01 -0.07 0.00 -2.00 0.00 0.00 60.65 58.56 2qee h LYS 182 Cb 1.19 -0.05 -0.03 0.00 -0.90 0.00 0.00 32.23 32.45 2qee h LYS 182 CO 0.08 0.14 0.10 0.45 -2.00 0.00 0.00 179.45 178.22 2qee h HIS 183 N 0.22 1.07 -0.40 0.07 3.86 -1.79 0.46 115.15 118.64 2qee h HIS 183 Ca 0.17 -0.14 -0.16 0.00 -1.16 0.00 0.00 60.37 59.08 2qee h HIS 183 Cb 0.38 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 2qee h HIS 183 CO -0.00 0.91 -0.36 0.00 0.86 0.00 0.00 177.93 179.34 2qee h ARG 184 N 0.96 0.95 -0.53 2.45 3.08 -1.22 -1.43 114.38 118.64 2qee h ARG 184 Ca 0.19 -0.49 0.04 0.00 0.07 0.00 0.00 59.98 59.79 2qee h ARG 184 Cb 0.41 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.43 2qee h ARG 184 CO 0.01 1.15 0.30 -0.07 -1.07 0.00 0.00 179.97 180.28 2qee h LEU 185 N 0.78 0.45 0.08 3.04 3.38 -0.48 -1.98 115.31 120.58 2qee h LEU 185 Ca 0.07 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.06 2qee h LEU 185 Cb 0.96 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 2qee h LEU 185 CO 0.09 0.32 -0.11 0.03 0.09 0.00 0.00 178.44 178.85 2qee h ARG 186 N 0.58 -0.23 -1.01 1.13 3.08 -0.65 0.98 114.38 118.27 2qee h ARG 186 Ca 0.22 0.02 0.25 0.00 0.07 0.00 0.00 59.98 60.54 2qee h ARG 186 Cb 0.08 0.05 -0.09 0.00 0.08 0.00 0.00 29.97 30.09 2qee h ARG 186 CO -0.13 -0.15 0.65 -0.44 -1.07 0.00 0.00 179.97 178.83 2qee h ASP 187 N -0.24 0.46 -0.06 7.04 3.32 -0.91 0.17 116.42 126.20 2qee h ASP 187 Ca 0.02 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2qee h ASP 187 Cb 0.25 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2qee h ASP 187 CO -0.06 0.12 0.00 0.79 -1.72 0.00 0.00 179.24 178.37 2qee n TRP 188 N -4.61 0.08 -0.22 4.55 8.01 -0.78 -4.89 117.44 119.58 2qee n TRP 188 Ca 0.24 -0.04 0.00 0.00 -1.31 0.00 0.00 57.50 56.39 2qee n TRP 188 Cb 0.82 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.12 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 1.02 0.86 3.27 6.99 0.00 0.59 -5.04 105.19 112.89 2qee n GLY 189 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.04 3.57 -1.37 1.61 2.02 0.29 -4.98 117.35 116.46 2qee s TYR 190 Ca 0.00 -1.98 -0.13 0.00 -0.37 0.00 0.00 57.07 54.59 2qee s TYR 190 Cb 0.00 -3.67 0.09 0.00 -0.40 0.00 0.00 41.96 37.97 2qee s TYR 190 CO 0.00 -0.97 2.00 1.63 -1.57 0.00 0.00 175.55 176.64 2qee n LYS 191 N 4.22 3.15 -2.19 -0.62 4.76 -1.26 -2.74 118.16 123.48 2qee n LYS 191 Ca 0.05 -3.04 -0.36 0.00 -2.87 0.00 0.00 58.31 52.09 2qee n LYS 191 Cb 0.43 -3.21 0.01 0.00 -1.84 0.00 0.00 35.03 30.42 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 2.50 2.99 0.49 -0.18 -7.23 -1.26 -4.80 120.40 112.91 2qee s VAL 192 Ca 0.46 0.65 -0.04 0.00 -1.81 0.00 0.00 61.98 61.24 2qee s VAL 192 Cb 0.10 -3.28 -0.02 0.00 0.56 0.00 0.00 36.38 33.74 2qee s VAL 192 CO -0.03 -0.10 0.77 0.20 -0.31 0.00 0.00 175.10 175.63 2qee s ASN 193 N -1.60 5.97 0.29 4.85 0.02 -1.26 -4.99 114.94 118.22 2qee s ASN 193 Ca 0.72 0.67 0.09 0.00 -1.02 0.00 0.00 52.86 53.32 2qee s ASN 193 Cb -0.27 -1.91 0.44 0.00 0.02 0.00 0.00 41.25 39.53 2qee s ASN 193 CO 0.31 -0.72 1.67 0.44 0.02 0.00 0.00 177.10 178.82 2qee h ASP 194 N 0.20 0.08 -3.79 -1.22 3.45 -2.03 -3.42 116.42 109.69 2qee h ASP 194 Ca -0.47 -0.04 -0.49 0.00 0.43 0.00 0.00 57.03 56.46 2qee h ASP 194 Cb 1.23 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 39.97 2qee h ASP 194 CO 0.60 0.60 0.40 -0.70 -1.57 0.00 0.00 179.24 178.57 2qee s GLU 195 N -3.85 4.72 -0.74 3.56 2.12 -1.26 -5.00 118.70 118.25 2qee s GLU 195 Ca -0.03 1.59 -0.26 0.00 0.36 0.00 0.00 54.97 56.63 2qee s GLU 195 Cb 0.13 -3.17 0.03 0.00 0.26 0.00 0.00 34.13 31.38 2qee s GLU 195 CO 0.76 0.36 1.26 -0.46 -0.54 0.00 0.00 175.26 176.64 2qee s TRP 196 N -1.23 2.33 0.14 5.30 -0.11 -1.26 -4.69 118.94 119.41 2qee s TRP 196 Ca 0.44 -0.13 0.03 0.00 1.22 0.00 0.00 56.10 57.66 2qee s TRP 196 Cb -0.27 -4.60 -0.01 0.00 -1.50 0.00 0.00 33.47 27.09 2qee s TRP 196 CO 0.34 -2.03 0.10 0.27 -4.62 0.00 0.00 176.95 171.01 2qee n ASN 197 N 9.20 0.03 -0.28 5.86 0.23 -1.26 -5.01 115.26 124.04 2qee n ASN 197 Ca 0.04 -1.90 0.03 0.00 -0.53 0.00 0.00 54.58 52.22 2qee n ASN 197 Cb 0.49 0.62 0.25 0.00 -2.08 0.00 0.00 39.78 39.06 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 0.99 -0.55 -3.83 4.57 -1.99 -1.23 114.58 112.54 2qee h GLU 198 Ca -0.10 -0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.05 2qee h GLU 198 Cb 0.49 -0.22 -0.04 0.00 -0.16 0.00 0.00 28.75 28.82 2qee h GLU 198 CO 0.16 0.65 0.31 0.78 -1.18 0.00 0.00 179.01 179.73 2qee h GLY 199 N 1.01 0.78 1.20 1.92 0.00 -1.97 0.11 103.07 106.13 2qee h GLY 199 Ca 0.36 -0.22 -0.18 0.00 0.00 0.00 0.00 47.33 47.28 2qee h GLY 199 CO -0.12 0.17 -0.55 1.76 0.00 0.00 0.00 176.54 177.79 2qee h SER 200 N 0.60 0.93 -0.27 0.19 0.02 -1.65 -1.35 113.55 112.02 2qee h SER 200 Ca 0.23 -0.50 -0.01 0.00 -0.84 0.00 0.00 61.79 60.67 2qee h SER 200 Cb 0.09 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 2qee h SER 200 CO -0.13 1.29 0.12 0.40 -1.14 0.00 0.00 176.83 177.37 2qee h ILE 201 N 0.64 1.16 -0.26 3.27 2.04 -0.88 -1.11 117.51 122.36 2qee h ILE 201 Ca 0.01 -0.45 -0.10 0.00 1.00 0.00 0.00 64.86 65.32 2qee h ILE 201 Cb 1.15 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 2qee h ILE 201 CO 0.12 0.16 -0.27 1.56 0.00 0.00 0.00 178.15 179.72 2qee h GLN 202 N 0.30 0.51 -0.39 2.37 1.08 -0.61 -1.68 115.11 116.70 2qee h GLN 202 Ca 0.09 -0.20 -0.11 0.00 -1.45 0.00 0.00 58.65 56.98 2qee h GLN 202 Cb 0.14 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 2qee h GLN 202 CO -0.01 0.73 -0.19 0.93 -0.95 0.00 0.00 178.83 179.35 2qee h GLU 203 N 0.45 0.81 -0.65 1.46 4.39 -0.92 -0.77 114.58 119.35 2qee h GLU 203 Ca 0.06 -0.35 -0.04 0.00 0.34 0.00 0.00 59.36 59.36 2qee h GLU 203 Cb 0.70 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.30 2qee h GLU 203 CO 0.05 0.98 0.23 0.28 -1.16 0.00 0.00 179.01 179.40 2qee h VAL 204 N 0.61 1.24 -0.52 3.13 2.07 -1.12 -1.18 116.25 120.48 2qee h VAL 204 Ca 0.09 -0.80 -0.06 0.00 0.82 0.00 0.00 66.70 66.74 2qee h VAL 204 Cb 0.74 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2qee h VAL 204 CO 0.06 0.31 0.08 0.11 0.02 0.00 0.00 177.57 178.15 2qee h LYS 205 N 0.93 0.82 -0.53 1.57 1.57 -1.22 -1.50 116.57 118.21 2qee h LYS 205 Ca 0.21 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2qee h LYS 205 Cb 0.25 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2qee h LYS 205 CO -0.01 0.77 0.16 -0.09 -0.57 0.00 0.00 179.45 179.71 2qee h ARG 206 N 0.78 0.83 -0.07 3.15 2.43 -0.71 -0.40 114.38 120.38 2qee h ARG 206 Ca 0.16 -0.18 0.03 0.00 -0.81 0.00 0.00 59.98 59.18 2qee h ARG 206 Cb 0.36 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 2qee h ARG 206 CO 0.01 0.77 -0.10 0.35 -1.51 0.00 0.00 179.97 179.48 2qee h PHE 207 N 0.74 -0.25 -0.41 2.20 3.57 -0.75 0.19 116.94 122.22 2qee h PHE 207 Ca 0.17 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.69 2qee h PHE 207 Cb 0.29 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 2qee h PHE 207 CO 0.02 -0.16 0.26 -0.07 -2.23 0.00 0.00 178.31 176.13 2qee h LEU 208 N -0.14 0.45 -0.40 0.59 3.38 -1.14 -1.86 115.31 116.18 2qee h LEU 208 Ca 0.06 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2qee h LEU 208 Cb 0.23 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2qee h LEU 208 CO -0.16 0.32 0.24 0.74 0.09 0.00 0.00 178.44 179.67 2qee h THR 209 N 0.54 1.14 -0.68 0.22 2.02 -0.71 0.11 112.91 115.55 2qee h THR 209 Ca 0.15 -0.33 0.06 0.00 0.77 0.00 0.00 66.41 67.07 2qee h THR 209 Cb -0.05 0.62 -0.06 0.00 -1.74 0.00 0.00 68.15 66.93 2qee h THR 209 CO -0.04 0.14 0.38 0.44 0.37 0.00 0.00 175.52 176.81 2qee h ASP 210 N 0.53 0.56 0.84 4.18 3.32 -0.38 -0.38 116.42 125.09 2qee h ASP 210 Ca 0.14 0.03 -0.17 0.00 0.02 0.00 0.00 57.03 57.05 2qee h ASP 210 Cb 0.02 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2qee h ASP 210 CO -0.03 0.36 -0.83 -0.50 -1.72 0.00 0.00 179.24 176.53 2qee h TRP 211 N 0.70 0.00 -0.34 4.55 4.06 -0.97 -1.41 115.95 122.53 2qee h TRP 211 Ca 0.30 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.25 2qee h TRP 211 Cb 0.19 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.33 2qee h TRP 211 CO -0.08 0.83 0.20 0.82 -3.56 0.00 0.00 178.44 176.65 2qee h ILE 212 N 0.00 1.13 -0.37 1.49 2.04 -0.36 -0.05 117.51 121.38 2qee h ILE 212 Ca -0.01 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.57 2qee h ILE 212 Cb 1.47 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 2qee h ILE 212 CO 0.11 0.13 0.19 -0.08 0.00 0.00 0.00 178.15 178.50 2qee h GLU 213 N 0.44 0.38 -0.18 2.37 4.81 -0.91 0.20 114.58 121.70 2qee h GLU 213 Ca 0.12 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 2qee h GLU 213 Cb 0.03 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 2qee h GLU 213 CO -0.02 0.25 -0.11 0.00 -0.73 0.00 0.00 179.01 178.40 2qee h ARG 214 N 0.39 0.39 0.00 1.92 3.08 -1.05 -3.35 114.38 115.76 2qee h ARG 214 Ca 0.15 -0.18 -0.18 0.00 0.07 0.00 0.00 59.98 59.84 2qee h ARG 214 Cb 0.05 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 2qee h ARG 214 CO -0.10 0.72 -1.50 -1.33 -1.07 0.00 0.00 179.97 176.69 2qee n MET 215 N -4.56 0.63 -3.65 0.04 2.81 -0.05 -5.01 117.12 107.32 2qee n MET 215 Ca -0.05 0.20 -0.26 0.00 -1.81 0.00 0.00 57.70 55.77 2qee n MET 215 Cb 0.34 -1.78 0.04 0.00 -0.71 0.00 0.00 33.22 31.10 2qee n MET 215 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2qee n ASP 216 N -2.86 -4.02 -4.79 7.83 2.03 0.69 -4.59 116.55 110.83 2qee n ASP 216 Ca -0.11 -0.93 -0.34 0.00 0.52 0.00 0.00 54.79 53.93 2qee n ASP 216 Cb 0.85 -3.75 -0.03 0.00 -0.72 0.00 0.00 41.12 37.47 2qee n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2qee s PRO 217 N -5.82 3.79 0.32 -0.67 0.04 -1.26 -4.58 135.00 126.82 2qee s PRO 217 Ca 0.32 1.41 0.17 0.00 0.04 0.00 0.00 61.00 62.94 2qee s PRO 217 Cb -0.10 -2.13 0.14 0.00 0.04 0.00 0.00 34.50 32.45 2qee s PRO 217 CO 0.84 -0.45 1.48 -0.39 0.04 0.00 0.00 177.00 178.52 2qee h VAL 218 N 1.59 0.61 -3.23 -0.36 -1.51 -1.38 -3.47 116.25 108.51 2qee h VAL 218 Ca -0.49 -1.86 -0.01 0.00 -1.23 0.00 0.00 66.70 63.11 2qee h VAL 218 Cb 1.22 2.29 -0.09 0.00 -2.13 0.00 0.00 31.29 32.59 2qee h VAL 218 CO 0.59 0.35 0.08 -0.72 -1.23 0.00 0.00 177.57 176.64 2qee s TYR 219 N -3.03 -0.16 -0.10 5.19 -0.85 -1.26 -4.28 117.35 112.86 2qee s TYR 219 Ca 0.05 -0.18 -0.03 0.00 -0.52 0.00 0.00 57.07 56.38 2qee s TYR 219 Cb 0.07 0.46 -0.04 0.00 0.38 0.00 0.00 41.96 42.83 2qee s TYR 219 CO 0.72 -0.97 0.05 -1.64 -1.52 0.00 0.00 175.55 172.19 2qee s MET 220 N -3.87 3.13 0.08 -3.49 -1.94 -0.64 -1.82 119.30 110.74 2qee s MET 220 Ca 0.09 -0.32 0.07 0.00 -1.71 0.00 0.00 55.69 53.82 2qee s MET 220 Cb -0.02 -2.92 -0.03 0.00 2.01 0.00 0.00 34.83 33.87 2qee s MET 220 CO -0.02 0.73 -0.18 0.00 -0.01 0.00 0.00 175.02 175.54 2qee s ALA 221 N -0.93 1.50 -0.07 3.03 0.00 -0.15 0.71 121.76 125.86 2qee s ALA 221 Ca 0.14 -1.10 -0.18 0.00 0.00 0.00 0.00 51.96 50.82 2qee s ALA 221 Cb -0.12 -0.19 0.04 0.00 0.00 0.00 0.00 23.12 22.85 2qee s ALA 221 CO 0.03 0.28 0.41 0.54 0.00 0.00 0.00 175.76 177.02 2qee s VAL 222 N -1.15 0.03 -0.07 0.00 0.11 -0.11 -0.74 120.40 118.47 2qee s VAL 222 Ca 0.03 -0.23 -0.04 0.00 -2.93 0.00 0.00 61.98 58.80 2qee s VAL 222 Cb -0.10 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 34.04 2qee s VAL 222 CO 0.03 -0.13 0.11 -0.44 -3.33 0.00 0.00 175.10 171.34 2qee s SER 223 N -0.77 6.04 0.05 3.54 0.01 -1.26 -1.05 113.70 120.27 2qee s SER 223 Ca -0.08 0.33 0.03 0.00 1.31 0.00 0.00 55.95 57.54 2qee s SER 223 Cb -0.04 -1.87 -0.03 0.00 0.21 0.00 0.00 66.02 64.30 2qee s SER 223 CO 0.04 0.35 -0.10 -0.76 0.41 0.00 0.00 173.24 173.18 2qee s LEU 224 N -1.30 2.26 0.77 2.44 1.43 0.68 -4.93 118.68 120.04 2qee s LEU 224 Ca 0.18 -0.57 -0.12 0.00 -1.03 0.00 0.00 54.13 52.59 2qee s LEU 224 Cb -0.12 -0.30 0.06 0.00 0.03 0.00 0.00 46.19 45.86 2qee s LEU 224 CO 0.08 -0.16 1.15 -2.16 0.23 0.00 0.00 176.35 175.49 2qee s PRO 225 N -1.64 2.29 0.56 1.29 0.04 -1.25 0.11 135.00 136.40 2qee s PRO 225 Ca -0.07 0.23 0.25 0.00 0.04 0.00 0.00 61.00 61.46 2qee s PRO 225 Cb -0.10 -1.98 1.53 0.00 0.04 0.00 0.00 34.50 33.99 2qee s PRO 225 CO 0.01 -1.39 2.10 -1.35 0.04 0.00 0.00 177.00 176.41 2qee h PRO 226 N -0.91 0.00 -0.25 0.56 0.11 -1.76 -0.78 132.00 128.97 2qee h PRO 226 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2qee h PRO 226 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2qee h PRO 226 CO 0.65 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.69 2qee n THR 227 N -4.09 0.34 -1.66 -1.15 -2.24 -1.26 -3.97 114.28 100.25 2qee n THR 227 Ca 0.02 -0.37 -0.56 0.00 -2.27 0.00 0.00 64.05 60.88 2qee n THR 227 Cb 0.32 0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 68.70 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 0.31 1.78 -4.11 4.78 7.35 -0.30 -4.97 117.46 122.29 2qee n PHE 228 Ca 0.12 0.61 -0.14 0.00 -0.76 0.00 0.00 57.45 57.28 2qee n PHE 228 Cb 0.26 -2.39 -0.11 0.00 0.35 0.00 0.00 39.48 37.59 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 2.19 1.15 -0.25 -2.13 1.04 -1.26 -4.70 113.70 109.75 2qee s SER 229 Ca 0.93 -0.65 -0.17 0.00 0.48 0.00 0.00 55.95 56.54 2qee s SER 229 Cb -1.04 0.02 0.07 0.00 0.10 0.00 0.00 66.02 65.17 2qee s SER 229 CO 0.58 -0.21 0.62 0.12 0.98 0.00 0.00 173.24 175.34 2qee s PHE 230 N -1.75 -0.87 0.87 5.02 2.19 -1.26 -4.44 117.98 117.73 2qee s PHE 230 Ca -0.04 1.86 -0.10 0.00 0.33 0.00 0.00 56.93 58.98 2qee s PHE 230 Cb -0.07 0.45 0.12 0.00 -1.31 0.00 0.00 43.02 42.20 2qee s PHE 230 CO 0.00 -0.44 1.13 -2.14 1.83 0.00 0.00 175.22 175.60 2qee s PRO 231 N 1.20 1.44 -0.21 10.12 0.02 -1.26 -4.13 135.00 142.18 2qee s PRO 231 Ca -0.07 1.40 -0.16 0.00 0.02 0.00 0.00 61.00 62.19 2qee s PRO 231 Cb -0.05 -1.79 0.06 0.00 0.02 0.00 0.00 34.50 32.74 2qee s PRO 231 CO -0.12 -2.29 0.54 -2.00 -0.33 0.00 0.00 177.00 172.80 2qee s GLU 232 N -4.74 0.60 -1.28 5.54 2.12 -1.26 -5.05 118.70 114.62 2qee s GLU 232 Ca 0.65 0.85 -0.15 0.00 0.36 0.00 0.00 54.97 56.68 2qee s GLU 232 Cb -0.21 0.21 0.12 0.00 0.26 0.00 0.00 34.13 34.51 2qee s GLU 232 CO 0.57 -0.11 1.71 0.39 -0.54 0.00 0.00 175.26 177.28 2qee n GLU 233 N 3.36 3.28 -4.15 4.30 -0.58 -1.26 -3.84 120.64 121.75 2qee n GLU 233 Ca -0.17 -3.44 -0.11 0.00 -0.42 0.00 0.00 57.16 53.02 2qee n GLU 233 Cb 0.56 -3.23 -0.10 0.00 -0.57 0.00 0.00 31.44 28.11 2qee n GLU 233 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2qee s SER 234 N 3.13 0.21 0.21 1.62 1.04 -1.26 -5.01 113.70 113.63 2qee s SER 234 Ca 0.47 -1.25 -0.09 0.00 0.48 0.00 0.00 55.95 55.56 2qee s SER 234 Cb 0.03 0.35 0.27 0.00 0.10 0.00 0.00 66.02 66.78 2qee s SER 234 CO 0.02 -0.80 1.75 0.78 0.98 0.00 0.00 173.24 175.97 2qee h ASN 235 N 2.72 0.28 -0.17 7.02 2.35 -1.92 -0.97 115.58 124.89 2qee h ASN 235 Ca -0.35 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.46 2qee h ASN 235 Cb 1.22 0.03 -0.01 0.00 0.05 0.00 0.00 38.32 39.62 2qee h ASN 235 CO 0.55 0.17 0.08 -0.09 -1.65 0.00 0.00 177.43 176.49 2qee h ARG 236 N 0.45 0.25 -0.78 0.81 2.43 -1.91 0.43 114.38 116.06 2qee h ARG 236 Ca 0.30 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.41 2qee h ARG 236 Cb 0.35 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.82 2qee h ARG 236 CO -0.28 0.29 0.38 0.78 -1.51 0.00 0.00 179.97 179.62 2qee h GLY 237 N 0.15 1.20 1.31 2.80 0.00 -1.61 -1.30 103.07 105.62 2qee h GLY 237 Ca 0.06 -0.59 -0.26 0.00 0.00 0.00 0.00 47.33 46.54 2qee h GLY 237 CO -0.01 0.56 -1.04 3.21 0.00 0.00 0.00 176.54 179.26 2qee h ARG 238 N 1.11 0.61 -0.51 4.80 3.08 -0.83 -1.78 114.38 120.85 2qee h ARG 238 Ca 0.27 -0.67 -0.02 0.00 0.07 0.00 0.00 59.98 59.62 2qee h ARG 238 Cb 0.11 0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 2qee h ARG 238 CO -0.03 1.27 0.23 0.82 -1.07 0.00 0.00 179.97 181.19 2qee h ILE 239 N 0.34 1.20 -0.18 2.04 2.04 -0.80 0.11 117.51 122.26 2qee h ILE 239 Ca -0.12 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.13 2qee h ILE 239 Cb 1.69 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 2qee h ILE 239 CO 0.20 0.23 0.05 0.40 0.00 0.00 0.00 178.15 179.03 2qee h ILE 240 N 0.69 1.20 -0.11 -0.67 2.04 -1.18 -0.79 117.51 118.68 2qee h ILE 240 Ca 0.18 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 2qee h ILE 240 Cb 0.14 1.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2qee h ILE 240 CO -0.02 0.19 0.01 -0.09 0.00 0.00 0.00 178.15 178.25 2qee h ARG 241 N 0.11 0.19 0.00 2.37 2.43 -1.22 -1.33 114.38 116.93 2qee h ARG 241 Ca 0.06 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 2qee h ARG 241 Cb 0.25 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2qee h ARG 241 CO -0.00 0.40 -1.21 -0.25 -1.51 0.00 0.00 179.97 177.40 2qee n ASP 242 N -4.83 0.85 0.05 -3.80 8.00 0.02 -4.49 116.55 112.35 2qee n ASP 242 Ca -0.06 0.35 0.00 0.00 0.71 0.00 0.00 54.79 55.79 2qee n ASP 242 Cb 0.18 0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 2qee n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qee h LEU 244 N 0.00 -0.27 -0.13 0.00 6.46 -1.17 -2.38 115.31 117.82 2qee h LEU 244 Ca 0.00 -0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 57.68 2qee h LEU 244 Cb 0.00 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 39.99 2qee h LEU 244 CO 0.00 -0.09 0.06 -0.07 -0.62 0.00 0.00 178.44 177.72 2qee h LEU 245 N -0.44 0.17 -0.59 2.25 3.38 -1.48 0.22 115.31 118.81 2qee h LEU 245 Ca -0.03 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 2qee h LEU 245 Cb 0.33 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2qee h LEU 245 CO 0.05 0.24 0.35 -0.65 0.09 0.00 0.00 178.44 178.53 2qee h PRO 246 N 0.08 0.81 -0.04 1.13 0.11 -1.78 -0.31 132.00 132.00 2qee h PRO 246 Ca 0.04 -0.08 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 2qee h PRO 246 Cb 0.12 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.06 2qee h PRO 246 CO -0.01 0.59 0.02 0.28 -0.21 0.00 0.00 178.00 178.67 2qee h VAL 247 N 0.80 1.12 -0.80 3.15 2.07 -1.27 -0.14 116.25 121.19 2qee h VAL 247 Ca 0.21 -0.36 0.16 0.00 0.82 0.00 0.00 66.70 67.53 2qee h VAL 247 Cb -0.01 1.30 -0.10 0.00 -1.52 0.00 0.00 31.29 30.95 2qee h VAL 247 CO -0.04 0.10 0.32 0.00 0.02 0.00 0.00 177.57 177.97 2qee h ALA 248 N 0.87 1.16 -0.18 1.67 0.00 -0.39 -1.84 119.26 120.55 2qee h ALA 248 Ca 0.01 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2qee h ALA 248 Cb 0.15 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2qee h ALA 248 CO -0.00 -0.25 -0.07 1.49 0.00 0.00 0.00 179.25 180.41 2qee h GLU 249 N 0.42 0.37 -0.65 0.00 4.81 -0.82 0.13 114.58 118.85 2qee h GLU 249 Ca 0.46 -0.15 0.04 0.00 -0.13 0.00 0.00 59.36 59.58 2qee h GLU 249 Cb 0.75 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.07 2qee h GLU 249 CO -0.45 0.66 0.38 -0.22 -0.73 0.00 0.00 179.01 178.65 2qee h LYS 250 N 0.06 0.70 -0.01 1.92 3.64 -0.63 -2.05 116.57 120.19 2qee h LYS 250 Ca 0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2qee h LYS 250 Cb 0.54 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2qee h LYS 250 CO 0.02 0.46 -0.14 0.72 -2.27 0.00 0.00 179.45 178.25 2qee n HIS 251 N -4.75 0.00 -3.82 1.91 8.25 -0.73 -4.96 115.22 111.12 2qee n HIS 251 Ca 0.07 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.30 2qee n HIS 251 Cb 0.13 -0.10 0.01 0.00 1.12 0.00 0.00 29.99 31.14 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 -0.57 -0.95 -4.46 0.41 4.05 0.23 -5.00 115.26 108.98 2qee n ASN 252 Ca 0.15 -0.92 -0.34 0.00 0.45 0.00 0.00 54.58 53.93 2qee n ASN 252 Cb 0.31 -3.55 -0.13 0.00 1.23 0.00 0.00 39.78 37.65 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 -3.80 3.71 0.81 -1.44 1.01 0.15 -4.91 121.20 116.72 2qee s ILE 253 Ca 0.02 -0.42 -0.11 0.00 0.00 0.00 0.00 60.65 60.15 2qee s ILE 253 Cb -0.01 -2.62 0.08 0.00 0.01 0.00 0.00 42.46 39.92 2qee s ILE 253 CO 0.85 0.49 1.10 -2.84 0.00 0.00 0.00 174.94 174.54 2qee s PRO 254 N 0.48 1.99 -0.26 2.79 0.02 -1.26 -4.59 135.00 134.16 2qee s PRO 254 Ca -0.04 1.15 -0.06 0.00 0.02 0.00 0.00 61.00 62.07 2qee s PRO 254 Cb -0.15 -1.87 -0.01 0.00 0.02 0.00 0.00 34.50 32.50 2qee s PRO 254 CO 0.03 -1.83 0.03 0.12 -0.33 0.00 0.00 177.00 175.02 2qee s PHE 255 N -2.88 3.06 -0.20 6.54 5.36 0.14 -1.62 117.98 128.37 2qee s PHE 255 Ca 0.62 -0.85 -0.17 0.00 -0.96 0.00 0.00 56.93 55.57 2qee s PHE 255 Cb -0.18 -2.19 -0.04 0.00 -0.34 0.00 0.00 43.02 40.28 2qee s PHE 255 CO 0.56 -0.52 0.44 0.00 -1.46 0.00 0.00 175.22 174.24 2qee s ALA 256 N 1.51 3.55 -0.14 11.12 0.00 0.22 -0.87 121.76 137.15 2qee s ALA 256 Ca 0.04 -0.49 0.02 0.00 0.00 0.00 0.00 51.96 51.54 2qee s ALA 256 Cb -0.16 -2.69 0.01 0.00 0.00 0.00 0.00 23.12 20.28 2qee s ALA 256 CO 0.00 -0.35 -0.22 -1.64 0.00 0.00 0.00 175.76 173.56 2qee s MET 257 N 1.42 3.03 -0.39 0.00 1.00 0.76 -0.93 119.30 124.18 2qee s MET 257 Ca 0.21 -0.85 -0.03 0.00 0.00 0.00 0.00 55.69 55.01 2qee s MET 257 Cb -0.15 -2.45 0.09 0.00 0.00 0.00 0.00 34.83 32.32 2qee s MET 257 CO 0.09 -0.03 0.16 -1.64 0.00 0.00 0.00 175.02 173.60 2qee s MET 258 N 0.85 2.15 -0.11 2.03 -1.94 -0.21 -2.11 119.30 119.96 2qee s MET 258 Ca -0.06 -1.66 -0.02 0.00 -1.71 0.00 0.00 55.69 52.24 2qee s MET 258 Cb -0.15 -3.51 -0.03 0.00 2.01 0.00 0.00 34.83 33.14 2qee s MET 258 CO -0.03 -0.96 -0.03 0.42 -0.01 0.00 0.00 175.02 174.41 2qee s ILE 259 N 1.19 3.97 0.00 2.53 1.01 -0.33 -0.23 121.20 129.34 2qee s ILE 259 Ca 0.05 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.34 2qee s ILE 259 Cb -0.22 -2.68 0.00 0.00 0.01 0.00 0.00 42.46 39.57 2qee s ILE 259 CO -0.03 0.56 0.00 0.61 0.00 0.00 0.00 174.94 176.08 2qee n GLY 260 N 2.70 0.43 3.69 6.18 0.00 0.12 -0.45 105.19 117.85 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 -1.39 5.05 -0.45 1.61 0.11 -0.87 -1.35 120.40 123.11 2qee s VAL 261 Ca 0.00 1.25 -0.14 0.00 -2.93 0.00 0.00 61.98 60.15 2qee s VAL 261 Cb 0.00 -3.96 0.06 0.00 -1.53 0.00 0.00 36.38 30.95 2qee s VAL 261 CO 0.00 0.18 0.36 -0.75 -3.33 0.00 0.00 175.10 171.56 2qee s LYS 262 N 1.39 2.93 0.32 1.54 2.20 0.09 -3.89 119.74 124.31 2qee s LYS 262 Ca 0.31 -1.31 -0.29 0.00 -0.36 0.00 0.00 55.97 54.32 2qee s LYS 262 Cb -0.16 -4.05 -0.10 0.00 -1.51 0.00 0.00 37.83 32.00 2qee s LYS 262 CO 0.13 -0.97 1.30 0.15 -0.36 0.00 0.00 175.35 175.60 2qee s LYS 263 N 1.62 4.37 -1.35 4.03 -0.14 -1.26 -0.37 119.74 126.62 2qee s LYS 263 Ca 0.04 2.19 -0.06 0.00 -1.36 0.00 0.00 55.97 56.78 2qee s LYS 263 Cb -0.23 -3.09 0.00 0.00 -1.68 0.00 0.00 37.83 32.83 2qee s LYS 263 CO 0.06 -0.18 0.47 0.54 -0.76 0.00 0.00 175.35 175.49 2qee n ARG 264 N 1.01 -2.63 0.27 1.68 5.12 -1.22 -4.87 116.66 116.02 2qee n ARG 264 Ca 0.01 0.38 0.16 0.00 -1.93 0.00 0.00 57.85 56.47 2qee n ARG 264 Cb 0.42 -4.29 0.59 0.00 -1.16 0.00 0.00 32.46 28.01 2qee n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 2qee h VAL 265 N -1.89 0.03 -2.64 1.55 -1.51 -0.87 -3.32 116.25 107.60 2qee h VAL 265 Ca -0.64 -0.63 -0.60 0.00 -1.23 0.00 0.00 66.70 63.60 2qee h VAL 265 Cb 1.38 1.61 -0.40 0.00 -2.13 0.00 0.00 31.29 31.75 2qee h VAL 265 CO 0.60 0.01 -0.82 -2.28 -1.23 0.00 0.00 177.57 173.85 2qee s HIS 266 N -3.59 2.03 0.33 5.19 5.65 -0.85 -5.02 115.29 119.04 2qee s HIS 266 Ca 0.02 -2.72 0.08 0.00 0.25 0.00 0.00 55.06 52.70 2qee s HIS 266 Cb 0.08 -1.60 0.79 0.00 -1.18 0.00 0.00 32.58 30.67 2qee s HIS 266 CO 0.57 -0.72 1.83 -1.35 -0.65 0.00 0.00 174.74 174.42 2qee h PRO 267 N 5.54 0.71 0.00 2.88 0.11 -1.84 -0.70 132.00 138.70 2qee h PRO 267 Ca 0.22 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2qee h PRO 267 Cb 0.85 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.80 2qee h PRO 267 CO 0.50 0.47 0.00 0.00 -0.21 0.00 0.00 178.00 178.76 2qee h ALA 268 N 1.60 1.00 -0.00 -0.75 0.00 -1.95 -0.79 119.26 118.38 2qee h ALA 268 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.42 2qee h ALA 268 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2qee h ALA 268 CO -0.27 0.00 -0.04 1.28 0.00 0.00 0.00 179.25 180.22 2qee n LEU 269 N -2.80 0.31 0.00 0.00 4.77 -0.27 -4.99 117.00 114.02 2qee n LEU 269 Ca -0.00 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2qee n LEU 269 Cb 0.21 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2qee n LEU 269 CO 0.22 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 2qee n GLY 270 N 1.18 3.61 0.34 -0.72 0.00 -0.30 -1.64 105.19 107.64 2qee n GLY 270 Ca 0.18 -0.02 0.17 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.02 1.61 3.32 -1.94 0.16 116.42 119.55 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 -2.32 2.62 -0.52 3.45 0.00 -0.66 -4.20 120.51 118.89 2qee n ALA 272 Ca 0.01 -0.21 0.10 0.00 0.00 0.00 0.00 53.44 53.35 2qee n ALA 272 Cb 0.32 -1.32 0.35 0.00 0.00 0.00 0.00 19.45 18.80 2qee n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qee n GLY 273 N 0.91 2.62 3.86 0.00 0.00 0.56 -4.84 105.19 108.31 2qee n GLY 273 Ca 0.17 -0.84 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 2qee n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qee s ASP 274 N -0.93 6.61 0.00 1.61 1.01 -1.26 -0.35 116.67 123.36 2qee s ASP 274 Ca 0.51 0.72 0.00 0.00 0.71 0.00 0.00 52.55 54.49 2qee s ASP 274 Cb 0.31 -2.16 0.00 0.00 1.01 0.00 0.00 42.92 42.08 2qee s ASP 274 CO 0.28 0.29 0.00 0.33 0.21 0.00 0.00 175.17 176.29 2qee n PHE 275 N 1.49 -0.07 -4.05 4.23 7.35 0.50 -4.93 117.46 121.98 2qee n PHE 275 Ca -0.13 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.45 2qee n PHE 275 Cb 0.53 0.00 -0.11 0.00 0.35 0.00 0.00 39.48 40.25 2qee n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2qee s VAL 276 N -0.24 0.38 0.09 -2.13 0.11 -1.26 -0.73 120.40 116.61 2qee s VAL 276 Ca 0.00 -1.19 -0.12 0.00 -2.93 0.00 0.00 61.98 57.74 2qee s VAL 276 Cb 0.00 -0.70 0.01 0.00 -1.53 0.00 0.00 36.38 34.17 2qee s VAL 276 CO 0.00 -0.54 0.28 -0.83 -3.33 0.00 0.00 175.10 170.68 2qee s GLY 277 N -1.83 -0.07 0.22 6.54 0.00 -0.46 -4.82 107.32 106.90 2qee s GLY 277 Ca -0.08 -0.30 -0.30 0.00 0.00 0.00 0.00 44.72 44.04 2qee s GLY 277 CO -0.02 -0.52 1.36 1.25 0.00 0.00 0.00 173.10 175.17 2qee s LYS 278 N -3.56 4.34 0.16 2.90 2.20 -1.26 -4.44 119.74 120.08 2qee s LYS 278 Ca 0.02 2.15 0.04 0.00 -0.36 0.00 0.00 55.97 57.82 2qee s LYS 278 Cb 0.03 -3.16 -0.04 0.00 -1.51 0.00 0.00 37.83 33.15 2qee s LYS 278 CO -0.10 -0.32 0.25 0.00 -0.36 0.00 0.00 175.35 174.82 2qee s ALA 279 N 0.08 3.84 0.39 3.13 0.00 -1.26 -4.76 121.76 123.19 2qee s ALA 279 Ca 0.58 -1.11 -0.27 0.00 0.00 0.00 0.00 51.96 51.16 2qee s ALA 279 Cb -0.39 -1.64 -0.09 0.00 0.00 0.00 0.00 23.12 21.00 2qee s ALA 279 CO 0.40 0.49 1.33 0.45 0.00 0.00 0.00 175.76 178.43 2qee s SER 280 N -3.28 6.37 0.00 0.00 0.15 -1.25 -4.95 113.70 110.73 2qee s SER 280 Ca 0.33 2.72 0.28 0.00 0.70 0.00 0.00 55.95 59.99 2qee s SER 280 Cb -0.10 -2.64 1.10 0.00 -1.71 0.00 0.00 66.02 62.67 2qee s SER 280 CO 0.27 -0.82 1.83 0.23 1.20 0.00 0.00 173.24 175.95 2qee n MET 281 N 0.27 0.03 -0.34 5.44 2.81 -1.26 -4.40 117.12 119.66 2qee n MET 281 Ca 0.03 -0.01 -0.00 0.00 -1.81 0.00 0.00 57.70 55.91 2qee n MET 281 Cb 0.43 -1.50 0.13 0.00 -0.71 0.00 0.00 33.22 31.57 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 0.01 0.99 -0.24 7.83 3.32 -1.93 0.43 116.42 126.83 2qee h ASP 282 Ca 0.00 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 2qee h ASP 282 Cb 0.49 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2qee h ASP 282 CO 0.00 0.67 -0.02 1.23 -1.72 0.00 0.00 179.24 179.39 2qee h GLY 283 N 1.15 0.48 0.94 2.75 0.00 -1.77 0.11 103.07 106.72 2qee h GLY 283 Ca 0.38 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 2qee h GLY 283 CO -0.13 0.34 0.15 -2.08 0.00 0.00 0.00 176.54 174.81 2qee h VAL 284 N 0.20 1.19 -0.39 4.60 2.07 -1.72 -1.29 116.25 120.91 2qee h VAL 284 Ca 0.07 -0.60 0.07 0.00 0.82 0.00 0.00 66.70 67.05 2qee h VAL 284 Cb 0.46 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 2qee h VAL 284 CO 0.02 0.21 0.04 -0.08 0.02 0.00 0.00 177.57 177.78 2qee h GLU 285 N 0.46 0.15 -0.12 1.57 4.81 -0.78 -0.99 114.58 119.68 2qee h GLU 285 Ca 0.12 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 2qee h GLU 285 Cb 0.19 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2qee h GLU 285 CO -0.01 0.10 -0.03 1.25 -0.73 0.00 0.00 179.01 179.59 2qee h HIS 286 N 0.16 -0.07 -0.36 0.92 2.76 -0.69 -1.65 115.15 116.22 2qee h HIS 286 Ca 0.19 0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.43 2qee h HIS 286 Cb 0.25 0.05 -0.05 0.00 1.55 0.00 0.00 27.41 29.20 2qee h HIS 286 CO -0.23 -0.06 0.04 -0.07 -1.30 0.00 0.00 177.93 176.32 2qee h LEU 287 N -0.00 -0.05 -0.36 0.26 3.38 -0.96 0.07 115.31 117.64 2qee h LEU 287 Ca 0.06 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2qee h LEU 287 Cb 0.09 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2qee h LEU 287 CO -0.13 0.01 0.16 -0.07 0.09 0.00 0.00 178.44 178.51 2qee h LEU 288 N 0.16 0.48 -0.13 1.67 3.38 -1.03 -1.21 115.31 118.63 2qee h LEU 288 Ca 0.17 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 2qee h LEU 288 Cb 0.22 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2qee h LEU 288 CO -0.25 0.49 -0.29 -0.09 0.09 0.00 0.00 178.44 178.38 2qee h ARG 289 N 0.44 0.43 0.00 1.13 2.43 -1.05 -3.33 114.38 114.43 2qee h ARG 289 Ca 0.12 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 2qee h ARG 289 Cb 0.14 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2qee h ARG 289 CO -0.01 0.90 -0.54 0.93 -1.51 0.00 0.00 179.97 179.73 2qee h GLU 290 N 0.03 0.00 -2.27 0.20 4.39 -0.99 -3.36 114.58 112.59 2qee h GLU 290 Ca 0.00 0.00 -0.61 0.00 0.34 0.00 0.00 59.36 59.09 2qee h GLU 290 Cb 0.89 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 29.13 2qee h GLU 290 CO 0.06 0.00 -0.52 0.66 -1.16 0.00 0.00 179.01 178.06 2qee n TYR 291 N -2.36 3.84 0.30 4.33 4.01 -0.46 -4.92 117.16 121.90 2qee n TYR 291 Ca 0.03 -3.96 0.19 0.00 -0.16 0.00 0.00 57.90 54.01 2qee n TYR 291 Cb 0.47 -0.56 0.89 0.00 -0.31 0.00 0.00 39.34 39.82 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 3.48 0.00 -0.17 -0.72 0.13 -1.72 -0.25 132.00 132.75 2qee h PRO 292 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2qee h PRO 292 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 2qee h PRO 292 CO 0.85 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.72 2qee n ASN 293 N -3.10 1.97 -4.76 1.44 5.03 -1.26 -4.88 115.26 109.71 2qee n ASN 293 Ca -0.01 -1.74 -0.31 0.00 0.87 0.00 0.00 54.58 53.40 2qee n ASN 293 Cb 0.22 -0.11 -0.07 0.00 -1.02 0.00 0.00 39.78 38.80 2qee n ASN 293 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 2qee s ASN 294 N -1.64 5.47 -0.09 6.41 -0.87 -0.11 -4.80 114.94 119.32 2qee s ASN 294 Ca 0.34 -0.00 -0.01 0.00 -1.57 0.00 0.00 52.86 51.62 2qee s ASN 294 Cb 0.19 -1.47 -0.03 0.00 -0.02 0.00 0.00 41.25 39.92 2qee s ASN 294 CO 0.28 0.20 -0.04 -0.54 -2.57 0.00 0.00 177.10 174.43 2qee s LYS 295 N -2.21 2.95 -0.06 -0.60 1.02 -1.26 -4.86 119.74 114.71 2qee s LYS 295 Ca 0.27 -0.50 0.03 0.00 0.02 0.00 0.00 55.97 55.79 2qee s LYS 295 Cb -0.12 -2.70 0.01 0.00 -0.52 0.00 0.00 37.83 34.50 2qee s LYS 295 CO 0.19 0.62 -0.14 -0.06 -0.92 0.00 0.00 175.35 175.04 2qee s PHE 296 N -0.68 1.61 -0.20 3.18 0.08 -0.10 -0.69 117.98 121.19 2qee s PHE 296 Ca 0.10 -0.58 -0.07 0.00 0.12 0.00 0.00 56.93 56.50 2qee s PHE 296 Cb -0.12 -1.14 -0.04 0.00 -0.57 0.00 0.00 43.02 41.15 2qee s PHE 296 CO 0.02 -0.27 0.06 -0.51 -0.10 0.00 0.00 175.22 174.41 2qee s LEU 297 N 0.52 3.65 -0.01 -0.37 1.43 -0.05 -0.63 118.68 123.21 2qee s LEU 297 Ca -0.13 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 52.95 2qee s LEU 297 Cb -0.15 -1.94 0.00 0.00 0.03 0.00 0.00 46.19 44.13 2qee s LEU 297 CO 0.04 0.11 -0.05 -0.69 0.23 0.00 0.00 176.35 175.99 2qee s VAL 298 N 0.76 0.44 0.03 -1.59 1.01 -0.59 -0.17 120.40 120.29 2qee s VAL 298 Ca 0.03 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2qee s VAL 298 Cb -0.14 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.83 2qee s VAL 298 CO 0.02 0.14 -0.08 0.28 0.00 0.00 0.00 175.10 175.46 2qee s THR 299 N 0.11 0.60 0.09 3.92 -1.32 -0.90 -2.23 115.64 115.91 2qee s THR 299 Ca -0.01 -0.78 0.06 0.00 -1.21 0.00 0.00 61.69 59.75 2qee s THR 299 Cb -0.05 -0.59 -0.03 0.00 -1.51 0.00 0.00 72.50 70.31 2qee s THR 299 CO -0.00 -0.15 -0.16 -0.04 -2.21 0.00 0.00 174.62 172.06 2qee s MET 300 N -1.02 0.95 -0.01 7.08 -1.94 -1.26 -1.19 119.30 121.91 2qee s MET 300 Ca -0.04 -1.06 0.13 0.00 -1.71 0.00 0.00 55.69 53.01 2qee s MET 300 Cb -0.07 -1.03 -0.21 0.00 2.01 0.00 0.00 34.83 35.54 2qee s MET 300 CO 0.00 0.23 0.72 1.25 -0.01 0.00 0.00 175.02 177.21 2qee h LEU 301 N 4.12 0.00 -9.69 -0.03 5.85 -1.08 -3.42 115.31 111.06 2qee h LEU 301 Ca -0.43 0.00 -0.53 0.00 0.84 0.00 0.00 57.88 57.77 2qee h LEU 301 Cb 1.19 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 2qee h LEU 301 CO 0.41 0.90 0.18 -0.55 -0.34 0.00 0.00 178.44 179.04 2qee s SER 302 N -6.03 7.37 0.30 1.25 0.15 -1.26 -4.53 113.70 110.95 2qee s SER 302 Ca -0.04 1.62 0.01 0.00 0.70 0.00 0.00 55.95 58.25 2qee s SER 302 Cb 0.08 -2.50 0.56 0.00 -1.71 0.00 0.00 66.02 62.45 2qee s SER 302 CO 0.82 0.17 1.89 -0.09 1.20 0.00 0.00 173.24 177.24 2qee h ARG 303 N 4.57 0.97 0.00 5.44 2.43 -1.95 -2.02 114.38 123.82 2qee h ARG 303 Ca -0.46 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 2qee h ARG 303 Cb 1.21 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2qee h ARG 303 CO 0.67 0.64 0.00 0.39 -1.51 0.00 0.00 179.97 180.16 2qee n GLU 304 N -4.52 0.40 0.00 0.20 4.71 -1.26 -2.34 120.64 117.84 2qee n GLU 304 Ca 0.15 0.06 0.10 0.00 -0.01 0.00 0.00 57.16 57.46 2qee n GLU 304 Cb 0.25 -1.50 -0.05 0.00 -1.01 0.00 0.00 31.44 29.12 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 -1.23 1.13 -0.06 1.62 5.03 -0.76 -4.69 115.26 116.30 2qee n ASN 305 Ca 0.12 -1.02 -0.13 0.00 0.87 0.00 0.00 54.58 54.42 2qee n ASN 305 Cb 0.16 0.82 -0.06 0.00 -1.02 0.00 0.00 39.78 39.68 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 0.44 0.42 -0.36 3.52 1.08 -1.53 -1.06 115.11 117.61 2qee h GLN 306 Ca 0.00 -0.21 -0.01 0.00 -1.45 0.00 0.00 58.65 56.97 2qee h GLN 306 Cb 0.54 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.96 2qee h GLN 306 CO 0.00 0.77 0.17 1.25 -0.95 0.00 0.00 178.83 180.07 2qee h HIS 307 N 0.08 0.53 0.00 2.96 2.76 -1.84 -1.83 115.15 117.81 2qee h HIS 307 Ca 0.03 -0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.07 2qee h HIS 307 Cb 0.68 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.47 2qee h HIS 307 CO 0.08 0.45 -0.48 1.05 -1.30 0.00 0.00 177.93 177.73 2qee h GLU 308 N 0.45 0.00 -0.71 5.26 4.11 -1.84 -1.62 114.58 120.23 2qee h GLU 308 Ca 0.12 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.57 2qee h GLU 308 Cb 0.13 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 2qee h GLU 308 CO -0.01 0.48 0.46 1.25 0.07 0.00 0.00 179.01 181.26 2qee h LEU 309 N 0.00 0.79 -0.30 3.06 5.85 -0.97 0.59 115.31 124.34 2qee h LEU 309 Ca -0.00 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 2qee h LEU 309 Cb 1.00 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 2qee h LEU 309 CO 0.06 0.57 0.17 0.58 -0.34 0.00 0.00 178.44 179.48 2qee h VAL 310 N 0.94 1.12 -0.47 1.05 2.07 -0.68 -1.56 116.25 118.72 2qee h VAL 310 Ca 0.27 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 2qee h VAL 310 Cb -0.08 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 2qee h VAL 310 CO -0.07 0.12 0.15 0.58 0.02 0.00 0.00 177.57 178.37 2qee h VAL 311 N 0.37 1.19 -0.33 2.57 2.07 -0.98 -2.06 116.25 119.08 2qee h VAL 311 Ca 0.11 -0.64 -0.09 0.00 0.82 0.00 0.00 66.70 66.90 2qee h VAL 311 Cb 0.04 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2qee h VAL 311 CO -0.02 0.24 -0.17 0.25 0.02 0.00 0.00 177.57 177.89 2qee h LEU 312 N 0.68 0.60 -1.28 2.57 5.85 -0.20 -1.56 115.31 121.97 2qee h LEU 312 Ca 0.16 -0.19 0.04 0.00 0.84 0.00 0.00 57.88 58.73 2qee h LEU 312 Cb 0.19 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2qee h LEU 312 CO -0.01 0.79 0.50 0.00 -0.34 0.00 0.00 178.44 179.38 2qee h ALA 313 N 1.27 1.55 -0.04 1.25 0.00 -0.65 -0.24 119.26 122.40 2qee h ALA 313 Ca 0.09 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2qee h ALA 313 Cb 0.61 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2qee h ALA 313 CO 0.04 0.37 0.03 0.00 0.00 0.00 0.00 179.25 179.69 2qee h ARG 314 N 0.93 0.00 0.03 0.00 3.08 -0.67 -2.97 114.38 114.77 2qee h ARG 314 Ca 0.31 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 60.08 2qee h ARG 314 Cb 0.06 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 2qee h ARG 314 CO -0.09 0.00 -1.53 0.87 -1.07 0.00 0.00 179.97 178.15 2qee h LYS 315 N 0.00 0.07 -4.07 0.04 1.79 -0.88 -3.46 116.57 110.07 2qee h LYS 315 Ca 0.02 -0.12 -0.55 0.00 -2.18 0.00 0.00 60.65 57.82 2qee h LYS 315 Cb 0.08 0.04 -0.38 0.00 -1.58 0.00 0.00 32.23 30.40 2qee h LYS 315 CO -0.00 0.79 -0.78 -0.06 -1.08 0.00 0.00 179.45 178.31 2qee s PHE 316 N -2.63 1.66 -0.27 -1.35 0.08 -0.85 -5.00 117.98 109.63 2qee s PHE 316 Ca -0.05 -1.12 0.28 0.00 0.12 0.00 0.00 56.93 56.15 2qee s PHE 316 Cb 0.08 -1.29 0.93 0.00 -0.57 0.00 0.00 43.02 42.18 2qee s PHE 316 CO 0.83 -0.63 1.80 0.66 -0.10 0.00 0.00 175.22 177.78 2qee h SER 317 N 8.12 0.00 -0.06 1.36 4.64 -1.90 -1.93 113.55 123.78 2qee h SER 317 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 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 0.39 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.89 2qee n ASN 318 N -2.82 0.42 -4.53 4.97 6.94 -1.26 -4.73 115.26 114.25 2qee n ASN 318 Ca 0.03 -1.75 -0.35 0.00 -0.02 0.00 0.00 54.58 52.48 2qee n ASN 318 Cb 0.37 -0.04 -0.11 0.00 -2.36 0.00 0.00 39.78 37.64 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 -1.28 3.58 -0.20 -4.53 2.96 -0.73 -0.92 118.68 117.55 2qee s LEU 319 Ca 0.17 -0.07 -0.00 0.00 -0.22 0.00 0.00 54.13 54.00 2qee s LEU 319 Cb 0.08 -1.92 0.02 0.00 0.50 0.00 0.00 46.19 44.87 2qee s LEU 319 CO 0.13 0.08 -0.14 -0.32 -1.32 0.00 0.00 176.35 174.78 2qee s MET 320 N 0.91 3.02 0.12 1.98 -2.45 0.19 -4.94 119.30 118.14 2qee s MET 320 Ca 0.03 -0.83 -0.08 0.00 -1.25 0.00 0.00 55.69 53.56 2qee s MET 320 Cb -0.14 -2.74 -0.06 0.00 1.25 0.00 0.00 34.83 33.14 2qee s MET 320 CO 0.03 -0.25 0.41 0.96 1.05 0.00 0.00 175.02 177.22 2qee s ILE 321 N 1.33 5.10 -0.01 10.11 -4.36 -1.26 -1.54 121.20 130.57 2qee s ILE 321 Ca 0.04 0.33 -0.01 0.00 -0.26 0.00 0.00 60.65 60.75 2qee s ILE 321 Cb -0.14 -3.64 0.00 0.00 1.25 0.00 0.00 42.46 39.94 2qee s ILE 321 CO -0.09 0.17 0.03 0.72 0.24 0.00 0.00 174.94 176.00 2qee s PHE 322 N -1.53 -0.03 0.02 1.37 -0.12 -0.95 -2.05 117.98 114.70 2qee s PHE 322 Ca 0.37 0.07 0.00 0.00 -0.05 0.00 0.00 56.93 57.32 2qee s PHE 322 Cb -0.13 0.00 0.00 0.00 -0.63 0.00 0.00 43.02 42.26 2qee s PHE 322 CO 0.20 -0.02 0.00 0.41 -0.05 0.00 0.00 175.22 175.77 2qee n GLY 323 N 3.11 -2.44 2.98 1.99 0.00 0.17 -4.41 105.19 106.59 2qee n GLY 323 Ca -0.13 -1.45 -0.31 0.00 0.00 0.00 0.00 46.02 44.14 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 0.62 3.53 0.00 0.00 -0.00 -1.26 -3.69 118.94 118.13 2qee s TRP 325 Ca 0.13 1.47 0.00 0.00 -0.00 0.00 0.00 56.10 57.70 2qee s TRP 325 Cb -0.21 -3.07 0.00 0.00 -0.00 0.00 0.00 33.47 30.19 2qee s TRP 325 CO -0.07 -0.14 0.00 1.87 -0.00 0.00 0.00 176.95 178.61 2qee n TRP 326 N 4.68 0.00 0.50 5.86 -0.00 -1.26 -0.06 117.44 127.16 2qee n TRP 326 Ca 0.06 0.00 0.07 0.00 -0.00 0.00 0.00 57.50 57.63 2qee n TRP 326 Cb 0.50 0.00 0.32 0.00 -0.00 0.00 0.00 31.31 32.13 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 0.05 1.10 5.87 3.72 -1.26 -0.57 117.46 126.37 2qee n PHE 327 Ca 0.00 0.02 0.13 0.00 -0.05 0.00 0.00 57.45 57.54 2qee n PHE 327 Cb 0.00 -0.53 0.33 0.00 -0.94 0.00 0.00 39.48 38.34 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 -1.54 0.31 -2.09 -1.08 2.81 0.92 -4.59 117.12 111.85 2qee n MET 328 Ca 0.03 -0.17 -0.38 0.00 -1.81 0.00 0.00 57.70 55.38 2qee n MET 328 Cb 0.18 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.19 2qee n MET 328 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2qee n ASN 329 N -1.20 7.40 -3.99 7.83 5.15 0.27 -3.71 115.26 127.01 2qee n ASN 329 Ca 0.08 -3.51 -0.18 0.00 -0.60 0.00 0.00 54.58 50.38 2qee n ASN 329 Cb 0.34 -1.20 -0.15 0.00 -0.53 0.00 0.00 39.78 38.23 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 -0.55 0.94 0.29 1.20 0.01 -1.26 -4.95 114.94 110.61 2qee s ASN 330 Ca 0.50 -0.14 0.00 0.00 -0.71 0.00 0.00 52.86 52.51 2qee s ASN 330 Cb 0.29 -0.15 0.69 0.00 0.41 0.00 0.00 41.25 42.49 2qee s ASN 330 CO -0.21 0.08 1.61 -0.65 -1.51 0.00 0.00 177.10 176.42 2qee h PRO 331 N 6.09 0.09 -0.79 -0.60 0.11 -1.97 0.12 132.00 135.05 2qee h PRO 331 Ca -0.31 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.81 2qee h PRO 331 Cb 1.18 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 2qee h PRO 331 CO 0.50 0.06 0.53 1.49 -0.21 0.00 0.00 178.00 180.36 2qee h GLU 332 N 0.09 1.03 0.11 1.05 4.57 -1.97 -0.96 114.58 118.49 2qee h GLU 332 Ca 0.55 -0.06 -0.19 0.00 -1.18 0.00 0.00 59.36 58.48 2qee h GLU 332 Cb 1.11 -0.23 0.01 0.00 -0.16 0.00 0.00 28.75 29.48 2qee h GLU 332 CO -0.77 0.68 -0.90 0.82 -1.18 0.00 0.00 179.01 177.65 2qee h ILE 333 N 1.06 1.38 -0.90 2.32 1.08 -1.28 -2.87 117.51 118.30 2qee h ILE 333 Ca 0.30 -2.46 0.16 0.00 -0.39 0.00 0.00 64.86 62.47 2qee h ILE 333 Cb -0.09 3.04 -0.10 0.00 -3.07 0.00 0.00 36.82 36.60 2qee h ILE 333 CO -0.07 0.68 0.49 0.40 -0.69 0.00 0.00 178.15 178.96 2qee h ILE 334 N -0.46 0.72 0.08 -0.67 2.04 -0.70 0.42 117.51 118.94 2qee h ILE 334 Ca -0.18 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 2qee h ILE 334 Cb 1.58 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 2qee h ILE 334 CO 0.09 0.12 -0.04 -1.13 0.00 0.00 0.00 178.15 177.19 2qee h ASN 335 N 0.67 -0.09 -0.59 1.72 -1.24 -1.25 0.58 115.58 115.39 2qee h ASN 335 Ca 0.50 -0.23 -0.09 0.00 0.71 0.00 0.00 56.30 57.19 2qee h ASN 335 Cb 0.74 0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.79 2qee h ASN 335 CO -0.37 0.18 0.02 1.05 -1.29 0.00 0.00 177.43 177.02 2qee h GLU 336 N -0.37 1.02 -0.45 6.67 4.11 -1.22 -1.76 114.58 122.57 2qee h GLU 336 Ca -0.01 -0.31 -0.01 0.00 0.07 0.00 0.00 59.36 59.09 2qee h GLU 336 Cb 0.31 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2qee h GLU 336 CO 0.02 1.00 0.23 0.52 0.07 0.00 0.00 179.01 180.85 2qee h MET 337 N 0.91 0.64 -0.45 1.06 2.86 -0.85 -0.78 114.93 118.33 2qee h MET 337 Ca 0.17 -0.09 -0.08 0.00 -2.06 0.00 0.00 59.70 57.65 2qee h MET 337 Cb 0.52 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 2qee h MET 337 CO 0.03 0.53 -0.04 1.15 1.06 0.00 0.00 176.91 179.64 2qee h THR 338 N 0.59 1.24 -0.18 2.22 2.02 -0.72 -1.21 112.91 116.87 2qee h THR 338 Ca 0.16 -1.04 -0.05 0.00 0.77 0.00 0.00 66.41 66.26 2qee h THR 338 Cb 0.09 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 2qee h THR 338 CO -0.02 0.36 -0.07 0.03 0.37 0.00 0.00 175.52 176.19 2qee h ARG 339 N 0.70 0.37 -0.75 6.66 3.08 -1.16 -0.86 114.38 122.41 2qee h ARG 339 Ca 0.13 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2qee h ARG 339 Cb 0.48 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.48 2qee h ARG 339 CO 0.02 0.65 0.46 0.52 -1.07 0.00 0.00 179.97 180.55 2qee h MET 340 N 0.06 1.02 -0.20 0.04 2.86 -0.93 -0.41 114.93 117.37 2qee h MET 340 Ca 0.04 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2qee h MET 340 Cb 0.53 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2qee h MET 340 CO 0.02 0.71 0.10 0.00 1.06 0.00 0.00 176.91 178.80 2qee h ARG 341 N 1.03 0.29 -0.27 1.72 3.08 -1.16 -2.17 114.38 116.90 2qee h ARG 341 Ca 0.27 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 60.12 2qee h ARG 341 Cb -0.05 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 29.95 2qee h ARG 341 CO -0.05 0.32 -0.44 1.98 -1.07 0.00 0.00 179.97 180.71 2qee h MET 342 N 0.20 0.77 -1.01 0.04 4.05 -0.93 0.38 114.93 118.44 2qee h MET 342 Ca 0.07 -0.47 0.13 0.00 -0.28 0.00 0.00 59.70 59.15 2qee h MET 342 Cb 0.12 0.05 -0.09 0.00 -0.80 0.00 0.00 31.60 30.88 2qee h MET 342 CO -0.01 1.10 0.63 0.93 0.23 0.00 0.00 176.91 179.79 2qee h GLU 343 N 0.52 0.92 0.00 0.39 5.08 -0.98 -0.42 114.58 120.10 2qee h GLU 343 Ca 0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2qee h GLU 343 Cb 1.04 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2qee h GLU 343 CO 0.10 0.61 -1.94 -1.33 -1.00 0.00 0.00 179.01 175.45 2qee n MET 344 N -4.65 0.62 0.00 2.33 2.81 -0.82 -4.59 117.12 112.82 2qee n MET 344 Ca 0.20 -0.19 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 2qee n MET 344 Cb 0.40 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.39 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 -2.22 0.75 0.00 4.03 4.77 0.13 -4.88 117.00 119.59 2qee n LEU 345 Ca -0.04 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 55.14 2qee n LEU 345 Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 2qee n LEU 345 CO 0.46 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 2qee n GLY 346 N 0.09 4.19 0.90 -0.72 0.00 -0.17 -1.19 105.19 108.30 2qee n GLY 346 Ca 0.00 0.09 0.07 0.00 0.00 0.00 0.00 46.02 46.19 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 1.72 -1.23 2.61 -2.24 -1.26 -4.38 114.28 109.50 2qee n THR 347 Ca 0.00 -1.43 -0.19 0.00 -2.27 0.00 0.00 64.05 60.16 2qee n THR 347 Cb 0.00 0.10 -0.10 0.00 -2.10 0.00 0.00 70.33 68.23 2qee n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qee n SER 348 N 0.14 5.90 -3.43 3.42 3.41 -0.33 -4.72 113.62 118.00 2qee n SER 348 Ca 0.18 -2.86 -0.11 0.00 -0.26 0.00 0.00 58.87 55.82 2qee n SER 348 Cb 0.71 -1.31 -0.02 0.00 -0.26 0.00 0.00 64.21 63.33 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 -0.48 0.48 -0.36 7.33 -0.12 -1.26 -4.82 117.98 118.75 2qee s PHE 349 Ca 0.60 -0.89 -0.03 0.00 -0.05 0.00 0.00 56.93 56.56 2qee s PHE 349 Cb 0.34 0.33 0.08 0.00 -0.63 0.00 0.00 43.02 43.14 2qee s PHE 349 CO -0.11 -1.23 0.12 0.42 -0.05 0.00 0.00 175.22 174.37 2qee s ILE 350 N -3.20 3.22 0.43 -4.49 1.01 -0.87 -4.71 121.20 112.58 2qee s ILE 350 Ca 0.22 -1.71 0.12 0.00 0.00 0.00 0.00 60.65 59.28 2qee s ILE 350 Cb -0.02 -3.04 0.19 0.00 0.01 0.00 0.00 42.46 39.60 2qee s ILE 350 CO 0.13 -0.42 1.99 1.55 0.00 0.00 0.00 174.94 178.19 2qee h PRO 351 N 8.04 0.12 -3.34 2.79 0.13 -1.86 0.50 132.00 138.38 2qee h PRO 351 Ca -0.17 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.88 2qee h PRO 351 Cb 1.06 -0.02 -0.13 0.00 0.13 0.00 0.00 31.00 32.03 2qee h PRO 351 CO 0.62 0.24 -0.07 -1.14 -0.23 0.00 0.00 178.00 177.42 2qee s GLN 352 N -4.79 1.05 0.08 0.86 2.00 -1.26 -3.41 119.66 114.19 2qee s GLN 352 Ca -0.05 -0.66 -0.07 0.00 -2.00 0.00 0.00 55.36 52.58 2qee s GLN 352 Cb 0.16 0.46 -0.01 0.00 0.80 0.00 0.00 33.01 34.42 2qee s GLN 352 CO 0.71 -0.41 0.14 -3.38 -0.50 0.00 0.00 175.29 171.85 2qee s HIS 353 N -3.64 0.23 -0.09 1.67 -3.43 -1.26 -4.64 115.29 104.13 2qee s HIS 353 Ca 0.02 -0.68 0.06 0.00 -0.80 0.00 0.00 55.06 53.66 2qee s HIS 353 Cb 0.02 -0.14 -0.24 0.00 -1.43 0.00 0.00 32.58 30.79 2qee s HIS 353 CO -0.11 -0.50 0.49 -1.13 -2.00 0.00 0.00 174.74 171.50 2qee n SER 354 N 0.02 1.25 -2.26 7.38 3.41 -1.25 -4.73 113.62 117.44 2qee n SER 354 Ca -0.15 0.30 -0.20 0.00 -0.26 0.00 0.00 58.87 58.56 2qee n SER 354 Cb 0.62 -0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 64.29 2qee n SER 354 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qee n ASP 355 N -3.17 -5.66 -4.74 4.04 -0.08 -0.47 -4.88 116.55 101.59 2qee n ASP 355 Ca -0.24 0.09 -0.42 0.00 -1.51 0.00 0.00 54.79 52.71 2qee n ASP 355 Cb 1.06 -4.77 -0.02 0.00 2.34 0.00 0.00 41.12 39.73 2qee n ASP 355 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qee s ALA 356 N -2.95 3.79 -0.06 -1.67 0.00 -1.26 -4.37 121.76 115.24 2qee s ALA 356 Ca 0.00 1.51 0.19 0.00 0.00 0.00 0.00 51.96 53.67 2qee s ALA 356 Cb 0.00 -3.65 -0.29 0.00 0.00 0.00 0.00 23.12 19.18 2qee s ALA 356 CO 0.00 -0.90 0.36 0.54 0.00 0.00 0.00 175.76 175.75 2qee n ARG 357 N 3.01 0.68 -5.03 0.00 1.74 -1.26 0.38 116.66 116.19 2qee n ARG 357 Ca 0.11 -0.14 -0.29 0.00 -0.77 0.00 0.00 57.85 56.76 2qee n ARG 357 Cb 0.37 -1.48 -0.17 0.00 -1.02 0.00 0.00 32.46 30.17 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 -3.18 1.74 0.24 1.55 1.01 -1.26 -4.38 120.40 116.12 2qee s VAL 358 Ca -0.08 -0.87 -0.08 0.00 0.00 0.00 0.00 61.98 60.96 2qee s VAL 358 Cb 0.11 -1.50 0.25 0.00 0.00 0.00 0.00 36.38 35.24 2qee s VAL 358 CO 0.82 0.49 1.65 0.25 0.00 0.00 0.00 175.10 178.31 2qee h LEU 359 N 6.44 -0.25 -1.20 3.92 5.85 -1.08 -1.05 115.31 127.94 2qee h LEU 359 Ca -0.28 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2qee h LEU 359 Cb 1.20 0.29 0.00 0.00 0.37 0.00 0.00 40.66 42.52 2qee h LEU 359 CO 0.47 -0.13 0.00 -0.33 -0.34 0.00 0.00 178.44 178.11 2qee h GLU 360 N 0.14 0.00 -0.22 1.25 3.07 -1.93 -2.32 114.58 114.57 2qee h GLU 360 Ca 0.39 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 59.31 2qee h GLU 360 Cb 0.67 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.57 2qee h GLU 360 CO -0.60 0.00 0.32 1.96 -1.40 0.00 0.00 179.01 179.29 2qee h GLN 361 N 0.00 0.00 -0.54 2.33 4.20 -1.59 -0.15 115.11 119.35 2qee h GLN 361 Ca 0.00 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.82 2qee h GLN 361 Cb 0.45 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 2qee h GLN 361 CO 0.00 0.00 0.37 -0.07 -0.67 0.00 0.00 178.83 178.46 2qee h LEU 362 N 0.00 0.22 0.49 1.46 3.38 -1.59 0.15 115.31 119.42 2qee h LEU 362 Ca 0.11 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2qee h LEU 362 Cb 0.74 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2qee h LEU 362 CO -0.00 0.13 -0.23 0.40 0.09 0.00 0.00 178.44 178.83 2qee h ILE 363 N 0.25 0.46 -0.22 1.22 2.04 -1.26 -2.76 117.51 117.23 2qee h ILE 363 Ca 0.26 -0.33 -0.20 0.00 1.00 0.00 0.00 64.86 65.58 2qee h ILE 363 Cb 0.68 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 2qee h ILE 363 CO -0.05 0.05 -0.66 0.10 0.00 0.00 0.00 178.15 177.59 2qee h TYR 364 N -0.87 1.07 -0.60 1.37 -0.00 -1.55 -0.64 116.97 115.74 2qee h TYR 364 Ca -0.07 -0.43 0.00 0.00 0.00 0.00 0.00 58.73 58.24 2qee h TYR 364 Cb 0.59 -0.18 -0.03 0.00 0.00 0.00 0.00 36.73 37.10 2qee h TYR 364 CO -0.00 1.26 0.38 0.87 -0.00 0.00 0.00 178.16 180.66 2qee h LYS 365 N 0.60 0.81 -0.00 0.10 1.79 -0.78 -0.27 116.57 118.82 2qee h LYS 365 Ca -0.02 -0.06 -0.26 0.00 -2.18 0.00 0.00 60.65 58.13 2qee h LYS 365 Cb 1.28 -0.17 0.02 0.00 -1.58 0.00 0.00 32.23 31.77 2qee h LYS 365 CO 0.14 0.56 -1.02 -1.49 -1.08 0.00 0.00 179.45 176.56 2qee h TRP 366 N 0.81 0.95 -0.02 -1.35 4.06 -1.51 -2.69 115.95 116.20 2qee h TRP 366 Ca 0.22 -0.52 0.01 0.00 2.06 0.00 0.00 58.89 60.66 2qee h TRP 366 Cb -0.05 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 27.99 2qee h TRP 366 CO -0.02 1.35 -0.06 1.25 -3.56 0.00 0.00 178.44 177.40 2qee h HIS 367 N 0.36 -0.15 -0.49 0.49 2.76 -0.82 0.19 115.15 117.50 2qee h HIS 367 Ca -0.12 0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 57.95 2qee h HIS 367 Cb 1.67 0.07 -0.01 0.00 1.55 0.00 0.00 27.41 30.69 2qee h HIS 367 CO 0.09 -0.10 -0.12 0.45 -1.30 0.00 0.00 177.93 176.95 2qee h HIS 368 N -0.10 1.07 -0.09 5.26 3.86 -1.13 -2.55 115.15 121.47 2qee h HIS 368 Ca 0.03 -0.23 -0.22 0.00 -1.16 0.00 0.00 60.37 58.79 2qee h HIS 368 Cb 0.14 -0.26 0.01 0.00 1.06 0.00 0.00 27.41 28.36 2qee h HIS 368 CO -0.14 1.02 -0.81 0.77 0.86 0.00 0.00 177.93 179.63 2qee h SER 369 N 0.80 0.87 -0.57 2.45 0.02 -1.42 -3.17 113.55 112.54 2qee h SER 369 Ca 0.12 -0.67 -0.05 0.00 -0.84 0.00 0.00 61.79 60.35 2qee h SER 369 Cb 0.68 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 2qee h SER 369 CO 0.05 1.41 0.19 0.11 -1.14 0.00 0.00 176.83 177.45 2qee h LYS 370 N 0.40 0.92 -0.47 3.45 1.57 -0.54 0.26 116.57 122.16 2qee h LYS 370 Ca -0.08 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.55 2qee h LYS 370 Cb 1.46 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.59 2qee h LYS 370 CO 0.16 0.79 0.28 0.66 -0.57 0.00 0.00 179.45 180.78 2qee h SER 371 N 0.89 0.45 -0.07 0.86 4.64 -1.49 0.90 113.55 119.73 2qee h SER 371 Ca 0.20 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.51 2qee h SER 371 Cb 0.26 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2qee h SER 371 CO -0.01 0.32 -0.02 0.40 -0.87 0.00 0.00 176.83 176.66 2qee h ILE 372 N 0.56 1.29 -0.86 0.95 2.04 -1.43 -2.14 117.51 117.92 2qee h ILE 372 Ca 0.19 -0.92 0.05 0.00 1.00 0.00 0.00 64.86 65.18 2qee h ILE 372 Cb 0.01 1.77 -0.06 0.00 -0.74 0.00 0.00 36.82 37.80 2qee h ILE 372 CO -0.08 0.25 0.54 0.40 0.00 0.00 0.00 178.15 179.27 2qee h ILE 373 N -0.20 1.08 -0.48 -0.67 2.04 -0.80 -1.84 117.51 116.64 2qee h ILE 373 Ca 0.02 -0.35 0.03 0.00 1.00 0.00 0.00 64.86 65.56 2qee h ILE 373 Cb 0.41 -0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.43 2qee h ILE 373 CO 0.01 0.19 0.26 0.00 0.00 0.00 0.00 178.15 178.60 2qee h ALA 374 N 1.39 0.61 -0.72 1.87 0.00 -0.71 -0.19 119.26 121.52 2qee h ALA 374 Ca 0.37 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.23 2qee h ALA 374 Cb 0.11 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2qee h ALA 374 CO -0.15 -0.07 0.23 0.93 0.00 0.00 0.00 179.25 180.19 2qee h GLU 375 N 0.52 1.10 -0.25 0.00 4.39 -0.68 0.43 114.58 120.09 2qee h GLU 375 Ca 0.20 -0.23 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 2qee h GLU 375 Cb 0.07 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 2qee h GLU 375 CO -0.12 0.93 0.09 0.28 -1.16 0.00 0.00 179.01 179.03 2qee h VAL 376 N 1.06 1.19 -0.60 3.13 2.07 -0.98 -2.02 116.25 120.10 2qee h VAL 376 Ca 0.23 -0.58 0.07 0.00 0.82 0.00 0.00 66.70 67.24 2qee h VAL 376 Cb 0.29 1.10 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 2qee h VAL 376 CO -0.01 0.19 0.29 -0.07 0.02 0.00 0.00 177.57 177.99 2qee h LEU 377 N 0.24 0.40 -0.16 2.57 3.38 -0.59 -0.43 115.31 120.72 2qee h LEU 377 Ca 0.08 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.13 2qee h LEU 377 Cb 0.21 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 2qee h LEU 377 CO -0.00 0.26 -0.04 0.40 0.09 0.00 0.00 178.44 179.14 2qee h ILE 378 N 0.54 0.83 -0.47 1.22 2.04 -0.67 0.26 117.51 121.26 2qee h ILE 378 Ca 0.28 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.17 2qee h ILE 378 Cb 0.23 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 2qee h ILE 378 CO -0.21 0.00 0.25 0.44 0.00 0.00 0.00 178.15 178.63 2qee h ASP 379 N -0.01 0.37 -0.41 1.72 3.32 -1.02 0.15 116.42 120.54 2qee h ASP 379 Ca 0.08 0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.02 2qee h ASP 379 Cb 0.13 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2qee h ASP 379 CO -0.17 0.26 -0.23 0.11 -1.72 0.00 0.00 179.24 177.50 2qee h LYS 380 N 0.49 0.92 -0.39 3.56 6.56 -0.46 -1.49 116.57 125.77 2qee h LYS 380 Ca 0.20 -0.39 -0.14 0.00 -1.06 0.00 0.00 60.65 59.26 2qee h LYS 380 Cb 0.08 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 31.70 2qee h LYS 380 CO -0.13 1.05 -0.32 1.88 -2.06 0.00 0.00 179.45 179.87 2qee h TYR 381 N 0.80 1.01 -0.72 -1.35 0.05 -0.44 -2.84 116.97 113.48 2qee h TYR 381 Ca 0.10 -0.28 -0.01 0.00 0.05 0.00 0.00 58.73 58.59 2qee h TYR 381 Cb 0.79 -0.22 -0.03 0.00 1.01 0.00 0.00 36.73 38.27 2qee h TYR 381 CO 0.05 1.07 0.39 0.22 -1.05 0.00 0.00 178.16 178.84 2qee h ASP 382 N 0.72 0.89 -0.36 3.88 3.58 -0.50 0.11 116.42 124.75 2qee h ASP 382 Ca 0.08 -0.07 -0.08 0.00 0.42 0.00 0.00 57.03 57.37 2qee h ASP 382 Cb 0.88 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.69 2qee h ASP 382 CO 0.08 0.72 -0.05 0.44 -2.88 0.00 0.00 179.24 177.55 2qee h ASP 383 N 1.01 0.74 1.05 2.28 3.32 -1.14 -0.41 116.42 123.26 2qee h ASP 383 Ca 0.26 -0.19 -0.19 0.00 0.02 0.00 0.00 57.03 56.92 2qee h ASP 383 Cb 0.03 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 2qee h ASP 383 CO -0.04 0.84 -0.98 0.16 -1.72 0.00 0.00 179.24 177.50 2qee h ILE 384 N 0.70 1.41 -0.91 0.35 3.07 -1.13 -2.53 117.51 118.48 2qee h ILE 384 Ca 0.13 -3.05 0.00 0.00 1.55 0.00 0.00 64.86 63.50 2qee h ILE 384 Cb 0.50 2.69 -0.04 0.00 -0.27 0.00 0.00 36.82 39.70 2qee h ILE 384 CO 0.03 0.80 0.58 -0.07 -1.05 0.00 0.00 178.15 178.44 2qee h LEU 385 N 0.00 1.06 -1.32 0.16 3.38 -0.52 -0.57 115.31 117.49 2qee h LEU 385 Ca -0.04 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2qee h LEU 385 Cb 1.70 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 42.17 2qee h LEU 385 CO 0.11 0.79 0.05 -0.61 0.09 0.00 0.00 178.44 178.86 2qee h GLN 386 N 1.24 0.50 -0.03 1.13 5.75 -0.97 -0.94 115.11 121.78 2qee h GLN 386 Ca 0.33 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.74 2qee h GLN 386 Cb -0.10 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.36 2qee h GLN 386 CO -0.07 0.49 0.00 0.00 -2.65 0.00 0.00 178.83 176.61 2qee n ALA 387 N -2.48 2.58 -0.33 3.38 0.00 -0.85 -4.90 120.51 117.91 2qee n ALA 387 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2qee n ALA 387 Cb 0.21 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 0.81 0.69 3.76 0.00 0.00 -0.36 -5.06 105.19 105.03 2qee n GLY 388 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.57 3.51 -0.82 1.61 -0.11 -0.28 -4.99 118.94 115.30 2qee s TRP 389 Ca 0.00 1.65 -0.12 0.00 1.22 0.00 0.00 56.10 58.85 2qee s TRP 389 Cb 0.00 -3.34 0.22 0.00 -1.50 0.00 0.00 33.47 28.85 2qee s TRP 389 CO 0.00 -0.73 0.75 -2.00 -4.62 0.00 0.00 176.95 170.35 2qee s GLU 390 N -1.41 3.50 0.18 5.86 2.12 -1.26 -4.06 118.70 123.61 2qee s GLU 390 Ca 0.45 -2.54 -0.30 0.00 0.36 0.00 0.00 54.97 52.94 2qee s GLU 390 Cb -0.33 -4.33 -0.09 0.00 0.26 0.00 0.00 34.13 29.64 2qee s GLU 390 CO 0.42 -1.27 1.36 0.08 -0.54 0.00 0.00 175.26 175.31 2qee s VAL 391 N 0.01 3.15 0.19 3.70 1.01 -1.26 -5.03 120.40 122.18 2qee s VAL 391 Ca 0.19 0.90 0.01 0.00 0.00 0.00 0.00 61.98 63.08 2qee s VAL 391 Cb -0.11 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 2qee s VAL 391 CO -0.08 0.11 0.36 0.42 0.00 0.00 0.00 175.10 175.91 2qee s THR 392 N 0.46 5.24 0.42 3.92 -4.23 -1.26 -4.50 115.64 115.69 2qee s THR 392 Ca 0.60 -0.51 0.10 0.00 -1.18 0.00 0.00 61.69 60.70 2qee s THR 392 Cb -0.37 -3.75 0.22 0.00 1.34 0.00 0.00 72.50 69.93 2qee s THR 392 CO 0.36 -0.17 2.01 -0.08 -0.54 0.00 0.00 174.62 176.19 2qee h GLU 393 N 1.94 0.31 -0.26 3.99 4.81 -1.95 -0.48 114.58 122.94 2qee h GLU 393 Ca -0.48 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 58.59 2qee h GLU 393 Cb 1.20 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 2qee h GLU 393 CO 0.67 0.31 -0.31 0.93 -0.73 0.00 0.00 179.01 179.88 2qee h GLU 394 N 0.31 0.54 -0.41 1.92 4.39 -1.99 -1.02 114.58 118.32 2qee h GLU 394 Ca 0.07 -0.24 -0.12 0.00 0.34 0.00 0.00 59.36 59.42 2qee h GLU 394 Cb 0.15 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 2qee h GLU 394 CO -0.00 0.79 -0.21 0.93 -1.16 0.00 0.00 179.01 179.37 2qee h GLU 395 N 0.47 0.87 -0.83 2.33 5.08 -1.70 -0.84 114.58 119.95 2qee h GLU 395 Ca 0.06 -0.38 0.07 0.00 -1.00 0.00 0.00 59.36 58.11 2qee h GLU 395 Cb 0.78 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.94 2qee h GLU 395 CO 0.06 1.03 0.50 0.82 -1.00 0.00 0.00 179.01 180.42 2qee h ILE 396 N 0.69 0.99 -0.41 3.13 2.04 -0.89 -0.44 117.51 122.62 2qee h ILE 396 Ca 0.09 -0.30 -0.14 0.00 1.00 0.00 0.00 64.86 65.51 2qee h ILE 396 Cb 0.77 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 2qee h ILE 396 CO 0.06 0.16 -0.30 0.11 0.00 0.00 0.00 178.15 178.18 2qee h LYS 397 N 0.89 0.90 -0.18 2.37 1.57 -0.90 -0.97 116.57 120.24 2qee h LYS 397 Ca 0.37 -0.42 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2qee h LYS 397 Cb 0.23 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2qee h LYS 397 CO -0.20 1.07 0.09 -0.09 -0.57 0.00 0.00 179.45 179.75 2qee h ARG 398 N 0.76 0.26 -0.74 3.15 2.43 -0.78 -0.98 114.38 118.47 2qee h ARG 398 Ca 0.08 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2qee h ARG 398 Cb 0.87 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.34 2qee h ARG 398 CO 0.08 0.30 0.31 -0.44 -1.51 0.00 0.00 179.97 178.71 2qee h ASP 399 N 0.16 1.01 -0.38 -3.80 3.32 -0.82 -0.40 116.42 115.51 2qee h ASP 399 Ca 0.06 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 56.92 2qee h ASP 399 Cb 0.13 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 2qee h ASP 399 CO -0.01 0.90 0.12 0.58 -1.72 0.00 0.00 179.24 179.11 2qee h VAL 400 N 1.06 1.21 -0.95 -1.35 2.07 -1.09 -1.39 116.25 115.80 2qee h VAL 400 Ca 0.25 -0.70 0.08 0.00 0.82 0.00 0.00 66.70 67.15 2qee h VAL 400 Cb 0.19 0.95 -0.07 0.00 -1.52 0.00 0.00 31.29 30.84 2qee h VAL 400 CO -0.02 0.25 0.60 0.00 0.02 0.00 0.00 177.57 178.41 2qee h ALA 401 N 0.96 1.36 -0.20 1.67 0.00 -0.58 -1.52 119.26 120.96 2qee h ALA 401 Ca 0.12 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2qee h ALA 401 Cb 0.26 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2qee h ALA 401 CO -0.00 0.31 0.12 -0.44 0.00 0.00 0.00 179.25 179.24 2qee h ASP 402 N 1.04 0.23 -0.47 0.00 3.32 -0.49 0.34 116.42 120.39 2qee h ASP 402 Ca 0.43 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.35 2qee h ASP 402 Cb 0.28 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2qee h ASP 402 CO -0.21 0.20 -0.11 -0.07 -1.72 0.00 0.00 179.24 177.33 2qee h LEU 403 N 0.25 0.91 0.00 1.55 3.38 -0.76 -0.19 115.31 120.45 2qee h LEU 403 Ca 0.07 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2qee h LEU 403 Cb 0.00 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.50 2qee h LEU 403 CO -0.01 1.06 -0.93 0.49 0.09 0.00 0.00 178.44 179.14 2qee n PHE 404 N -4.24 0.27 0.05 1.13 3.72 -0.62 -4.17 117.46 113.61 2qee n PHE 404 Ca 0.00 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 2qee n PHE 404 Cb 0.39 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 38.50 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 -1.92 -0.71 0.10 4.37 2.88 -0.56 -1.13 113.62 116.64 2qee n SER 405 Ca 0.02 0.20 -0.03 0.00 -1.33 0.00 0.00 58.87 57.74 2qee n SER 405 Cb 0.42 0.91 0.18 0.00 -0.75 0.00 0.00 64.21 64.98 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 0.20 -0.58 -1.46 3.08 -0.92 -2.82 114.38 111.88 2qee h ARG 406 Ca 0.00 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 59.86 2qee h ARG 406 Cb 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2qee h ARG 406 CO 0.00 0.66 0.07 -0.91 -1.07 0.00 0.00 179.97 178.72 2qee h ASN 407 N 0.16 0.91 0.46 7.04 2.35 -1.25 -0.25 115.58 125.01 2qee h ASN 407 Ca 0.01 -0.21 -0.02 0.00 -0.55 0.00 0.00 56.30 55.52 2qee h ASN 407 Cb 0.95 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.08 2qee h ASN 407 CO 0.08 0.93 -0.22 0.15 -1.65 0.00 0.00 177.43 176.71 2qee h PHE 408 N 0.89 -0.58 -0.69 1.19 3.57 -1.73 -1.52 116.94 118.07 2qee h PHE 408 Ca 0.18 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.67 2qee h PHE 408 Cb 0.43 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 2qee h PHE 408 CO 0.03 -0.27 0.46 -1.49 -2.23 0.00 0.00 178.31 174.80 2qee h TRP 409 N -0.82 0.87 -0.58 0.41 4.06 -1.42 0.30 115.95 118.77 2qee h TRP 409 Ca -0.06 0.02 -0.04 0.00 2.06 0.00 0.00 58.89 60.87 2qee h TRP 409 Cb 0.56 -0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 28.40 2qee h TRP 409 CO -0.00 0.55 0.21 -0.09 -3.56 0.00 0.00 178.44 175.54 2qee h ARG 410 N 0.94 0.86 0.08 0.49 2.43 -0.99 -1.01 114.38 117.18 2qee h ARG 410 Ca 0.25 -0.15 -0.19 0.00 -0.81 0.00 0.00 59.98 59.09 2qee h ARG 410 Cb -0.11 -0.14 0.02 0.00 -0.42 0.00 0.00 29.97 29.32 2qee h ARG 410 CO -0.05 0.73 -0.79 0.35 -1.51 0.00 0.00 179.97 178.69 2qee h PHE 411 N 0.84 0.65 0.00 2.20 3.57 -0.05 -3.11 116.94 121.04 2qee h PHE 411 Ca 0.20 -0.41 0.00 0.00 3.53 0.00 0.00 57.97 61.29 2qee h PHE 411 Cb 0.21 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.90 2qee h PHE 411 CO 0.01 1.27 0.00 1.33 -2.23 0.00 0.00 178.31 178.69 2qee n VAL 412 N -4.11 0.17 -3.01 1.41 0.24 -0.06 -4.89 118.33 108.07 2qee n VAL 412 Ca -0.12 0.04 -0.17 0.00 -2.04 0.00 0.00 64.34 62.05 2qee n VAL 412 Cb 0.78 -0.59 0.04 0.00 -1.47 0.00 0.00 33.84 32.61 2qee n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qee n GLY 413 N 1.18 -0.17 1.65 7.63 0.00 -0.41 -4.83 105.19 110.25 2qee n GLY 413 Ca 0.08 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.40 1.31 0.00 1.61 5.12 -1.06 -5.07 116.66 115.17 2qee n ARG 414 Ca -0.05 -1.69 0.00 0.00 -1.93 0.00 0.00 57.85 54.19 2qee n ARG 414 Cb 0.57 0.54 0.00 0.00 -1.16 0.00 0.00 32.46 32.41 2qee n ARG 414 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99