#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fgt s ILE 8 N 0.00 5.10 0.07 3.15 1.01 0.78 -4.85 121.20 126.46 1fgt s ILE 8 Ca 0.00 0.69 -0.31 0.00 0.00 0.00 0.00 60.65 61.03 1fgt s ILE 8 Cb 0.00 -3.80 -0.06 0.00 0.01 0.00 0.00 42.46 38.61 1fgt s ILE 8 CO 0.00 0.07 1.22 -0.75 0.00 0.00 0.00 174.94 175.48 1fgt s LYS 9 N 2.23 4.42 0.13 2.79 2.20 -1.26 -1.04 119.74 129.21 1fgt s LYS 9 Ca 0.19 1.80 0.03 0.00 -0.36 0.00 0.00 55.97 57.63 1fgt s LYS 9 Cb -0.16 -3.34 -0.04 0.00 -1.51 0.00 0.00 37.83 32.78 1fgt s LYS 9 CO 0.10 -0.28 -0.09 0.20 -0.36 0.00 0.00 175.35 174.93 1fgt s GLY 10 N 1.07 0.94 -0.08 5.54 0.00 0.14 -1.48 107.32 113.45 1fgt s GLY 10 Ca 0.59 -1.43 0.00 0.00 0.00 0.00 0.00 44.72 43.89 1fgt s GLY 10 CO 0.29 -1.53 -0.05 -1.59 0.00 0.00 0.00 173.10 170.22 1fgt s THR 11 N -3.43 0.71 -0.17 0.90 2.01 -0.15 -2.03 115.64 113.48 1fgt s THR 11 Ca 0.14 -0.15 -0.05 0.00 0.31 0.00 0.00 61.69 61.95 1fgt s THR 11 Cb 0.04 -0.76 -0.03 0.00 0.01 0.00 0.00 72.50 71.75 1fgt s THR 11 CO -0.02 0.30 0.00 -0.69 -0.69 0.00 0.00 174.62 173.52 1fgt s VAL 12 N 1.43 4.20 -0.13 3.82 1.01 0.04 -1.15 120.40 129.62 1fgt s VAL 12 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1fgt s VAL 12 Cb -0.13 -2.87 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 1fgt s VAL 12 CO -0.04 0.47 -0.13 -0.69 0.00 0.00 0.00 175.10 174.71 1fgt s VAL 13 N 0.48 3.04 0.15 2.92 1.01 -0.13 0.45 120.40 128.33 1fgt s VAL 13 Ca -0.01 -0.67 -0.08 0.00 0.00 0.00 0.00 61.98 61.23 1fgt s VAL 13 Cb -0.14 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 1fgt s VAL 13 CO 0.02 0.53 0.24 -1.48 0.00 0.00 0.00 175.10 174.41 1fgt s LEU 14 N 0.31 1.14 -0.13 3.92 0.05 -0.61 -0.48 118.68 122.88 1fgt s LEU 14 Ca -0.10 -0.90 0.01 0.00 0.05 0.00 0.00 54.13 53.19 1fgt s LEU 14 Cb -0.16 1.04 0.02 0.00 -2.05 0.00 0.00 46.19 45.04 1fgt s LEU 14 CO 0.06 -0.85 -0.16 -0.04 -0.55 0.00 0.00 176.35 174.80 1fgt s MET 15 N -3.97 2.40 0.53 1.48 -1.94 0.65 -1.56 119.30 116.89 1fgt s MET 15 Ca 0.17 -0.62 -0.21 0.00 -1.71 0.00 0.00 55.69 53.32 1fgt s MET 15 Cb 0.04 -2.06 -0.05 0.00 2.01 0.00 0.00 34.83 34.77 1fgt s MET 15 CO -0.01 -0.11 1.21 -2.14 -0.01 0.00 0.00 175.02 173.97 1fgt s PRO 16 N 1.10 3.33 0.28 2.03 0.02 -1.26 -0.61 135.00 139.89 1fgt s PRO 16 Ca -0.03 1.87 -0.01 0.00 0.02 0.00 0.00 61.00 62.85 1fgt s PRO 16 Cb -0.14 -2.18 0.65 0.00 0.02 0.00 0.00 34.50 32.85 1fgt s PRO 16 CO -0.04 -0.93 1.62 -0.22 -0.33 0.00 0.00 177.00 177.10 1fgt h LYS 17 N 1.46 0.10 0.00 5.54 3.64 -1.94 -0.17 116.57 125.20 1fgt h LYS 17 Ca -0.50 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1fgt h LYS 17 Cb 1.28 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1fgt h LYS 17 CO 0.58 0.07 0.26 -2.95 -2.27 0.00 0.00 179.45 175.13 1fgt h ASN 18 N 0.11 0.00 0.24 4.20 -1.07 -1.92 -2.11 115.58 115.03 1fgt h ASN 18 Ca 0.53 0.00 -0.25 0.00 0.07 0.00 0.00 56.30 56.65 1fgt h ASN 18 Cb 1.05 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 37.31 1fgt h ASN 18 CO -0.75 0.00 -1.04 -0.33 0.07 0.00 0.00 177.43 175.38 1fgt h GLU 19 N 0.00 0.51 0.00 4.14 4.39 -1.37 -3.52 114.58 118.72 1fgt h GLU 19 Ca 0.00 -0.59 0.00 0.00 0.34 0.00 0.00 59.36 59.11 1fgt h GLU 19 Cb 0.51 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1fgt h GLU 19 CO 0.00 1.22 -0.89 1.28 -1.16 0.00 0.00 179.01 179.46 1fgt n LEU 20 N -3.76 0.42 0.00 1.33 4.32 -0.80 -4.36 117.00 114.14 1fgt n LEU 20 Ca -0.09 -0.35 0.00 0.00 -0.02 0.00 0.00 56.01 55.55 1fgt n LEU 20 Cb 0.89 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.69 1fgt n LEU 20 CO 0.54 0.10 0.00 0.18 -1.22 0.00 0.00 177.39 176.99 1fgt n LEU 32 N -1.49 0.00 0.24 2.23 4.77 -1.26 -3.31 117.00 118.18 1fgt n LEU 32 Ca 0.01 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.15 1fgt n LEU 32 Cb 0.24 0.00 0.68 0.00 -2.33 0.00 0.00 43.42 42.00 1fgt n LEU 32 CO 0.26 0.00 0.97 0.78 -1.33 0.00 0.00 177.39 178.07 1fgt h ASN 33 N 0.00 0.00 0.56 -1.43 2.35 -2.03 -2.10 115.58 112.93 1fgt h ASN 33 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1fgt h ASN 33 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1fgt h ASN 33 CO 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.78 1fgt h ALA 34 N 2.08 1.00 0.00 -0.83 0.00 -2.05 -1.62 119.26 117.84 1fgt h ALA 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fgt h ALA 34 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1fgt h ALA 34 CO 0.00 0.00 -0.12 1.19 0.00 0.00 0.00 179.25 180.32 1fgt n PHE 35 N -2.95 0.72 0.00 0.00 3.72 -0.79 -4.66 117.46 113.51 1fgt n PHE 35 Ca -0.01 0.21 0.00 0.00 -0.05 0.00 0.00 57.45 57.60 1fgt n PHE 35 Cb 0.20 -0.82 0.00 0.00 -0.94 0.00 0.00 39.48 37.92 1fgt n PHE 35 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1fgt n LEU 36 N -2.12 0.00 0.00 4.37 4.77 -0.61 -3.98 117.00 119.43 1fgt n LEU 36 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1fgt n LEU 36 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1fgt n LEU 36 CO 0.31 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1fgt n GLY 37 N 4.75 2.28 1.73 -0.72 0.00 -1.26 -1.56 105.19 110.41 1fgt n GLY 37 Ca 0.00 -0.13 -0.17 0.00 0.00 0.00 0.00 46.02 45.73 1fgt n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fgt n ARG 38 N 14.00 2.29 0.02 1.61 1.74 -1.26 -4.57 116.66 130.50 1fgt n ARG 38 Ca 0.00 -3.29 -0.19 0.00 -0.77 0.00 0.00 57.85 53.60 1fgt n ARG 38 Cb 0.00 -2.04 -0.10 0.00 -1.02 0.00 0.00 32.46 29.30 1fgt n ARG 38 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1fgt h SER 39 N 1.31 0.78 -3.36 0.55 0.02 -1.49 -3.44 113.55 107.92 1fgt h SER 39 Ca 0.41 -0.73 -0.46 0.00 -0.84 0.00 0.00 61.79 60.17 1fgt h SER 39 Cb 1.80 -0.24 -0.35 0.00 0.14 0.00 0.00 62.40 63.75 1fgt h SER 39 CO 0.81 1.40 -0.78 -0.69 -1.14 0.00 0.00 176.83 176.43 1fgt s VAL 40 N -3.34 0.70 0.03 2.27 1.01 -1.26 0.21 120.40 120.03 1fgt s VAL 40 Ca -0.11 -0.17 0.08 0.00 0.00 0.00 0.00 61.98 61.79 1fgt s VAL 40 Cb 0.06 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.68 1fgt s VAL 40 CO 0.88 0.28 -0.25 -0.94 0.00 0.00 0.00 175.10 175.08 1fgt s SER 41 N 1.24 2.93 0.12 3.32 1.04 -0.82 -2.72 113.70 118.82 1fgt s SER 41 Ca -0.05 -0.55 0.09 0.00 0.48 0.00 0.00 55.95 55.92 1fgt s SER 41 Cb -0.14 -0.27 -0.04 0.00 0.10 0.00 0.00 66.02 65.67 1fgt s SER 41 CO -0.02 0.24 -0.22 -0.76 0.98 0.00 0.00 173.24 173.47 1fgt s LEU 42 N -1.10 2.33 -0.08 2.42 1.02 0.13 -1.23 118.68 122.17 1fgt s LEU 42 Ca 0.10 -0.73 -0.01 0.00 0.02 0.00 0.00 54.13 53.51 1fgt s LEU 42 Cb -0.10 -0.94 0.03 0.00 0.02 0.00 0.00 46.19 45.20 1fgt s LEU 42 CO 0.01 0.07 -0.00 -1.10 0.02 0.00 0.00 176.35 175.35 1fgt s GLN 43 N -2.10 0.70 0.56 1.70 -0.21 -0.24 -0.98 119.66 119.08 1fgt s GLN 43 Ca 0.10 0.05 -0.18 0.00 0.02 0.00 0.00 55.36 55.35 1fgt s GLN 43 Cb -0.09 -1.09 -0.05 0.00 1.00 0.00 0.00 33.01 32.78 1fgt s GLN 43 CO 0.05 -0.32 1.08 -0.51 -2.12 0.00 0.00 175.29 173.48 1fgt s LEU 44 N 1.94 3.65 -0.06 2.90 1.43 -1.26 -0.53 118.68 126.75 1fgt s LEU 44 Ca 0.05 1.98 0.03 0.00 -1.03 0.00 0.00 54.13 55.16 1fgt s LEU 44 Cb -0.12 -4.56 0.01 0.00 0.03 0.00 0.00 46.19 41.54 1fgt s LEU 44 CO -0.06 -1.16 -0.14 -0.63 0.23 0.00 0.00 176.35 174.60 1fgt s ILE 45 N -2.11 1.20 0.19 -0.59 1.01 0.60 -0.86 121.20 120.64 1fgt s ILE 45 Ca 0.68 -0.55 -0.30 0.00 0.00 0.00 0.00 60.65 60.48 1fgt s ILE 45 Cb -0.19 -1.07 -0.08 0.00 0.01 0.00 0.00 42.46 41.13 1fgt s ILE 45 CO 0.30 0.36 0.97 -0.55 0.00 0.00 0.00 174.94 176.02 1fgt s SER 46 N 0.42 7.55 0.00 3.58 0.15 -0.02 -1.15 113.70 124.23 1fgt s SER 46 Ca -0.10 1.91 0.23 0.00 0.70 0.00 0.00 55.95 58.68 1fgt s SER 46 Cb -0.14 -2.60 0.06 0.00 -1.71 0.00 0.00 66.02 61.63 1fgt s SER 46 CO 0.03 0.03 1.11 0.00 1.20 0.00 0.00 173.24 175.61 1fgt n ALA 47 N 2.05 4.26 -0.00 5.45 0.00 -0.07 -4.17 120.51 128.02 1fgt n ALA 47 Ca 0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 53.44 52.93 1fgt n ALA 47 Cb 0.48 -0.91 -0.01 0.00 0.00 0.00 0.00 19.45 19.02 1fgt n ALA 47 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1fgt n THR 48 N -1.44 0.03 -3.98 0.00 -2.24 -1.25 -4.08 114.28 101.31 1fgt n THR 48 Ca 0.05 -0.02 -0.35 0.00 -2.27 0.00 0.00 64.05 61.46 1fgt n THR 48 Cb 0.34 -0.33 -0.13 0.00 -2.10 0.00 0.00 70.33 68.10 1fgt n THR 48 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1fgt s LYS 49 N -2.03 3.48 0.17 -0.78 -0.14 -1.26 -4.91 119.74 114.26 1fgt s LYS 49 Ca -0.00 -0.58 0.08 0.00 -1.36 0.00 0.00 55.97 54.11 1fgt s LYS 49 Cb 0.00 -3.05 -0.04 0.00 -1.68 0.00 0.00 37.83 33.06 1fgt s LYS 49 CO 0.03 -0.12 -0.08 0.00 -0.76 0.00 0.00 175.35 174.42 1fgt s ALA 50 N 1.31 3.00 1.00 5.17 0.00 -1.26 -0.64 121.76 130.34 1fgt s ALA 50 Ca 0.04 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.58 1fgt s ALA 50 Cb -0.14 -0.81 0.00 0.00 0.00 0.00 0.00 23.12 22.16 1fgt s ALA 50 CO -0.01 0.50 0.00 -0.40 0.00 0.00 0.00 175.76 175.85 1fgt n ASP 51 N 0.10 -0.39 0.00 0.00 5.68 0.85 -4.80 116.55 117.99 1fgt n ASP 51 Ca -0.11 -0.61 0.08 0.00 -0.50 0.00 0.00 54.79 53.65 1fgt n ASP 51 Cb 0.55 0.00 0.44 0.00 -1.14 0.00 0.00 41.12 40.97 1fgt n ASP 51 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fgt n ALA 52 N -3.00 1.98 0.41 2.12 0.00 -1.26 -2.29 120.51 118.48 1fgt n ALA 52 Ca 0.00 -0.09 0.05 0.00 0.00 0.00 0.00 53.44 53.40 1fgt n ALA 52 Cb 0.00 -1.27 0.03 0.00 0.00 0.00 0.00 19.45 18.21 1fgt n ALA 52 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1fgt n HIS 53 N -1.17 0.00 -0.30 0.00 8.25 -1.26 -4.97 115.22 115.77 1fgt n HIS 53 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1fgt n HIS 53 Cb 0.10 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.21 1fgt n HIS 53 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fgt n GLY 54 N 0.65 0.72 3.81 -1.41 0.00 -0.97 -5.06 105.19 102.92 1fgt n GLY 54 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1fgt n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fgt s LYS 55 N -0.70 3.94 0.20 1.61 1.02 -1.26 -4.12 119.74 120.43 1fgt s LYS 55 Ca 0.00 0.20 -0.31 0.00 0.02 0.00 0.00 55.97 55.88 1fgt s LYS 55 Cb 0.00 -3.29 -0.16 0.00 -0.52 0.00 0.00 37.83 33.87 1fgt s LYS 55 CO 0.00 0.54 1.02 0.41 -0.92 0.00 0.00 175.35 176.41 1fgt n GLY 56 N 2.41 -0.30 3.77 -3.33 0.00 0.44 -0.11 105.19 108.07 1fgt n GLY 56 Ca -0.14 0.45 -0.37 0.00 0.00 0.00 0.00 46.02 45.97 1fgt n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fgt s LYS 57 N -0.81 3.54 -0.10 1.61 1.02 0.19 -4.60 119.74 120.59 1fgt s LYS 57 Ca 0.68 1.78 0.01 0.00 0.02 0.00 0.00 55.97 58.46 1fgt s LYS 57 Cb -0.83 -2.25 -0.02 0.00 -0.52 0.00 0.00 37.83 34.20 1fgt s LYS 57 CO 0.55 -0.74 -0.12 0.08 -0.92 0.00 0.00 175.35 174.21 1fgt s VAL 58 N -1.58 3.25 0.42 3.17 1.01 -1.26 -0.84 120.40 124.57 1fgt s VAL 58 Ca 0.68 -0.62 -0.07 0.00 0.00 0.00 0.00 61.98 61.96 1fgt s VAL 58 Cb -0.29 -2.33 0.10 0.00 0.00 0.00 0.00 36.38 33.86 1fgt s VAL 58 CO 0.34 0.56 0.49 0.61 0.00 0.00 0.00 175.10 177.09 1fgt n GLY 59 N 2.90 -1.76 3.85 4.51 0.00 -0.04 -4.99 105.19 109.66 1fgt n GLY 59 Ca -0.18 -1.60 -0.31 0.00 0.00 0.00 0.00 46.02 43.93 1fgt n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fgt s LYS 60 N -4.08 3.52 0.12 1.61 1.02 -1.26 -4.73 119.74 115.94 1fgt s LYS 60 Ca 0.29 0.87 -0.31 0.00 0.02 0.00 0.00 55.97 56.84 1fgt s LYS 60 Cb -0.01 -2.07 -0.09 0.00 -0.52 0.00 0.00 37.83 35.14 1fgt s LYS 60 CO 0.21 -0.63 1.49 -0.51 -0.92 0.00 0.00 175.35 174.99 1fgt s ASP 61 N -3.74 6.71 -0.08 2.83 1.01 -1.26 -4.46 116.67 117.67 1fgt s ASP 61 Ca 0.57 2.44 0.03 0.00 0.71 0.00 0.00 52.55 56.30 1fgt s ASP 61 Cb -0.12 -2.58 0.01 0.00 1.01 0.00 0.00 42.92 41.24 1fgt s ASP 61 CO 0.48 -0.76 -0.15 -0.89 0.21 0.00 0.00 175.17 174.06 1fgt s THR 62 N 1.45 1.41 0.28 -1.27 2.01 -0.16 -4.91 115.64 114.45 1fgt s THR 62 Ca 0.68 -0.63 0.05 0.00 0.31 0.00 0.00 61.69 62.10 1fgt s THR 62 Cb -0.39 -1.27 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 1fgt s THR 62 CO 0.31 0.42 0.41 -0.36 -0.69 0.00 0.00 174.62 174.70 1fgt s PHE 63 N 0.67 3.32 0.26 4.92 0.40 -1.26 0.19 117.98 126.48 1fgt s PHE 63 Ca -0.14 -0.08 -0.30 0.00 -0.60 0.00 0.00 56.93 55.81 1fgt s PHE 63 Cb -0.16 -1.74 -0.11 0.00 0.51 0.00 0.00 43.02 41.52 1fgt s PHE 63 CO 0.04 0.26 1.52 -0.51 0.70 0.00 0.00 175.22 177.22 1fgt s LEU 64 N -4.07 4.37 -0.17 -0.37 1.43 -1.10 -4.76 118.68 114.01 1fgt s LEU 64 Ca 0.38 2.77 0.02 0.00 -1.03 0.00 0.00 54.13 56.28 1fgt s LEU 64 Cb -0.09 -3.62 -0.23 0.00 0.03 0.00 0.00 46.19 42.28 1fgt s LEU 64 CO 0.30 -0.80 0.17 -0.62 0.23 0.00 0.00 176.35 175.63 1fgt n GLU 65 N 2.46 0.70 -3.74 1.70 1.02 -0.28 -4.34 120.64 118.15 1fgt n GLU 65 Ca 0.08 0.20 -0.00 0.00 -0.02 0.00 0.00 57.16 57.42 1fgt n GLU 65 Cb 0.39 -1.63 -0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1fgt n GLU 65 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1fgt s GLY 66 N -5.83 -0.25 -0.07 0.62 0.00 -1.20 -4.92 107.32 95.67 1fgt s GLY 66 Ca -0.23 0.31 -0.25 0.00 0.00 0.00 0.00 44.72 44.55 1fgt s GLY 66 CO 0.73 1.22 0.77 -0.42 0.00 0.00 0.00 173.10 175.40 1fgt s ILE 67 N -2.53 4.99 -0.22 0.90 1.09 -1.26 0.10 121.20 124.26 1fgt s ILE 67 Ca 0.17 1.58 -0.15 0.00 -1.10 0.00 0.00 60.65 61.15 1fgt s ILE 67 Cb 0.02 -4.11 -0.04 0.00 -1.06 0.00 0.00 42.46 37.27 1fgt s ILE 67 CO -0.01 0.20 0.38 0.21 -0.10 0.00 0.00 174.94 175.62 1fgt s ASN 68 N 0.90 6.37 -0.25 3.58 3.84 0.64 -4.80 114.94 125.22 1fgt s ASN 68 Ca 0.40 0.44 0.12 0.00 0.21 0.00 0.00 52.86 54.03 1fgt s ASN 68 Cb -0.18 -2.22 0.46 0.00 -0.55 0.00 0.00 41.25 38.76 1fgt s ASN 68 CO 0.19 -0.09 1.18 1.07 -2.79 0.00 0.00 177.10 176.65 1fgt n THR 69 N 4.52 2.07 -0.06 -5.21 5.66 -1.26 -4.23 114.28 115.76 1fgt n THR 69 Ca -0.09 -3.61 -0.05 0.00 -3.05 0.00 0.00 64.05 57.25 1fgt n THR 69 Cb 0.51 -0.37 -0.02 0.00 -1.55 0.00 0.00 70.33 68.91 1fgt n THR 69 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1fgt n SER 70 N -0.68 1.51 -4.73 1.09 7.64 -1.26 -4.96 113.62 112.23 1fgt n SER 70 Ca 0.30 0.50 -0.42 0.00 1.01 0.00 0.00 58.87 60.26 1fgt n SER 70 Cb 0.90 -0.78 -0.03 0.00 -1.01 0.00 0.00 64.21 63.29 1fgt n SER 70 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1fgt s LEU 71 N -7.53 4.37 0.26 -3.43 2.96 -1.26 -4.90 118.68 109.15 1fgt s LEU 71 Ca -0.15 2.64 0.03 0.00 -0.22 0.00 0.00 54.13 56.43 1fgt s LEU 71 Cb 0.02 -3.60 0.34 0.00 0.50 0.00 0.00 46.19 43.44 1fgt s LEU 71 CO 0.22 -0.79 1.64 -0.65 -1.32 0.00 0.00 176.35 175.45 1fgt h PRO 72 N 6.25 0.35 -6.33 0.98 0.11 -2.02 -3.42 132.00 127.91 1fgt h PRO 72 Ca -0.44 -0.18 -0.55 0.00 0.11 0.00 0.00 66.00 64.94 1fgt h PRO 72 Cb 1.21 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 1fgt h PRO 72 CO 0.87 0.73 0.68 0.99 -0.21 0.00 0.00 178.00 181.06 1fgt s THR 73 N -4.11 4.25 0.00 -1.15 2.01 -1.26 -4.57 115.64 110.81 1fgt s THR 73 Ca -0.05 1.58 0.00 0.00 0.31 0.00 0.00 61.69 63.53 1fgt s THR 73 Cb 0.13 -4.02 0.00 0.00 0.01 0.00 0.00 72.50 68.62 1fgt s THR 73 CO 0.79 0.01 0.00 -0.11 -0.69 0.00 0.00 174.62 174.63 1fgt n LEU 74 N 5.07 0.00 0.00 4.42 7.94 -1.26 -5.12 117.00 128.05 1fgt n LEU 74 Ca 0.11 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 1fgt n LEU 74 Cb 0.46 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.41 1fgt n LEU 74 CO 0.55 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.44 1fgt n GLY 75 N 0.00 0.76 4.17 -3.96 0.00 -1.26 -4.79 105.19 100.11 1fgt n GLY 75 Ca 0.00 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 1fgt n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fgt n ALA 76 N 1.79 -2.11 -2.50 4.61 0.00 -1.26 -1.01 120.51 120.03 1fgt n ALA 76 Ca 0.00 -0.40 -0.07 0.00 0.00 0.00 0.00 53.44 52.97 1fgt n ALA 76 Cb 0.00 -1.32 -0.00 0.00 0.00 0.00 0.00 19.45 18.13 1fgt n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fgt n GLY 77 N -2.34 -0.50 3.91 0.00 0.00 -1.26 -4.91 105.19 100.09 1fgt n GLY 77 Ca -0.29 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.45 1fgt n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fgt s GLU 78 N -5.05 3.60 -0.01 1.61 2.02 -0.18 -4.53 118.70 116.16 1fgt s GLU 78 Ca 0.01 -0.12 0.01 0.00 0.02 0.00 0.00 54.97 54.90 1fgt s GLU 78 Cb -0.01 -2.74 0.00 0.00 0.10 0.00 0.00 34.13 31.48 1fgt s GLU 78 CO 0.02 0.32 -0.04 -1.12 0.02 0.00 0.00 175.26 174.46 1fgt s SER 79 N -3.03 0.51 -0.05 -0.19 0.01 -0.60 -4.77 113.70 105.58 1fgt s SER 79 Ca 0.42 -0.08 -0.02 0.00 1.31 0.00 0.00 55.95 57.58 1fgt s SER 79 Cb -0.11 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 65.99 1fgt s SER 79 CO 0.28 0.03 0.06 0.00 0.41 0.00 0.00 173.24 174.03 1fgt s ALA 80 N 0.05 3.52 -0.04 1.44 0.00 -1.26 -1.58 121.76 123.90 1fgt s ALA 80 Ca -0.00 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.18 1fgt s ALA 80 Cb -0.03 -1.60 -0.00 0.00 0.00 0.00 0.00 23.12 21.48 1fgt s ALA 80 CO -0.00 0.64 -0.15 -0.06 0.00 0.00 0.00 175.76 176.19 1fgt s PHE 81 N -1.06 1.49 0.38 0.00 0.08 0.17 -0.26 117.98 118.78 1fgt s PHE 81 Ca 0.18 -0.42 -0.19 0.00 0.12 0.00 0.00 56.93 56.63 1fgt s PHE 81 Cb -0.12 -1.02 -0.10 0.00 -0.57 0.00 0.00 43.02 41.22 1fgt s PHE 81 CO 0.08 -0.15 0.86 -0.80 -0.10 0.00 0.00 175.22 175.11 1fgt s ASN 82 N 0.11 6.89 -0.27 1.36 0.01 0.11 -0.78 114.94 122.37 1fgt s ASN 82 Ca -0.04 1.53 -0.25 0.00 -0.71 0.00 0.00 52.86 53.39 1fgt s ASN 82 Cb -0.11 -2.47 0.08 0.00 0.41 0.00 0.00 41.25 39.16 1fgt s ASN 82 CO 0.02 -0.28 0.79 -0.51 -1.51 0.00 0.00 177.10 175.60 1fgt s ILE 83 N -2.07 0.00 -0.11 0.60 2.07 -0.86 -1.13 121.20 119.70 1fgt s ILE 83 Ca 0.58 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.85 1fgt s ILE 83 Cb -0.10 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.50 1fgt s ILE 83 CO 0.15 0.00 -0.20 -1.00 -1.91 0.00 0.00 174.94 171.98 1fgt s HIS 84 N 0.40 2.36 -0.16 3.50 3.76 -1.26 0.25 115.29 124.14 1fgt s HIS 84 Ca 0.00 -1.06 -0.08 0.00 -0.15 0.00 0.00 55.06 53.78 1fgt s HIS 84 Cb -0.05 -1.62 -0.04 0.00 1.11 0.00 0.00 32.58 31.98 1fgt s HIS 84 CO -0.01 -0.47 0.12 -0.06 -0.85 0.00 0.00 174.74 173.47 1fgt s PHE 85 N 0.63 3.46 -0.80 1.40 0.40 -0.21 -4.87 117.98 118.01 1fgt s PHE 85 Ca -0.13 0.38 -0.26 0.00 -0.60 0.00 0.00 56.93 56.33 1fgt s PHE 85 Cb -0.16 -2.04 0.02 0.00 0.51 0.00 0.00 43.02 41.35 1fgt s PHE 85 CO 0.03 0.48 1.42 -2.00 0.70 0.00 0.00 175.22 175.86 1fgt s GLU 86 N -0.31 3.18 -0.21 0.44 2.12 -1.26 -0.15 118.70 122.51 1fgt s GLU 86 Ca 0.11 -0.34 -0.05 0.00 0.36 0.00 0.00 54.97 55.05 1fgt s GLU 86 Cb -0.12 -4.52 0.11 0.00 0.26 0.00 0.00 34.13 29.86 1fgt s GLU 86 CO 0.01 -2.29 0.39 -0.46 -0.54 0.00 0.00 175.26 172.36 1fgt s TRP 87 N 6.18 -0.77 0.30 5.30 -0.11 -1.26 -4.77 118.94 123.81 1fgt s TRP 87 Ca 0.43 1.16 0.07 0.00 1.22 0.00 0.00 56.10 58.99 1fgt s TRP 87 Cb -0.07 0.14 -0.03 0.00 -1.50 0.00 0.00 33.47 32.02 1fgt s TRP 87 CO 0.09 -0.58 0.29 0.16 -4.62 0.00 0.00 176.95 172.30 1fgt s ASP 88 N 2.57 5.53 0.56 5.86 -4.77 -1.26 -4.53 116.67 120.62 1fgt s ASP 88 Ca 0.05 -0.34 0.38 0.00 -3.30 0.00 0.00 52.55 49.34 1fgt s ASP 88 Cb -0.14 -1.20 1.53 0.00 -1.09 0.00 0.00 42.92 42.02 1fgt s ASP 88 CO -0.14 -0.25 1.71 1.23 0.70 0.00 0.00 175.17 178.43 1fgt h GLY 89 N 1.26 0.00 2.00 2.12 0.00 -2.02 0.26 103.07 106.69 1fgt h GLY 89 Ca -0.46 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 1fgt h GLY 89 CO 0.58 0.00 -0.04 1.48 0.00 0.00 0.00 176.54 178.57 1fgt h SER 90 N 0.00 0.00 0.36 0.19 4.64 -2.05 -1.51 113.55 115.18 1fgt h SER 90 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 1fgt h SER 90 Cb 2.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.66 1fgt h SER 90 CO -0.01 0.04 -0.09 0.23 -0.87 0.00 0.00 176.83 176.13 1fgt n MET 91 N -3.24 0.69 0.00 4.77 2.81 0.08 -4.95 117.12 117.28 1fgt n MET 91 Ca -0.01 -0.21 0.00 0.00 -1.81 0.00 0.00 57.70 55.66 1fgt n MET 91 Cb 0.21 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.22 1fgt n MET 91 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1fgt n GLY 92 N 1.27 -1.68 3.57 3.03 0.00 -0.57 -4.14 105.19 106.66 1fgt n GLY 92 Ca 0.15 -1.58 -0.35 0.00 0.00 0.00 0.00 46.02 44.24 1fgt n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fgt s ILE 93 N 0.00 4.64 0.22 -0.61 1.01 -1.26 -4.79 121.20 120.41 1fgt s ILE 93 Ca 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 60.65 60.27 1fgt s ILE 93 Cb 0.00 -3.12 -0.10 0.00 0.01 0.00 0.00 42.46 39.25 1fgt s ILE 93 CO 0.00 0.42 1.46 -2.16 0.00 0.00 0.00 174.94 174.66 1fgt s PRO 94 N 0.78 4.26 0.00 2.79 0.04 -1.26 -0.89 135.00 140.72 1fgt s PRO 94 Ca 0.04 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1fgt s PRO 94 Cb -0.13 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1fgt s PRO 94 CO 0.02 -0.46 0.49 0.41 0.04 0.00 0.00 177.00 177.50 1fgt n GLY 95 N 2.64 -0.25 3.82 0.56 0.00 -0.30 -4.74 105.19 106.91 1fgt n GLY 95 Ca 0.09 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.08 1fgt n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fgt s ALA 96 N -0.19 -1.74 -0.02 4.61 0.00 -1.14 -1.28 121.76 122.01 1fgt s ALA 96 Ca 0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 51.96 51.62 1fgt s ALA 96 Cb 0.00 0.68 0.07 0.00 0.00 0.00 0.00 23.12 23.88 1fgt s ALA 96 CO 0.00 -1.06 0.69 -0.59 0.00 0.00 0.00 175.76 174.80 1fgt s PHE 97 N -2.55 -0.61 0.10 0.00 -0.12 -0.03 -0.29 117.98 114.47 1fgt s PHE 97 Ca 0.18 0.94 0.01 0.00 -0.05 0.00 0.00 56.93 58.01 1fgt s PHE 97 Cb -0.01 0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 1fgt s PHE 97 CO 0.03 -0.64 0.22 0.71 -0.05 0.00 0.00 175.22 175.49 1fgt s TYR 98 N -1.68 3.46 -0.05 3.49 2.02 0.31 -1.08 117.35 123.81 1fgt s TYR 98 Ca -0.08 0.17 -0.05 0.00 -0.37 0.00 0.00 57.07 56.75 1fgt s TYR 98 Cb -0.00 -1.70 0.01 0.00 -0.40 0.00 0.00 41.96 39.87 1fgt s TYR 98 CO 0.05 0.55 0.14 -1.50 -1.57 0.00 0.00 175.55 173.22 1fgt s ILE 99 N -1.59 -0.00 -0.07 2.71 2.07 -0.80 -1.08 121.20 122.44 1fgt s ILE 99 Ca 0.34 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.60 1fgt s ILE 99 Cb -0.12 -0.20 0.01 0.00 0.13 0.00 0.00 42.46 42.28 1fgt s ILE 99 CO 0.27 0.00 -0.11 -0.54 -1.91 0.00 0.00 174.94 172.65 1fgt s LYS 100 N 0.09 1.64 -0.30 3.50 1.02 -0.37 -3.85 119.74 121.48 1fgt s LYS 100 Ca -0.00 -0.38 -0.10 0.00 0.02 0.00 0.00 55.97 55.51 1fgt s LYS 100 Cb -0.01 -1.40 -0.03 0.00 -0.52 0.00 0.00 37.83 35.88 1fgt s LYS 100 CO 0.00 -0.01 0.16 1.21 -0.92 0.00 0.00 175.35 175.80 1fgt s ASN 101 N 0.78 5.71 0.00 2.83 2.47 -1.26 -1.94 114.94 123.54 1fgt s ASN 101 Ca -0.12 -0.29 0.23 0.00 0.42 0.00 0.00 52.86 53.10 1fgt s ASN 101 Cb -0.15 -2.05 0.22 0.00 -1.45 0.00 0.00 41.25 37.82 1fgt s ASN 101 CO 0.02 -0.13 1.22 -1.22 -3.72 0.00 0.00 177.10 173.27 1fgt n TYR 102 N 5.02 0.00 -1.40 0.43 4.01 0.13 -0.27 117.16 125.09 1fgt n TYR 102 Ca -0.14 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.29 1fgt n TYR 102 Cb 0.50 -0.16 0.09 0.00 -0.31 0.00 0.00 39.34 39.46 1fgt n TYR 102 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1fgt s MET 103 N -3.00 2.25 0.07 -0.72 -1.94 -1.24 -4.94 119.30 109.78 1fgt s MET 103 Ca 0.10 0.94 -0.15 0.00 -1.71 0.00 0.00 55.69 54.87 1fgt s MET 103 Cb 0.17 -1.91 -0.21 0.00 2.01 0.00 0.00 34.83 34.89 1fgt s MET 103 CO 0.76 -1.58 1.21 1.96 -0.01 0.00 0.00 175.02 177.36 1fgt h GLN 104 N -1.07 0.67 -6.30 2.03 1.08 -1.97 -3.40 115.11 106.14 1fgt h GLN 104 Ca -0.45 -0.64 -0.56 0.00 -1.45 0.00 0.00 58.65 55.54 1fgt h GLN 104 Cb 1.24 0.16 -0.04 0.00 -0.05 0.00 0.00 27.48 28.80 1fgt h GLN 104 CO 0.55 1.24 -0.05 0.08 -0.95 0.00 0.00 178.83 179.70 1fgt s VAL 105 N -3.47 4.79 0.64 -0.54 1.01 -1.26 -4.47 120.40 117.10 1fgt s VAL 105 Ca -0.11 1.02 -0.14 0.00 0.00 0.00 0.00 61.98 62.75 1fgt s VAL 105 Cb 0.07 -3.81 -0.01 0.00 0.00 0.00 0.00 36.38 32.63 1fgt s VAL 105 CO 0.89 0.36 1.06 -1.83 0.00 0.00 0.00 175.10 175.59 1fgt s GLU 106 N -1.62 3.09 0.11 2.72 1.03 -1.26 -4.77 118.70 118.00 1fgt s GLU 106 Ca 0.35 1.15 0.02 0.00 0.03 0.00 0.00 54.97 56.51 1fgt s GLU 106 Cb -0.17 -2.00 -0.04 0.00 -0.80 0.00 0.00 34.13 31.11 1fgt s GLU 106 CO 0.19 -0.99 -0.06 -0.59 -1.33 0.00 0.00 175.26 172.48 1fgt s PHE 107 N -2.64 0.97 -0.41 4.83 -0.12 -1.10 -3.85 117.98 115.67 1fgt s PHE 107 Ca 0.62 -0.91 -0.16 0.00 -0.05 0.00 0.00 56.93 56.43 1fgt s PHE 107 Cb -0.16 -0.55 0.02 0.00 -0.63 0.00 0.00 43.02 41.70 1fgt s PHE 107 CO 0.44 -0.13 0.38 0.12 -0.05 0.00 0.00 175.22 175.98 1fgt s PHE 108 N -3.59 3.20 -0.20 3.49 5.36 0.22 -1.17 117.98 125.28 1fgt s PHE 108 Ca 0.14 -0.40 -0.29 0.00 -0.96 0.00 0.00 56.93 55.41 1fgt s PHE 108 Cb 0.05 -2.76 0.00 0.00 -0.34 0.00 0.00 43.02 39.97 1fgt s PHE 108 CO -0.03 -0.63 1.09 -1.17 -1.46 0.00 0.00 175.22 173.02 1fgt s LEU 109 N 1.96 4.13 -0.16 6.12 2.96 0.41 -0.26 118.68 133.85 1fgt s LEU 109 Ca 0.10 1.47 -0.13 0.00 -0.22 0.00 0.00 54.13 55.34 1fgt s LEU 109 Cb -0.18 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.89 1fgt s LEU 109 CO 0.12 -0.67 -0.02 0.11 -1.32 0.00 0.00 176.35 174.58 1fgt h LYS 110 N 7.57 0.00 -2.65 1.98 1.79 -1.08 0.09 116.57 124.27 1fgt h LYS 110 Ca -0.22 0.00 0.12 0.00 -2.18 0.00 0.00 60.65 58.37 1fgt h LYS 110 Cb 1.08 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.65 1fgt h LYS 110 CO 0.96 0.35 0.36 -1.54 -1.08 0.00 0.00 179.45 178.51 1fgt s SER 111 N -6.10 -0.25 -0.03 0.86 1.04 -0.90 -1.20 113.70 107.13 1fgt s SER 111 Ca -0.19 -0.44 0.02 0.00 0.48 0.00 0.00 55.95 55.83 1fgt s SER 111 Cb 0.03 0.59 0.01 0.00 0.10 0.00 0.00 66.02 66.75 1fgt s SER 111 CO 0.34 -1.07 -0.07 -0.22 0.98 0.00 0.00 173.24 173.19 1fgt s LEU 112 N -2.89 1.71 -0.06 2.42 2.96 -1.01 -0.96 118.68 120.85 1fgt s LEU 112 Ca 0.11 -0.16 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 1fgt s LEU 112 Cb -0.03 -0.48 0.02 0.00 0.50 0.00 0.00 46.19 46.20 1fgt s LEU 112 CO 0.02 0.04 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.11 1fgt s THR 113 N 0.32 0.91 -0.13 3.68 2.01 -0.30 -0.99 115.64 121.15 1fgt s THR 113 Ca -0.05 -0.34 -0.01 0.00 0.31 0.00 0.00 61.69 61.61 1fgt s THR 113 Cb -0.09 -0.87 -0.02 0.00 0.01 0.00 0.00 72.50 71.53 1fgt s THR 113 CO 0.00 0.31 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.40 1fgt s LEU 114 N 0.84 3.00 -0.23 4.42 1.43 0.12 -0.98 118.68 127.29 1fgt s LEU 114 Ca -0.12 -0.19 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 1fgt s LEU 114 Cb -0.15 -1.69 0.05 0.00 0.03 0.00 0.00 46.19 44.43 1fgt s LEU 114 CO 0.01 0.20 -0.14 -1.61 0.23 0.00 0.00 176.35 175.05 1fgt s GLU 115 N 0.13 2.50 -0.01 1.70 2.02 -0.55 -1.14 118.70 123.36 1fgt s GLU 115 Ca -0.04 -1.17 0.05 0.00 0.02 0.00 0.00 54.97 53.83 1fgt s GLU 115 Cb -0.14 -2.78 -0.01 0.00 0.10 0.00 0.00 34.13 31.30 1fgt s GLU 115 CO 0.04 -0.44 -0.16 0.99 0.02 0.00 0.00 175.26 175.71 1fgt s THR 122 N 1.17 1.24 -0.19 3.63 2.01 -1.26 -4.57 115.64 117.67 1fgt s THR 122 Ca -0.04 -0.67 -0.00 0.00 0.31 0.00 0.00 61.69 61.29 1fgt s THR 122 Cb -0.18 -1.03 0.01 0.00 0.01 0.00 0.00 72.50 71.31 1fgt s THR 122 CO -0.08 0.35 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.42 1fgt s ILE 123 N -0.35 2.43 -0.02 1.82 1.01 -0.29 -5.11 121.20 120.68 1fgt s ILE 123 Ca 0.06 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.90 1fgt s ILE 123 Cb -0.06 -2.05 -0.03 0.00 0.01 0.00 0.00 42.46 40.32 1fgt s ILE 123 CO -0.01 0.51 -0.01 -0.13 0.00 0.00 0.00 174.94 175.30 1fgt s ARG 124 N 1.34 2.79 -0.13 2.79 0.52 -1.26 -0.70 118.95 124.29 1fgt s ARG 124 Ca 0.05 -0.59 -0.00 0.00 -0.52 0.00 0.00 55.73 54.67 1fgt s ARG 124 Cb -0.13 -2.66 0.02 0.00 0.52 0.00 0.00 34.95 32.70 1fgt s ARG 124 CO -0.10 0.64 -0.10 -0.06 0.02 0.00 0.00 175.30 175.69 1fgt s PHE 125 N -1.03 1.76 -0.36 -0.53 0.40 -0.16 -1.01 117.98 117.06 1fgt s PHE 125 Ca 0.18 -0.92 -0.11 0.00 -0.60 0.00 0.00 56.93 55.47 1fgt s PHE 125 Cb -0.11 -1.37 0.01 0.00 0.51 0.00 0.00 43.02 42.05 1fgt s PHE 125 CO 0.08 -0.57 0.21 0.08 0.70 0.00 0.00 175.22 175.72 1fgt s VAL 126 N 1.58 4.75 -0.17 -0.44 1.01 -1.26 -2.42 120.40 123.46 1fgt s VAL 126 Ca 0.04 -0.63 -0.14 0.00 0.00 0.00 0.00 61.98 61.26 1fgt s VAL 126 Cb -0.13 -3.55 -0.07 0.00 0.00 0.00 0.00 36.38 32.63 1fgt s VAL 126 CO -0.09 -0.13 -0.29 0.00 0.00 0.00 0.00 175.10 174.60 1fgt n ASN 128 N -4.21 -4.27 -3.81 0.00 3.02 -0.08 -4.95 115.26 100.96 1fgt n ASN 128 Ca -0.23 -1.27 -0.12 0.00 -0.03 0.00 0.00 54.58 52.93 1fgt n ASN 128 Cb 0.56 -1.78 -0.11 0.00 -0.61 0.00 0.00 39.78 37.84 1fgt n ASN 128 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1fgt s SER 129 N -3.49 -0.15 0.11 6.41 0.15 -0.60 -4.97 113.70 111.16 1fgt s SER 129 Ca 0.47 0.20 -0.30 0.00 0.70 0.00 0.00 55.95 57.02 1fgt s SER 129 Cb -0.25 0.36 -0.06 0.00 -1.71 0.00 0.00 66.02 64.36 1fgt s SER 129 CO 0.96 -0.22 1.07 0.26 1.20 0.00 0.00 173.24 176.52 1fgt s TRP 130 N -0.53 3.62 -0.31 3.44 0.52 -1.26 -0.44 118.94 123.97 1fgt s TRP 130 Ca -0.06 1.59 0.01 0.00 0.02 0.00 0.00 56.10 57.66 1fgt s TRP 130 Cb -0.04 -3.24 0.07 0.00 -1.15 0.00 0.00 33.47 29.12 1fgt s TRP 130 CO 0.01 -0.49 -0.00 0.08 0.02 0.00 0.00 176.95 176.56 1fgt s VAL 131 N 0.28 2.54 0.85 4.03 1.01 -0.31 -4.93 120.40 123.87 1fgt s VAL 131 Ca 0.51 -1.80 -0.12 0.00 0.00 0.00 0.00 61.98 60.57 1fgt s VAL 131 Cb -0.27 -2.61 0.13 0.00 0.00 0.00 0.00 36.38 33.63 1fgt s VAL 131 CO 0.32 -0.27 1.20 -0.31 0.00 0.00 0.00 175.10 176.03 1fgt s TYR 132 N 1.09 2.21 0.27 5.22 1.51 -1.26 -2.69 117.35 123.70 1fgt s TYR 132 Ca -0.01 0.40 -0.30 0.00 -1.01 0.00 0.00 57.07 56.15 1fgt s TYR 132 Cb -0.20 -3.67 -0.13 0.00 -0.11 0.00 0.00 41.96 37.85 1fgt s TYR 132 CO -0.05 -2.09 1.43 -1.71 -1.11 0.00 0.00 175.55 172.02 1fgt n ASN 133 N -3.40 3.01 -0.21 2.29 2.85 -1.26 -4.36 115.26 114.18 1fgt n ASN 133 Ca 0.12 1.16 0.30 0.00 -0.11 0.00 0.00 54.58 56.05 1fgt n ASN 133 Cb 0.60 -1.48 0.73 0.00 1.24 0.00 0.00 39.78 40.87 1fgt n ASN 133 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1fgt h THR 134 N 3.02 0.44 0.00 -0.44 1.03 -0.92 -0.32 112.91 115.72 1fgt h THR 134 Ca -0.46 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.94 1fgt h THR 134 Cb 1.27 0.48 0.00 0.00 -1.07 0.00 0.00 68.15 68.83 1fgt h THR 134 CO 0.74 0.00 0.00 0.11 -0.01 0.00 0.00 175.52 176.36 1fgt h LYS 135 N 0.00 0.00 0.00 0.00 1.57 -1.89 -2.90 116.57 113.35 1fgt h LYS 135 Ca 0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.24 1fgt h LYS 135 Cb 1.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.22 1fgt h LYS 135 CO -0.00 0.00 -0.15 1.28 -0.57 0.00 0.00 179.45 180.00 1fgt n LEU 136 N -2.69 0.64 -4.82 2.94 4.77 -0.13 -4.85 117.00 112.86 1fgt n LEU 136 Ca 0.02 0.46 -0.36 0.00 -0.03 0.00 0.00 56.01 56.10 1fgt n LEU 136 Cb 0.30 -0.32 -0.07 0.00 -2.33 0.00 0.00 43.42 41.01 1fgt n LEU 136 CO 0.25 -0.11 -0.16 -0.31 -1.33 0.00 0.00 177.39 175.74 1fgt s TYR 137 N -3.09 3.53 0.16 -1.77 2.02 -1.10 -4.99 117.35 112.12 1fgt s TYR 137 Ca 0.10 0.48 -0.07 0.00 -0.37 0.00 0.00 57.07 57.21 1fgt s TYR 137 Cb 0.14 -2.05 0.02 0.00 -0.40 0.00 0.00 41.96 39.68 1fgt s TYR 137 CO 0.62 0.56 1.47 -0.22 -1.57 0.00 0.00 175.55 176.40 1fgt h LYS 138 N 5.64 0.71 -4.93 -0.62 3.64 -1.88 -3.45 116.57 115.68 1fgt h LYS 138 Ca -0.49 -0.44 -0.34 0.00 -1.27 0.00 0.00 60.65 58.11 1fgt h LYS 138 Cb 1.20 0.05 -0.21 0.00 -0.41 0.00 0.00 32.23 32.86 1fgt h LYS 138 CO 0.65 1.07 -0.75 -1.54 -2.27 0.00 0.00 179.45 176.61 1fgt s SER 139 N -6.93 1.26 0.31 4.20 1.04 -1.26 -5.13 113.70 107.19 1fgt s SER 139 Ca -0.09 -0.61 -0.29 0.00 0.48 0.00 0.00 55.95 55.44 1fgt s SER 139 Cb 0.11 -0.00 -0.11 0.00 0.10 0.00 0.00 66.02 66.12 1fgt s SER 139 CO 0.86 -0.16 1.51 -0.69 0.98 0.00 0.00 173.24 175.75 1fgt s VAL 140 N -1.48 2.24 0.26 5.02 1.01 -1.26 -4.93 120.40 121.27 1fgt s VAL 140 Ca -0.05 0.22 -0.31 0.00 0.00 0.00 0.00 61.98 61.84 1fgt s VAL 140 Cb -0.09 -3.14 -0.11 0.00 0.00 0.00 0.00 36.38 33.04 1fgt s VAL 140 CO 0.01 0.04 1.62 -0.13 0.00 0.00 0.00 175.10 176.64 1fgt s ARG 141 N -0.96 4.14 -0.02 2.72 1.81 -1.25 -4.90 118.95 120.50 1fgt s ARG 141 Ca 0.59 2.56 0.05 0.00 -1.72 0.00 0.00 55.73 57.21 1fgt s ARG 141 Cb -0.46 -3.05 -0.01 0.00 -0.45 0.00 0.00 34.95 30.98 1fgt s ARG 141 CO 0.51 -0.65 -0.18 -1.50 -0.68 0.00 0.00 175.30 172.80 1fgt s ILE 142 N 0.36 1.42 0.04 1.52 2.07 -1.26 -1.91 121.20 123.43 1fgt s ILE 142 Ca 0.66 -0.77 0.06 0.00 -1.41 0.00 0.00 60.65 59.19 1fgt s ILE 142 Cb -0.48 -1.18 -0.02 0.00 0.13 0.00 0.00 42.46 40.91 1fgt s ILE 142 CO 0.43 0.40 -0.17 -0.36 -1.91 0.00 0.00 174.94 173.33 1fgt s PHE 143 N -0.39 1.45 0.20 3.50 0.08 -0.24 -4.98 117.98 117.59 1fgt s PHE 143 Ca 0.06 -0.35 0.06 0.00 0.12 0.00 0.00 56.93 56.83 1fgt s PHE 143 Cb -0.07 -0.86 -0.04 0.00 -0.57 0.00 0.00 43.02 41.47 1fgt s PHE 143 CO -0.01 0.05 0.12 -0.06 -0.10 0.00 0.00 175.22 175.23 1fgt s PHE 144 N -0.79 3.05 0.85 0.36 0.40 -1.26 -0.85 117.98 119.73 1fgt s PHE 144 Ca 0.04 -0.09 -0.11 0.00 -0.60 0.00 0.00 56.93 56.18 1fgt s PHE 144 Cb -0.08 -1.43 0.10 0.00 0.51 0.00 0.00 43.02 42.13 1fgt s PHE 144 CO 0.01 0.53 1.10 0.00 0.70 0.00 0.00 175.22 177.56 1fgt s ALA 145 N -1.92 1.82 -0.98 5.36 0.00 -0.40 -4.39 121.76 121.24 1fgt s ALA 145 Ca 0.31 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1fgt s ALA 145 Cb -0.09 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1fgt s ALA 145 CO 0.23 -2.18 0.33 0.27 0.00 0.00 0.00 175.76 174.41 1fgt n ASN 146 N -3.79 0.67 -4.82 0.00 6.94 -0.18 -4.86 115.26 109.21 1fgt n ASN 146 Ca 0.09 -1.30 -0.33 0.00 -0.02 0.00 0.00 54.58 53.02 1fgt n ASN 146 Cb 0.54 -0.32 -0.03 0.00 -2.36 0.00 0.00 39.78 37.60 1fgt n ASN 146 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 1fgt s HIS 147 N -0.98 3.24 -0.14 -2.53 3.76 -1.26 -1.56 115.29 115.82 1fgt s HIS 147 Ca 0.00 1.52 -0.02 0.00 -0.15 0.00 0.00 55.06 56.41 1fgt s HIS 147 Cb 0.00 -2.90 -0.02 0.00 1.11 0.00 0.00 32.58 30.77 1fgt s HIS 147 CO 0.00 -0.59 -0.09 0.99 -0.85 0.00 0.00 174.74 174.20 1fgt s THR 148 N -2.41 3.41 -0.09 1.30 2.01 -1.26 -4.78 115.64 113.82 1fgt s THR 148 Ca 0.62 -0.53 -0.03 0.00 0.31 0.00 0.00 61.69 62.05 1fgt s THR 148 Cb -0.12 -2.46 0.05 0.00 0.01 0.00 0.00 72.50 69.98 1fgt s THR 148 CO 0.28 0.51 0.14 -0.31 -0.69 0.00 0.00 174.62 174.55 1fgt s TYR 149 N 0.32 -0.10 0.77 4.92 2.02 -0.15 -4.95 117.35 120.18 1fgt s TYR 149 Ca -0.08 0.43 -0.15 0.00 -0.37 0.00 0.00 57.07 56.90 1fgt s TYR 149 Cb -0.15 -0.35 -0.02 0.00 -0.40 0.00 0.00 41.96 41.04 1fgt s TYR 149 CO 0.04 -0.30 0.55 1.33 -1.57 0.00 0.00 175.55 175.60 1fgt n VAL 150 N 5.32 1.47 -0.18 0.71 0.24 -1.26 -3.90 118.33 120.72 1fgt n VAL 150 Ca -0.04 -0.35 -0.01 0.00 -2.04 0.00 0.00 64.34 61.90 1fgt n VAL 150 Cb 0.50 -0.75 0.06 0.00 -1.47 0.00 0.00 33.84 32.18 1fgt n VAL 150 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1fgt h PRO 151 N -0.63 0.05 0.00 7.34 0.11 -1.97 -0.43 132.00 136.47 1fgt h PRO 151 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1fgt h PRO 151 Cb 1.33 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1fgt h PRO 151 CO 0.41 0.03 0.00 -1.13 -0.21 0.00 0.00 178.00 177.10 1fgt n SER 152 N -5.33 0.06 -0.60 -2.05 3.41 -1.26 -1.41 113.62 106.43 1fgt n SER 152 Ca 0.07 0.52 0.07 0.00 -0.26 0.00 0.00 58.87 59.27 1fgt n SER 152 Cb 0.31 -0.53 0.09 0.00 -0.26 0.00 0.00 64.21 63.82 1fgt n SER 152 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1fgt n GLU 153 N -1.57 1.40 -1.99 4.33 -0.58 -0.18 -4.99 120.64 117.06 1fgt n GLU 153 Ca 0.00 -1.54 -0.42 0.00 -0.42 0.00 0.00 57.16 54.79 1fgt n GLU 153 Cb 0.02 -1.28 -0.03 0.00 -0.57 0.00 0.00 31.44 29.59 1fgt n GLU 153 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1fgt s THR 154 N -1.08 2.77 0.29 2.62 2.01 -0.50 -4.90 115.64 116.84 1fgt s THR 154 Ca 0.19 0.55 -0.30 0.00 0.31 0.00 0.00 61.69 62.45 1fgt s THR 154 Cb 0.12 -3.36 -0.13 0.00 0.01 0.00 0.00 72.50 69.15 1fgt s THR 154 CO 0.17 0.05 1.41 -2.65 -0.69 0.00 0.00 174.62 172.91 1fgt n PRO 155 N 3.89 2.24 -0.33 4.92 -0.02 -1.26 -4.79 135.00 139.65 1fgt n PRO 155 Ca 0.13 0.79 0.18 0.00 -2.02 0.00 0.00 63.50 62.58 1fgt n PRO 155 Cb 0.39 -2.45 0.39 0.00 -0.02 0.00 0.00 33.50 31.81 1fgt n PRO 155 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fgt h ALA 156 N 3.67 1.74 0.00 3.55 0.00 -1.91 0.34 119.26 126.65 1fgt h ALA 156 Ca -0.46 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1fgt h ALA 156 Cb 1.27 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1fgt h ALA 156 CO 0.71 -0.37 0.00 -2.30 0.00 0.00 0.00 179.25 177.29 1fgt n PRO 157 N -4.98 0.04 0.00 0.00 -0.02 -1.26 -2.89 135.00 125.89 1fgt n PRO 157 Ca 0.27 0.30 0.06 0.00 -2.02 0.00 0.00 63.50 62.11 1fgt n PRO 157 Cb 0.79 -1.57 -0.01 0.00 -0.02 0.00 0.00 33.50 32.68 1fgt n PRO 157 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1fgt n LEU 158 N -1.64 1.23 -0.02 2.45 4.77 0.09 -0.42 117.00 123.47 1fgt n LEU 158 Ca 0.03 -0.72 -0.09 0.00 -0.03 0.00 0.00 56.01 55.20 1fgt n LEU 158 Cb 0.17 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.23 1fgt n LEU 158 CO 0.14 0.25 0.76 0.58 -1.33 0.00 0.00 177.39 177.79 1fgt h VAL 159 N 1.14 0.59 -0.47 4.08 2.07 -1.38 0.58 116.25 122.87 1fgt h VAL 159 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 1fgt h VAL 159 Cb 0.40 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1fgt h VAL 159 CO 0.00 0.00 -0.13 -1.28 0.02 0.00 0.00 177.57 176.18 1fgt h SER 160 N -0.17 0.87 -0.76 0.57 0.87 -1.84 -2.04 113.55 111.05 1fgt h SER 160 Ca 0.11 -0.28 -0.03 0.00 -1.23 0.00 0.00 61.79 60.36 1fgt h SER 160 Cb 0.32 -0.24 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 1fgt h SER 160 CO -0.27 1.01 0.38 1.88 -0.53 0.00 0.00 176.83 179.29 1fgt h TYR 161 N 0.78 1.10 0.09 2.24 0.05 -1.76 0.84 116.97 120.31 1fgt h TYR 161 Ca 0.12 -0.05 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 1fgt h TYR 161 Cb 0.65 -0.34 0.00 0.00 1.01 0.00 0.00 36.73 38.05 1fgt h TYR 161 CO 0.04 0.79 -0.04 -0.09 -1.05 0.00 0.00 178.16 177.80 1fgt h ARG 162 N 1.10 -0.12 -0.31 4.88 2.43 -0.51 -1.83 114.38 120.02 1fgt h ARG 162 Ca 0.27 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.33 1fgt h ARG 162 Cb 0.10 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1fgt h ARG 162 CO -0.04 -0.02 -0.29 1.49 -1.51 0.00 0.00 179.97 179.60 1fgt h GLU 163 N -0.19 0.64 -0.52 0.20 4.57 -1.11 -2.79 114.58 115.38 1fgt h GLU 163 Ca -0.01 -0.28 -0.08 0.00 -1.18 0.00 0.00 59.36 57.82 1fgt h GLU 163 Cb 0.16 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 1fgt h GLU 163 CO 0.02 0.86 0.02 0.93 -1.18 0.00 0.00 179.01 179.66 1fgt h GLU 164 N 0.55 0.87 -0.68 1.92 4.39 -0.75 -0.41 114.58 120.46 1fgt h GLU 164 Ca 0.07 -0.24 -0.08 0.00 0.34 0.00 0.00 59.36 59.45 1fgt h GLU 164 Cb 0.78 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.30 1fgt h GLU 164 CO 0.06 0.85 0.11 1.49 -1.16 0.00 0.00 179.01 180.37 1fgt h GLU 165 N 0.81 1.13 -0.53 2.33 4.57 -1.21 0.02 114.58 121.69 1fgt h GLU 165 Ca 0.16 -0.30 -0.05 0.00 -1.18 0.00 0.00 59.36 57.99 1fgt h GLU 165 Cb 0.46 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.89 1fgt h GLU 165 CO 0.02 1.02 0.14 -0.07 -1.18 0.00 0.00 179.01 178.94 1fgt h LEU 166 N 1.05 0.80 -1.40 1.64 3.38 -1.19 -1.15 115.31 118.44 1fgt h LEU 166 Ca 0.21 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1fgt h LEU 166 Cb 0.44 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1fgt h LEU 166 CO 0.01 0.82 0.22 0.11 0.09 0.00 0.00 178.44 179.69 1fgt h LYS 167 N 0.74 0.62 -0.62 1.13 1.57 -0.66 -1.72 116.57 117.64 1fgt h LYS 167 Ca 0.17 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.80 1fgt h LYS 167 Cb 0.33 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1fgt h LYS 167 CO 0.00 0.49 0.07 1.03 -0.57 0.00 0.00 179.45 180.47 1fgt h SER 168 N 0.63 1.00 0.52 0.86 0.87 -0.42 -2.74 113.55 114.27 1fgt h SER 168 Ca 0.16 -0.28 -0.05 0.00 -1.23 0.00 0.00 61.79 60.39 1fgt h SER 168 Cb 0.07 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1fgt h SER 168 CO -0.02 1.03 -0.25 -0.07 -0.53 0.00 0.00 176.83 176.99 1fgt h LEU 169 N 0.95 0.00 0.00 2.23 3.38 -0.41 -3.08 115.31 118.38 1fgt h LEU 169 Ca 0.18 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 1fgt h LEU 169 Cb 0.47 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1fgt h LEU 169 CO 0.02 0.25 -0.75 0.03 0.09 0.00 0.00 178.44 178.08 1fgt h ARG 170 N 0.00 0.00 0.00 1.13 3.08 -1.06 0.77 114.38 118.31 1fgt h ARG 170 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1fgt h ARG 170 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1fgt h ARG 170 CO 0.03 0.50 0.00 0.41 -1.07 0.00 0.00 179.97 179.84 1fgt n GLY 171 N 1.27 -0.06 0.07 0.04 0.00 -1.10 -4.34 105.19 101.08 1fgt n GLY 171 Ca -0.01 -0.97 0.05 0.00 0.00 0.00 0.00 46.02 45.09 1fgt n GLY 171 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1fgt n ASN 172 N -2.36 2.23 0.00 1.61 0.23 -1.26 -4.98 115.26 110.73 1fgt n ASN 172 Ca 0.00 -2.49 0.00 0.00 -0.53 0.00 0.00 54.58 51.56 1fgt n ASN 172 Cb 0.00 -0.20 0.00 0.00 -2.08 0.00 0.00 39.78 37.50 1fgt n ASN 172 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1fgt n GLY 173 N -0.87 0.48 3.27 4.83 0.00 -1.26 -5.01 105.19 106.63 1fgt n GLY 173 Ca 0.08 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.95 1fgt n GLY 173 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fgt s THR 174 N -2.09 0.87 0.00 2.61 -4.23 -1.26 -5.11 115.64 106.44 1fgt s THR 174 Ca 0.00 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.50 1fgt s THR 174 Cb 0.00 -2.16 0.00 0.00 1.34 0.00 0.00 72.50 71.68 1fgt s THR 174 CO 0.00 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 1fgt n GLY 175 N -0.30 0.48 3.67 3.99 0.00 -1.26 -4.94 105.19 106.83 1fgt n GLY 175 Ca -0.06 -1.63 -0.43 0.00 0.00 0.00 0.00 46.02 43.90 1fgt n GLY 175 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1fgt s GLU 176 N -3.74 4.30 0.25 1.61 2.12 -1.22 -4.39 118.70 117.62 1fgt s GLU 176 Ca 0.00 1.28 -0.30 0.00 0.36 0.00 0.00 54.97 56.31 1fgt s GLU 176 Cb 0.00 -3.61 -0.09 0.00 0.26 0.00 0.00 34.13 30.69 1fgt s GLU 176 CO 0.00 -0.50 1.15 1.03 -0.54 0.00 0.00 175.26 176.40 1fgt s ARG 177 N 2.73 4.56 0.26 4.30 1.81 -0.66 -5.03 118.95 126.93 1fgt s ARG 177 Ca 0.43 1.87 0.08 0.00 -1.72 0.00 0.00 55.73 56.39 1fgt s ARG 177 Cb -0.16 -3.20 -0.04 0.00 -0.45 0.00 0.00 34.95 31.11 1fgt s ARG 177 CO 0.10 0.07 0.15 0.15 -0.68 0.00 0.00 175.30 175.09 1fgt s LYS 178 N -1.07 2.74 0.28 3.54 -0.14 -1.26 -4.89 119.74 118.94 1fgt s LYS 178 Ca 0.48 -1.18 0.00 0.00 -1.36 0.00 0.00 55.97 53.91 1fgt s LYS 178 Cb -0.33 -2.44 0.65 0.00 -1.68 0.00 0.00 37.83 34.03 1fgt s LYS 178 CO 0.41 0.36 1.64 1.49 -0.76 0.00 0.00 175.35 178.49 1fgt h GLU 179 N 1.58 0.18 -0.01 1.68 4.81 -1.96 -0.51 114.58 120.35 1fgt h GLU 179 Ca -0.47 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1fgt h GLU 179 Cb 1.24 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1fgt h GLU 179 CO 0.61 0.12 -0.07 2.48 -0.73 0.00 0.00 179.01 181.42 1fgt n TYR 180 N -5.25 0.00 -1.87 0.92 0.18 -1.26 -4.09 117.16 105.79 1fgt n TYR 180 Ca 0.20 0.00 -0.35 0.00 1.88 0.00 0.00 57.90 59.63 1fgt n TYR 180 Cb 0.64 -0.07 0.04 0.00 -0.38 0.00 0.00 39.34 39.57 1fgt n TYR 180 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1fgt s ASP 181 N -2.21 5.08 -0.37 9.48 1.01 -0.20 -4.74 116.67 124.72 1fgt s ASP 181 Ca 0.35 2.23 0.12 0.00 0.71 0.00 0.00 52.55 55.96 1fgt s ASP 181 Cb 0.21 -2.58 0.45 0.00 1.01 0.00 0.00 42.92 42.00 1fgt s ASP 181 CO 0.41 -1.66 1.03 0.54 0.21 0.00 0.00 175.17 175.70 1fgt n ARG 182 N -1.99 2.23 -3.85 8.23 1.74 -1.26 -1.06 116.66 120.70 1fgt n ARG 182 Ca 0.12 -3.83 -0.36 0.00 -0.77 0.00 0.00 57.85 53.02 1fgt n ARG 182 Cb 0.51 -1.72 -0.12 0.00 -1.02 0.00 0.00 32.46 30.10 1fgt n ARG 182 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1fgt s ILE 183 N -4.23 4.31 -0.23 0.55 1.01 -1.26 -4.46 121.20 116.89 1fgt s ILE 183 Ca 0.37 -0.18 -0.08 0.00 0.00 0.00 0.00 60.65 60.76 1fgt s ILE 183 Cb 0.43 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 1fgt s ILE 183 CO -0.06 0.37 0.08 -0.31 0.00 0.00 0.00 174.94 175.02 1fgt s TYR 184 N 1.35 3.15 0.31 3.97 1.51 0.27 -4.60 117.35 123.30 1fgt s TYR 184 Ca 0.05 -0.20 -0.15 0.00 -1.01 0.00 0.00 57.07 55.76 1fgt s TYR 184 Cb -0.15 -2.21 0.02 0.00 -0.11 0.00 0.00 41.96 39.52 1fgt s TYR 184 CO 0.03 -0.18 0.64 0.34 -1.11 0.00 0.00 175.55 175.27 1fgt s ASP 185 N 1.25 0.01 0.19 2.29 -1.08 -1.26 -4.53 116.67 113.55 1fgt s ASP 185 Ca 0.05 -0.96 0.06 0.00 -0.52 0.00 0.00 52.55 51.19 1fgt s ASP 185 Cb -0.14 0.71 -0.04 0.00 -1.46 0.00 0.00 42.92 41.99 1fgt s ASP 185 CO 0.04 -1.37 0.10 -0.31 0.52 0.00 0.00 175.17 174.15 1fgt s TYR 186 N -3.41 3.03 0.18 -5.34 1.51 -1.26 -0.98 117.35 111.08 1fgt s TYR 186 Ca 0.18 -0.08 -0.23 0.00 -1.01 0.00 0.00 57.07 55.93 1fgt s TYR 186 Cb -0.03 -1.43 0.06 0.00 -0.11 0.00 0.00 41.96 40.44 1fgt s TYR 186 CO 0.11 0.53 0.66 0.34 -1.11 0.00 0.00 175.55 176.07 1fgt s ASP 187 N -3.24 -0.46 0.80 2.29 -1.08 -0.30 -4.45 116.67 110.23 1fgt s ASP 187 Ca 0.30 -0.18 -0.10 0.00 -0.52 0.00 0.00 52.55 52.06 1fgt s ASP 187 Cb -0.09 0.62 0.11 0.00 -1.46 0.00 0.00 42.92 42.10 1fgt s ASP 187 CO 0.22 -1.05 1.14 0.68 0.52 0.00 0.00 175.17 176.68 1fgt s VAL 188 N -3.74 2.12 -1.24 1.11 -7.23 -1.26 -1.06 120.40 109.08 1fgt s VAL 188 Ca 0.04 -0.18 -0.13 0.00 -1.81 0.00 0.00 61.98 59.90 1fgt s VAL 188 Cb -0.02 -2.94 0.15 0.00 0.56 0.00 0.00 36.38 34.13 1fgt s VAL 188 CO -0.07 0.00 1.59 -1.22 -0.31 0.00 0.00 175.10 175.09 1fgt n TYR 189 N -3.24 4.49 -0.88 2.82 4.02 -0.38 -4.57 117.16 119.41 1fgt n TYR 189 Ca 0.11 -3.17 0.08 0.00 -0.01 0.00 0.00 57.90 54.91 1fgt n TYR 189 Cb 0.60 -2.21 0.17 0.00 -0.02 0.00 0.00 39.34 37.89 1fgt n TYR 189 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1fgt n ASN 190 N 5.61 2.90 -0.35 7.72 6.94 -1.26 -2.01 115.26 134.81 1fgt n ASN 190 Ca 0.39 -2.89 0.05 0.00 -0.02 0.00 0.00 54.58 52.12 1fgt n ASN 190 Cb 0.42 -0.42 0.12 0.00 -2.36 0.00 0.00 39.78 37.54 1fgt n ASN 190 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1fgt n ASP 191 N -0.89 2.68 -0.02 0.53 5.75 -1.26 -0.83 116.55 122.52 1fgt n ASP 191 Ca 0.16 -2.44 -0.17 0.00 -0.01 0.00 0.00 54.79 52.33 1fgt n ASP 191 Cb 0.68 -0.26 -0.14 0.00 -1.03 0.00 0.00 41.12 40.37 1fgt n ASP 191 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1fgt n LEU 192 N -0.45 2.04 -4.82 -2.12 4.77 -1.26 -4.92 117.00 110.25 1fgt n LEU 192 Ca 0.11 0.24 -0.30 0.00 -0.03 0.00 0.00 56.01 56.02 1fgt n LEU 192 Cb 0.51 -0.66 0.08 0.00 -2.33 0.00 0.00 43.42 41.01 1fgt n LEU 192 CO 0.05 0.71 0.72 -0.83 -1.33 0.00 0.00 177.39 176.71 1fgt s GLY 193 N -5.51 1.63 -0.40 -0.72 0.00 -1.26 -0.94 107.32 100.12 1fgt s GLY 193 Ca -0.18 -0.19 0.11 0.00 0.00 0.00 0.00 44.72 44.46 1fgt s GLY 193 CO 0.78 0.22 0.75 -2.01 0.00 0.00 0.00 173.10 172.83 1fgt n ASN 194 N -3.34 1.32 0.24 1.64 5.15 -0.06 -4.89 115.26 115.33 1fgt n ASN 194 Ca 0.07 -3.09 0.14 0.00 -0.60 0.00 0.00 54.58 51.10 1fgt n ASN 194 Cb 0.56 -0.61 0.80 0.00 -0.53 0.00 0.00 39.78 40.00 1fgt n ASN 194 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1fgt h PRO 195 N 3.05 0.00 0.00 1.20 0.13 -1.72 -1.80 132.00 132.86 1fgt h PRO 195 Ca 0.10 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.19 1fgt h PRO 195 Cb 0.90 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1fgt h PRO 195 CO 0.54 0.00 -0.22 -0.44 -0.23 0.00 0.00 178.00 177.66 1fgt h ASP 196 N 0.00 0.00 0.42 1.44 5.19 -1.95 -2.87 116.42 118.65 1fgt h ASP 196 Ca 0.04 0.00 -0.31 0.00 -0.62 0.00 0.00 57.03 56.14 1fgt h ASP 196 Cb 0.20 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 1fgt h ASP 196 CO -0.00 0.22 -1.58 0.50 -3.12 0.00 0.00 179.24 175.25 1fgt h LYS 197 N 0.00 0.24 -1.47 3.56 3.64 -1.76 -3.48 116.57 117.30 1fgt h LYS 197 Ca -0.00 -0.42 0.10 0.00 -1.27 0.00 0.00 60.65 59.06 1fgt h LYS 197 Cb 0.61 0.16 -0.28 0.00 -0.41 0.00 0.00 32.23 32.31 1fgt h LYS 197 CO 0.03 1.10 0.54 0.45 -2.27 0.00 0.00 179.45 179.29 1fgt s SER 198 N -6.95 -0.37 0.17 4.20 0.15 -1.08 -5.00 113.70 104.82 1fgt s SER 198 Ca -0.10 0.69 0.19 0.00 0.70 0.00 0.00 55.95 57.43 1fgt s SER 198 Cb 0.07 0.77 0.83 0.00 -1.71 0.00 0.00 66.02 65.98 1fgt s SER 198 CO 0.85 -0.12 1.58 -1.84 1.20 0.00 0.00 173.24 174.91 1fgt n GLU 199 N 2.30 0.12 0.20 5.44 0.28 -1.25 -1.06 120.64 126.68 1fgt n GLU 199 Ca -0.13 0.40 0.14 0.00 -0.16 0.00 0.00 57.16 57.42 1fgt n GLU 199 Cb 0.56 -1.75 0.53 0.00 1.43 0.00 0.00 31.44 32.21 1fgt n GLU 199 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 1fgt h LYS 200 N 0.00 0.00 -0.68 3.44 1.57 -1.92 -2.49 116.57 116.48 1fgt h LYS 200 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fgt h LYS 200 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1fgt h LYS 200 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 1fgt n LEU 201 N -2.73 3.79 -4.78 2.94 4.77 -0.22 -4.93 117.00 115.85 1fgt n LEU 201 Ca 0.02 -1.90 -0.37 0.00 -0.03 0.00 0.00 56.01 53.73 1fgt n LEU 201 Cb 0.32 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.89 1fgt n LEU 201 CO 0.26 0.90 0.73 0.00 -1.33 0.00 0.00 177.39 177.94 1fgt s ALA 202 N -1.19 3.18 0.02 -1.18 0.00 -0.94 -0.88 121.76 120.77 1fgt s ALA 202 Ca 0.46 0.71 0.01 0.00 0.00 0.00 0.00 51.96 53.14 1fgt s ALA 202 Cb 0.25 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 1fgt s ALA 202 CO 0.30 -0.12 -0.04 1.03 0.00 0.00 0.00 175.76 176.92 1fgt s ARG 203 N -2.18 0.36 0.46 0.00 1.81 -1.26 -4.93 118.95 113.20 1fgt s ARG 203 Ca 0.53 -0.59 -0.24 0.00 -1.72 0.00 0.00 55.73 53.72 1fgt s ARG 203 Cb -0.23 -0.05 -0.07 0.00 -0.45 0.00 0.00 34.95 34.14 1fgt s ARG 203 CO 0.30 -0.01 1.28 -1.25 -0.68 0.00 0.00 175.30 174.94 1fgt s PRO 204 N -1.31 3.67 0.07 3.54 0.04 -1.26 -4.78 135.00 134.97 1fgt s PRO 204 Ca -0.12 2.07 -0.31 0.00 0.04 0.00 0.00 61.00 62.68 1fgt s PRO 204 Cb -0.09 -2.51 -0.06 0.00 0.04 0.00 0.00 34.50 31.88 1fgt s PRO 204 CO -0.00 -0.71 1.28 0.08 0.04 0.00 0.00 177.00 177.68 1fgt s VAL 205 N -1.36 3.76 -0.29 -0.36 1.01 -1.26 -4.91 120.40 116.99 1fgt s VAL 205 Ca 0.63 1.26 -0.10 0.00 0.00 0.00 0.00 61.98 63.77 1fgt s VAL 205 Cb -0.36 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 1fgt s VAL 205 CO 0.44 0.09 0.16 -0.76 0.00 0.00 0.00 175.10 175.04 1fgt s LEU 206 N 1.18 4.03 0.00 3.92 1.43 -0.85 -4.83 118.68 123.56 1fgt s LEU 206 Ca 0.61 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 1fgt s LEU 206 Cb -0.32 -2.05 0.00 0.00 0.03 0.00 0.00 46.19 43.85 1fgt s LEU 206 CO 0.29 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.36 1fgt n GLY 207 N 5.02 3.03 1.95 -3.19 0.00 0.14 -1.25 105.19 110.89 1fgt n GLY 207 Ca -0.14 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1fgt n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fgt n GLY 208 N 0.07 0.68 3.15 -0.02 0.00 -1.26 -4.85 105.19 102.98 1fgt n GLY 208 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1fgt n GLY 208 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fgt s SER 209 N -2.31 0.27 0.35 1.61 1.04 -1.26 -5.04 113.70 108.37 1fgt s SER 209 Ca 0.00 -0.78 0.19 0.00 0.48 0.00 0.00 55.95 55.84 1fgt s SER 209 Cb 0.00 0.28 0.45 0.00 0.10 0.00 0.00 66.02 66.84 1fgt s SER 209 CO 0.00 -0.66 1.62 0.77 0.98 0.00 0.00 173.24 175.95 1fgt h SER 210 N 2.97 0.00 -0.16 7.02 4.64 -1.97 -2.80 113.55 123.24 1fgt h SER 210 Ca -0.34 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.89 1fgt h SER 210 Cb 1.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1fgt h SER 210 CO 0.60 0.38 -0.26 0.74 -0.87 0.00 0.00 176.83 177.41 1fgt h THR 211 N 0.00 1.35 -2.53 2.95 2.02 -2.00 -3.38 112.91 111.32 1fgt h THR 211 Ca -0.00 -1.49 -0.60 0.00 0.77 0.00 0.00 66.41 65.09 1fgt h THR 211 Cb 1.09 1.92 -0.41 0.00 -1.74 0.00 0.00 68.15 69.01 1fgt h THR 211 CO 0.05 0.45 -0.73 0.49 0.37 0.00 0.00 175.52 176.15 1fgt n PHE 212 N -4.41 2.09 -2.24 3.16 3.72 -1.19 -4.87 117.46 113.71 1fgt n PHE 212 Ca -0.06 -3.97 -0.34 0.00 -0.05 0.00 0.00 57.45 53.02 1fgt n PHE 212 Cb 0.45 -0.40 -0.00 0.00 -0.94 0.00 0.00 39.48 38.58 1fgt n PHE 212 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1fgt s PRO 213 N -1.45 3.41 -0.20 -1.08 0.04 -1.06 0.28 135.00 134.94 1fgt s PRO 213 Ca 0.32 1.44 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 1fgt s PRO 213 Cb 0.06 -2.03 0.14 0.00 0.04 0.00 0.00 34.50 32.72 1fgt s PRO 213 CO -0.12 -0.77 1.10 -0.47 0.04 0.00 0.00 177.00 176.77 1fgt s TYR 214 N -2.02 -0.28 0.66 0.56 5.04 -1.26 -4.44 117.35 115.61 1fgt s TYR 214 Ca 0.69 0.49 -0.17 0.00 -2.44 0.00 0.00 57.07 55.63 1fgt s TYR 214 Cb -0.20 0.46 -0.00 0.00 0.35 0.00 0.00 41.96 42.57 1fgt s TYR 214 CO 0.28 -0.26 1.25 -2.14 -1.34 0.00 0.00 175.55 173.35 1fgt s PRO 215 N -1.05 2.54 0.66 4.97 0.02 -1.26 -4.64 135.00 136.23 1fgt s PRO 215 Ca 0.01 1.93 -0.08 0.00 0.02 0.00 0.00 61.00 62.88 1fgt s PRO 215 Cb -0.01 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.67 1fgt s PRO 215 CO -0.01 -1.57 1.00 1.03 -0.33 0.00 0.00 177.00 177.11 1fgt s ARG 216 N -3.50 2.75 0.40 5.54 1.81 -0.30 -4.76 118.95 120.89 1fgt s ARG 216 Ca 0.79 0.13 0.03 0.00 -1.72 0.00 0.00 55.73 54.97 1fgt s ARG 216 Cb -0.34 -2.15 -0.03 0.00 -0.45 0.00 0.00 34.95 31.98 1fgt s ARG 216 CO 0.40 -0.94 0.10 -0.98 -0.68 0.00 0.00 175.30 173.19 1fgt s ARG 217 N -5.19 1.90 0.13 3.54 1.04 -0.23 -4.13 118.95 116.02 1fgt s ARG 217 Ca 0.57 -2.15 -0.31 0.00 -1.04 0.00 0.00 55.73 52.80 1fgt s ARG 217 Cb -0.11 -0.78 -0.09 0.00 -2.04 0.00 0.00 34.95 31.93 1fgt s ARG 217 CO 0.48 -0.40 1.44 0.20 -0.04 0.00 0.00 175.30 176.98 1fgt s GLY 218 N -3.61 1.86 0.24 3.88 0.00 -1.26 -1.15 107.32 107.27 1fgt s GLY 218 Ca 0.24 1.19 -0.30 0.00 0.00 0.00 0.00 44.72 45.86 1fgt s GLY 218 CO 0.13 2.43 1.33 -1.60 0.00 0.00 0.00 173.10 175.39 1fgt s ARG 219 N 1.11 4.36 -0.05 2.90 3.52 -0.15 -4.71 118.95 125.93 1fgt s ARG 219 Ca 0.66 2.13 0.04 0.00 -0.13 0.00 0.00 55.73 58.44 1fgt s ARG 219 Cb -0.39 -3.15 -0.06 0.00 -1.56 0.00 0.00 34.95 29.79 1fgt s ARG 219 CO 0.31 -0.26 0.02 0.25 -0.81 0.00 0.00 175.30 174.80 1fgt n THR 220 N 2.20 0.34 -2.63 4.11 -2.24 -1.26 -4.80 114.28 110.01 1fgt n THR 220 Ca 0.05 -0.21 -0.19 0.00 -2.27 0.00 0.00 64.05 61.42 1fgt n THR 220 Cb 0.42 -0.86 0.01 0.00 -2.10 0.00 0.00 70.33 67.80 1fgt n THR 220 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fgt n GLY 221 N 2.69 -0.40 0.18 3.38 0.00 -1.26 -1.65 105.19 108.12 1fgt n GLY 221 Ca -0.08 -0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.04 1fgt n GLY 221 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1fgt h ARG 222 N -0.58 0.00 0.00 1.61 3.08 -1.91 -3.23 114.38 113.35 1fgt h ARG 222 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1fgt h ARG 222 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.38 1fgt h ARG 222 CO 0.52 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.83 1fgt n GLY 223 N -0.02 0.92 3.81 0.04 0.00 -1.26 -4.77 105.19 103.91 1fgt n GLY 223 Ca 0.02 -1.93 -0.32 0.00 0.00 0.00 0.00 46.02 43.78 1fgt n GLY 223 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fgt s PRO 224 N -2.03 3.12 0.90 1.61 0.04 -1.26 -0.74 135.00 136.64 1fgt s PRO 224 Ca 0.00 1.11 -0.12 0.00 0.04 0.00 0.00 61.00 62.03 1fgt s PRO 224 Cb 0.00 -2.01 0.13 0.00 0.04 0.00 0.00 34.50 32.66 1fgt s PRO 224 CO 0.00 -0.96 1.12 0.95 0.04 0.00 0.00 177.00 178.15 1fgt s THR 225 N -2.69 2.31 0.13 1.26 -4.23 -0.14 -4.30 115.64 107.98 1fgt s THR 225 Ca 0.61 0.10 -0.09 0.00 -1.18 0.00 0.00 61.69 61.13 1fgt s THR 225 Cb -0.15 -2.79 -0.13 0.00 1.34 0.00 0.00 72.50 70.77 1fgt s THR 225 CO 0.44 -0.13 1.36 0.58 -0.54 0.00 0.00 174.62 176.33 1fgt h VAL 226 N -1.47 1.30 0.00 2.29 2.07 -1.97 -3.31 116.25 115.16 1fgt h VAL 226 Ca -0.50 -1.98 0.00 0.00 0.82 0.00 0.00 66.70 65.04 1fgt h VAL 226 Cb 1.31 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 1fgt h VAL 226 CO 0.60 0.62 -0.64 0.71 0.02 0.00 0.00 177.57 178.88 1fgt h THR 227 N 0.49 0.00 -2.53 2.57 1.35 -1.93 -3.45 112.91 109.41 1fgt h THR 227 Ca -0.04 -0.66 -0.33 0.00 -0.55 0.00 0.00 66.41 64.83 1fgt h THR 227 Cb 1.34 1.28 -0.36 0.00 -1.73 0.00 0.00 68.15 68.68 1fgt h THR 227 CO 0.15 0.00 -0.64 -0.62 -0.25 0.00 0.00 175.52 174.16 1fgt s ASP 228 N -4.70 1.49 0.35 5.36 2.15 -1.25 -5.01 116.67 115.07 1fgt s ASP 228 Ca 0.05 -0.30 0.25 0.00 0.43 0.00 0.00 52.55 52.97 1fgt s ASP 228 Cb 0.12 0.35 1.27 0.00 -0.30 0.00 0.00 42.92 44.35 1fgt s ASP 228 CO 0.73 -0.33 1.75 1.55 -0.17 0.00 0.00 175.17 178.69 1fgt h PRO 229 N 8.32 0.00 -0.01 4.34 0.13 -1.88 -1.98 132.00 140.92 1fgt h PRO 229 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1fgt h PRO 229 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1fgt h PRO 229 CO 0.29 0.00 -0.34 0.09 -0.23 0.00 0.00 178.00 177.81 1fgt n ASN 230 N -2.36 1.47 -4.44 1.44 5.03 -1.26 -4.77 115.26 110.37 1fgt n ASN 230 Ca -0.01 -1.17 -0.33 0.00 0.87 0.00 0.00 54.58 53.94 1fgt n ASN 230 Cb 0.08 0.28 -0.13 0.00 -1.02 0.00 0.00 39.78 38.98 1fgt n ASN 230 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1fgt s THR 231 N -2.48 3.05 0.09 3.41 2.01 -0.75 -4.82 115.64 116.16 1fgt s THR 231 Ca 0.22 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 61.21 1fgt s THR 231 Cb 0.19 -2.22 -0.05 0.00 0.01 0.00 0.00 72.50 70.42 1fgt s THR 231 CO 0.54 0.57 1.01 -0.70 -0.69 0.00 0.00 174.62 175.35 1fgt s GLU 232 N -0.39 4.62 0.85 4.92 2.12 -0.01 -0.97 118.70 129.85 1fgt s GLU 232 Ca 0.04 1.52 -0.12 0.00 0.36 0.00 0.00 54.97 56.78 1fgt s GLU 232 Cb -0.12 -3.38 0.11 0.00 0.26 0.00 0.00 34.13 31.00 1fgt s GLU 232 CO 0.02 0.08 1.18 -1.59 -0.54 0.00 0.00 175.26 174.41 1fgt s LYS 233 N 0.29 1.37 0.74 4.30 -2.85 0.08 -4.69 119.74 118.99 1fgt s LYS 233 Ca 0.50 1.68 -0.13 0.00 -1.00 0.00 0.00 55.97 57.01 1fgt s LYS 233 Cb -0.24 -1.75 0.05 0.00 -2.06 0.00 0.00 37.83 33.82 1fgt s LYS 233 CO 0.30 -2.40 1.15 -0.65 0.10 0.00 0.00 175.35 173.85 1fgt s GLN 234 N -4.35 2.18 -0.05 1.78 -1.52 -1.26 -4.89 119.66 111.56 1fgt s GLN 234 Ca 0.71 1.52 -0.12 0.00 -1.95 0.00 0.00 55.36 55.52 1fgt s GLN 234 Cb -0.26 -1.86 0.02 0.00 -0.22 0.00 0.00 33.01 30.69 1fgt s GLN 234 CO 0.54 -1.75 0.27 0.20 -0.25 0.00 0.00 175.29 174.29 1fgt s GLY 235 N -2.52 -0.14 0.30 3.09 0.00 -1.26 -5.03 107.32 101.76 1fgt s GLY 235 Ca 0.69 0.44 0.05 0.00 0.00 0.00 0.00 44.72 45.90 1fgt s GLY 235 CO 0.48 0.28 1.73 0.83 0.00 0.00 0.00 173.10 176.41 1fgt h GLU 236 N 4.66 0.31 -4.34 2.90 5.08 -2.05 -3.41 114.58 117.73 1fgt h GLU 236 Ca -0.28 -0.13 -0.50 0.00 -1.00 0.00 0.00 59.36 57.44 1fgt h GLU 236 Cb 1.18 -0.01 -0.35 0.00 0.50 0.00 0.00 28.75 30.08 1fgt h GLU 236 CO 0.37 0.62 -0.80 0.08 -1.00 0.00 0.00 179.01 178.28 1fgt s VAL 237 N -4.30 0.99 -0.42 3.13 1.01 -1.26 -5.10 120.40 114.45 1fgt s VAL 237 Ca -0.05 -0.35 -0.21 0.00 0.00 0.00 0.00 61.98 61.37 1fgt s VAL 237 Cb 0.14 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.58 1fgt s VAL 237 CO 0.77 0.34 0.66 -0.36 0.00 0.00 0.00 175.10 176.51 1fgt s PHE 238 N 1.08 3.07 0.51 5.22 0.40 -1.26 -5.02 117.98 121.98 1fgt s PHE 238 Ca -0.07 0.05 -0.23 0.00 -0.60 0.00 0.00 56.93 56.08 1fgt s PHE 238 Cb -0.14 -3.34 -0.06 0.00 0.51 0.00 0.00 43.02 39.98 1fgt s PHE 238 CO -0.01 -0.83 1.39 0.98 0.70 0.00 0.00 175.22 177.45 1fgt n TYR 239 N 6.27 2.48 -4.02 0.36 4.19 -1.26 -4.86 117.16 120.32 1fgt n TYR 239 Ca -0.01 0.43 -0.11 0.00 3.31 0.00 0.00 57.90 61.52 1fgt n TYR 239 Cb 0.48 -2.40 -0.11 0.00 0.49 0.00 0.00 39.34 37.79 1fgt n TYR 239 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 1fgt s VAL 240 N -1.25 0.31 0.24 2.97 -7.23 -1.26 -4.84 120.40 109.34 1fgt s VAL 240 Ca 0.68 -0.94 -0.30 0.00 -1.81 0.00 0.00 61.98 59.61 1fgt s VAL 240 Cb -0.43 -0.41 -0.15 0.00 0.56 0.00 0.00 36.38 35.95 1fgt s VAL 240 CO 0.52 -0.41 1.02 -2.65 -0.31 0.00 0.00 175.10 173.27 1fgt n PRO 241 N 1.62 1.13 -0.30 4.82 -0.02 -1.26 -4.79 135.00 136.20 1fgt n PRO 241 Ca -0.23 0.40 0.06 0.00 -2.02 0.00 0.00 63.50 61.72 1fgt n PRO 241 Cb 0.55 -1.78 0.16 0.00 -0.02 0.00 0.00 33.50 32.41 1fgt n PRO 241 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1fgt h ARG 242 N 2.40 0.03 0.00 -0.52 9.65 -1.24 0.53 114.38 125.23 1fgt h ARG 242 Ca -0.40 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.48 1fgt h ARG 242 Cb 1.35 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.93 1fgt h ARG 242 CO 0.64 0.02 0.00 -0.25 2.80 0.00 0.00 179.97 183.17 1fgt n ASP 243 N -5.50 0.00 0.13 -3.80 8.00 -1.26 -1.62 116.55 112.50 1fgt n ASP 243 Ca 0.15 -0.21 0.12 0.00 0.71 0.00 0.00 54.79 55.57 1fgt n ASP 243 Cb 0.52 -0.21 0.24 0.00 -0.02 0.00 0.00 41.12 41.64 1fgt n ASP 243 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1fgt h GLU 244 N 0.00 0.00 -4.98 -1.24 4.39 -1.20 -3.41 114.58 108.14 1fgt h GLU 244 Ca 0.00 0.00 -0.68 0.00 0.34 0.00 0.00 59.36 59.02 1fgt h GLU 244 Cb 0.16 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 28.63 1fgt h GLU 244 CO 0.00 0.00 0.45 1.21 -1.16 0.00 0.00 179.01 179.51 1fgt s ASN 245 N -5.01 6.34 -0.01 1.42 2.47 -0.64 -4.31 114.94 115.20 1fgt s ASN 245 Ca 0.07 -1.53 -0.30 0.00 0.42 0.00 0.00 52.86 51.52 1fgt s ASN 245 Cb 0.10 -2.36 -0.06 0.00 -1.45 0.00 0.00 41.25 37.48 1fgt s ASN 245 CO 0.67 -1.18 1.55 -0.76 -3.72 0.00 0.00 177.10 173.66 1fgt s LEU 246 N 2.98 4.32 0.55 3.21 1.43 -1.26 -5.02 118.68 124.89 1fgt s LEU 246 Ca 0.21 2.23 -0.05 0.00 -1.03 0.00 0.00 54.13 55.49 1fgt s LEU 246 Cb -0.16 -3.55 -0.01 0.00 0.03 0.00 0.00 46.19 42.51 1fgt s LEU 246 CO 0.02 -0.84 0.85 -0.83 0.23 0.00 0.00 176.35 175.79 1fgt s GLY 247 N 2.52 1.57 0.01 -3.19 0.00 -1.26 -5.04 107.32 101.93 1fgt s GLY 247 Ca 0.69 -0.65 0.01 0.00 0.00 0.00 0.00 44.72 44.77 1fgt s GLY 247 CO 0.28 -0.41 -0.03 0.30 0.00 0.00 0.00 173.10 173.24 1fgt s HIS 248 N -2.89 0.24 0.23 1.90 0.09 -1.21 -5.03 115.29 108.63 1fgt s HIS 248 Ca 0.51 -0.17 -0.01 0.00 -0.00 0.00 0.00 55.06 55.39 1fgt s HIS 248 Cb -0.10 -0.16 0.25 0.00 -0.00 0.00 0.00 32.58 32.56 1fgt s HIS 248 CO 0.45 -0.05 1.61 -0.07 -0.00 0.00 0.00 174.74 176.69 1fgt h LEU 249 N 5.67 0.58 -8.77 0.89 3.38 -1.87 -3.40 115.31 111.79 1fgt h LEU 249 Ca -0.28 -0.25 -0.64 0.00 0.09 0.00 0.00 57.88 56.81 1fgt h LEU 249 Cb 1.20 -0.16 -0.22 0.00 0.09 0.00 0.00 40.66 41.57 1fgt h LEU 249 CO 0.48 0.90 -0.66 -0.54 0.09 0.00 0.00 178.44 178.71 1fgt s LYS 250 N -4.30 3.65 0.48 1.13 1.02 -1.26 -4.91 119.74 115.56 1fgt s LYS 250 Ca -0.07 -0.52 0.14 0.00 0.02 0.00 0.00 55.97 55.54 1fgt s LYS 250 Cb 0.13 -3.01 1.14 0.00 -0.52 0.00 0.00 37.83 35.56 1fgt s LYS 250 CO 0.82 0.12 2.10 1.03 -0.92 0.00 0.00 175.35 178.50 1fgt h SER 251 N 7.12 0.17 0.40 2.83 0.87 -1.98 -0.13 113.55 122.83 1fgt h SER 251 Ca -0.34 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 1fgt h SER 251 Cb 1.18 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1fgt h SER 251 CO 0.62 0.12 0.00 0.07 -0.53 0.00 0.00 176.83 177.11 1fgt h LYS 252 N 0.20 0.00 -0.01 2.24 2.10 -1.96 -1.69 116.57 117.45 1fgt h LYS 252 Ca 0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.73 1fgt h LYS 252 Cb 0.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.41 1fgt h LYS 252 CO -0.01 0.00 -0.19 -0.25 -2.00 0.00 0.00 179.45 177.00 1fgt n ASP 253 N -2.48 0.99 -2.71 7.07 8.00 -0.06 -4.30 116.55 123.05 1fgt n ASP 253 Ca -0.00 -0.93 -0.28 0.00 0.71 0.00 0.00 54.79 54.30 1fgt n ASP 253 Cb 0.15 0.08 -0.07 0.00 -0.02 0.00 0.00 41.12 41.25 1fgt n ASP 253 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fgt n ALA 254 N -0.58 6.73 -0.24 2.24 0.00 -0.64 -4.70 120.51 123.32 1fgt n ALA 254 Ca 0.14 -3.01 0.18 0.00 0.00 0.00 0.00 53.44 50.76 1fgt n ALA 254 Cb 0.33 -2.57 0.50 0.00 0.00 0.00 0.00 19.45 17.72 1fgt n ALA 254 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1fgt h LEU 255 N 5.18 0.42 -2.89 0.00 3.38 -1.83 -1.59 115.31 117.98 1fgt h LEU 255 Ca 0.49 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.50 1fgt h LEU 255 Cb 0.78 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 1fgt h LEU 255 CO 0.99 0.17 0.01 1.05 0.09 0.00 0.00 178.44 180.75 1fgt h GLU 256 N 0.43 0.00 0.00 1.13 9.09 -1.90 -0.77 114.58 122.55 1fgt h GLU 256 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.87 1fgt h GLU 256 Cb 1.12 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.22 1fgt h GLU 256 CO -0.18 0.00 -0.11 0.44 0.05 0.00 0.00 179.01 179.22 1fgt n ILE 257 N -3.22 0.30 -0.31 -1.06 -5.35 -0.60 -4.01 119.36 105.12 1fgt n ILE 257 Ca -0.03 -0.16 -0.01 0.00 -0.27 0.00 0.00 62.75 62.29 1fgt n ILE 257 Cb 0.08 -0.44 0.12 0.00 -1.74 0.00 0.00 39.64 37.66 1fgt n ILE 257 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1fgt h GLY 258 N 4.74 1.25 1.43 3.28 0.00 -1.28 -2.53 103.07 109.95 1fgt h GLY 258 Ca 0.00 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 46.86 1fgt h GLY 258 CO 0.00 0.32 -0.00 -0.91 0.00 0.00 0.00 176.54 175.95 1fgt h THR 259 N 1.02 1.23 -0.29 4.70 1.35 -1.76 0.14 112.91 119.29 1fgt h THR 259 Ca 0.35 -0.94 -0.03 0.00 -0.55 0.00 0.00 66.41 65.24 1fgt h THR 259 Cb 0.07 0.90 -0.01 0.00 -1.73 0.00 0.00 68.15 67.38 1fgt h THR 259 CO -0.14 0.33 0.06 0.50 -0.25 0.00 0.00 175.52 176.02 1fgt h LYS 260 N 0.66 0.48 -0.63 4.72 3.64 -1.72 0.84 116.57 124.56 1fgt h LYS 260 Ca 0.13 -0.12 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 1fgt h LYS 260 Cb 0.41 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1fgt h LYS 260 CO 0.02 0.57 0.03 0.77 -2.27 0.00 0.00 179.45 178.57 1fgt h SER 261 N 0.31 1.06 -0.04 4.20 0.02 -1.17 -0.06 113.55 117.88 1fgt h SER 261 Ca 0.09 -0.29 -0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1fgt h SER 261 Cb 0.32 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.57 1fgt h SER 261 CO 0.00 1.09 0.02 0.25 -1.14 0.00 0.00 176.83 177.06 1fgt h LEU 262 N 1.00 0.04 -0.24 5.07 5.85 -0.48 0.23 115.31 126.78 1fgt h LEU 262 Ca 0.18 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 1fgt h LEU 262 Cb 0.53 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1fgt h LEU 262 CO 0.03 0.13 -0.13 -1.28 -0.34 0.00 0.00 178.44 176.84 1fgt h SER 263 N -0.04 0.54 0.92 1.25 0.87 -0.72 0.18 113.55 116.55 1fgt h SER 263 Ca 0.01 -0.42 -0.22 0.00 -1.23 0.00 0.00 61.79 59.93 1fgt h SER 263 Cb 0.09 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 1fgt h SER 263 CO -0.00 0.84 -1.12 1.56 -0.53 0.00 0.00 176.83 177.58 1fgt h GLN 264 N 0.24 0.00 0.00 2.24 4.20 -1.00 -3.39 115.11 117.40 1fgt h GLN 264 Ca 0.05 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 1fgt h GLN 264 Cb 0.65 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 1fgt h GLN 264 CO 0.04 0.86 -1.23 -0.89 -0.67 0.00 0.00 178.83 176.94 1fgt n ILE 265 N -3.27 0.36 -0.05 2.54 5.41 0.71 -4.71 119.36 120.35 1fgt n ILE 265 Ca -0.03 -0.05 -0.13 0.00 1.00 0.00 0.00 62.75 63.54 1fgt n ILE 265 Cb 0.95 -1.58 -0.07 0.00 -0.71 0.00 0.00 39.64 38.22 1fgt n ILE 265 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1fgt h VAL 266 N -0.19 1.35 -0.28 1.39 2.07 -1.23 -3.03 116.25 116.32 1fgt h VAL 266 Ca -0.13 -1.31 0.06 0.00 0.82 0.00 0.00 66.70 66.14 1fgt h VAL 266 Cb 1.06 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 32.66 1fgt h VAL 266 CO -0.08 0.38 -0.08 -0.61 0.02 0.00 0.00 177.57 177.21 1fgt h GLN 267 N -0.02 -0.01 -0.91 1.57 4.15 -0.84 -0.18 115.11 118.88 1fgt h GLN 267 Ca 0.02 0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.47 1fgt h GLN 267 Cb 0.68 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.32 1fgt h GLN 267 CO 0.04 -0.01 0.60 -1.35 -1.93 0.00 0.00 178.83 176.17 1fgt h PRO 268 N -0.01 1.12 -0.55 -2.39 0.11 -1.78 0.15 132.00 128.64 1fgt h PRO 268 Ca 0.14 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.15 1fgt h PRO 268 Cb 0.22 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.05 1fgt h PRO 268 CO -0.30 0.74 0.23 0.00 -0.21 0.00 0.00 178.00 178.46 1fgt h ALA 269 N 1.46 0.71 -0.30 -0.75 0.00 -1.18 -1.30 119.26 117.91 1fgt h ALA 269 Ca 0.36 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1fgt h ALA 269 Cb -0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1fgt h ALA 269 CO -0.10 0.32 0.13 0.74 0.00 0.00 0.00 179.25 180.33 1fgt h PHE 270 N 0.75 0.45 -0.86 0.00 0.04 -0.29 -2.82 116.94 114.20 1fgt h PHE 270 Ca 0.18 -0.03 0.08 0.00 2.80 0.00 0.00 57.97 61.00 1fgt h PHE 270 Cb 0.19 -0.14 -0.06 0.00 2.20 0.00 0.00 35.95 38.14 1fgt h PHE 270 CO 0.01 0.42 0.56 0.93 -0.60 0.00 0.00 178.31 179.63 1fgt h GLU 271 N 0.34 0.87 -0.59 1.51 5.08 -0.70 -1.57 114.58 119.53 1fgt h GLU 271 Ca 0.10 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 1fgt h GLU 271 Cb 0.16 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1fgt h GLU 271 CO -0.01 0.58 0.04 0.66 -1.00 0.00 0.00 179.01 179.28 1fgt h SER 272 N 0.90 0.95 -0.39 1.42 4.64 -1.00 0.53 113.55 120.60 1fgt h SER 272 Ca 0.38 -0.24 0.01 0.00 -0.47 0.00 0.00 61.79 61.47 1fgt h SER 272 Cb 0.31 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 1fgt h SER 272 CO -0.15 0.98 0.26 0.00 -0.87 0.00 0.00 176.83 177.05 1fgt h ALA 273 N 1.12 1.75 0.22 5.18 0.00 -1.09 -0.19 119.26 126.26 1fgt h ALA 273 Ca 0.17 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.75 1fgt h ALA 273 Cb 0.47 -0.15 0.03 0.00 0.00 0.00 0.00 17.79 18.15 1fgt h ALA 273 CO 0.02 0.23 -1.36 0.74 0.00 0.00 0.00 179.25 178.87 1fgt h PHE 274 N 0.50 0.86 -0.34 0.00 -1.00 -1.11 -1.18 116.94 114.68 1fgt h PHE 274 Ca 0.15 -0.63 -0.04 0.00 2.81 0.00 0.00 57.97 60.26 1fgt h PHE 274 Cb -0.02 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.48 1fgt h PHE 274 CO -0.00 1.52 0.06 -0.44 -1.61 0.00 0.00 178.31 177.84 1fgt h ASP 275 N 0.02 0.46 -0.02 2.17 3.32 -0.50 -1.09 116.42 120.77 1fgt h ASP 275 Ca -0.24 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1fgt h ASP 275 Cb 2.05 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 41.48 1fgt h ASP 275 CO 0.24 0.49 0.00 0.18 -1.72 0.00 0.00 179.24 178.42 1fgt n LEU 276 N -4.33 0.95 -3.70 1.55 4.77 -0.12 -4.94 117.00 111.19 1fgt n LEU 276 Ca 0.02 -0.33 -0.24 0.00 -0.03 0.00 0.00 56.01 55.43 1fgt n LEU 276 Cb 0.20 -0.01 0.05 0.00 -2.33 0.00 0.00 43.42 41.33 1fgt n LEU 276 CO 0.38 0.16 0.09 0.29 -1.33 0.00 0.00 177.39 176.98 1fgt n LYS 277 N -0.24 -6.07 0.00 3.23 5.02 -0.41 -4.89 118.16 114.80 1fgt n LYS 277 Ca 0.20 0.70 0.12 0.00 -2.02 0.00 0.00 58.31 57.31 1fgt n LYS 277 Cb 0.26 -5.55 0.23 0.00 -0.02 0.00 0.00 35.03 29.95 1fgt n LYS 277 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1fgt n SER 278 N -3.00 0.92 -3.77 4.39 7.64 -0.46 -4.88 113.62 114.47 1fgt n SER 278 Ca -0.13 -0.72 -0.13 0.00 1.01 0.00 0.00 58.87 58.90 1fgt n SER 278 Cb 0.61 0.32 -0.09 0.00 -1.01 0.00 0.00 64.21 64.03 1fgt n SER 278 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1fgt s THR 279 N -2.75 0.05 0.41 0.44 -1.32 -1.25 -4.88 115.64 106.34 1fgt s THR 279 Ca 0.17 -0.44 -0.26 0.00 -1.21 0.00 0.00 61.69 59.95 1fgt s THR 279 Cb 0.18 -0.58 -0.10 0.00 -1.51 0.00 0.00 72.50 70.49 1fgt s THR 279 CO 0.64 -0.24 1.30 -2.65 -2.21 0.00 0.00 174.62 171.46 1fgt n PRO 280 N 1.48 2.03 0.09 7.08 -0.02 -1.26 -4.84 135.00 139.57 1fgt n PRO 280 Ca -0.21 0.72 -0.03 0.00 -2.02 0.00 0.00 63.50 61.96 1fgt n PRO 280 Cb 0.56 -2.41 0.17 0.00 -0.02 0.00 0.00 33.50 31.80 1fgt n PRO 280 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1fgt h ILE 281 N 2.22 1.36 -3.10 4.25 1.08 -1.98 -3.45 117.51 117.88 1fgt h ILE 281 Ca -0.48 -1.80 -0.54 0.00 -0.39 0.00 0.00 64.86 61.65 1fgt h ILE 281 Cb 1.29 1.88 -0.17 0.00 -3.07 0.00 0.00 36.82 36.75 1fgt h ILE 281 CO 0.61 0.53 -0.78 -1.61 -0.69 0.00 0.00 178.15 176.21 1fgt s GLU 282 N -3.91 1.36 0.34 2.37 0.41 -1.26 -4.23 118.70 113.78 1fgt s GLU 282 Ca -0.04 -1.49 -0.26 0.00 -0.41 0.00 0.00 54.97 52.77 1fgt s GLU 282 Cb 0.13 -1.43 -0.09 0.00 -1.78 0.00 0.00 34.13 30.95 1fgt s GLU 282 CO 0.78 0.28 1.03 -0.06 -0.49 0.00 0.00 175.26 176.81 1fgt s PHE 283 N -2.17 3.51 -0.17 1.61 0.08 -1.26 -4.95 117.98 114.63 1fgt s PHE 283 Ca 0.19 1.71 0.10 0.00 0.12 0.00 0.00 56.93 59.05 1fgt s PHE 283 Cb -0.05 -3.11 -0.13 0.00 -0.57 0.00 0.00 43.02 39.15 1fgt s PHE 283 CO 0.08 -0.33 0.28 0.72 -0.10 0.00 0.00 175.22 175.87 1fgt n HIS 284 N 0.55 0.00 -3.85 0.36 8.25 -1.26 -4.87 115.22 114.40 1fgt n HIS 284 Ca 0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.39 1fgt n HIS 284 Cb 0.48 -0.14 -0.06 0.00 1.12 0.00 0.00 29.99 31.38 1fgt n HIS 284 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1fgt s SER 285 N -2.68 -0.01 0.38 0.41 1.04 -1.26 -4.21 113.70 107.36 1fgt s SER 285 Ca -0.01 -0.67 0.04 0.00 0.48 0.00 0.00 55.95 55.79 1fgt s SER 285 Cb 0.07 0.43 0.73 0.00 0.10 0.00 0.00 66.02 67.35 1fgt s SER 285 CO 0.40 -0.85 2.02 -0.26 0.98 0.00 0.00 173.24 175.53 1fgt h PHE 286 N 2.54 0.66 0.00 5.02 0.04 -1.96 -1.62 116.94 121.62 1fgt h PHE 286 Ca -0.32 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.45 1fgt h PHE 286 Cb 1.23 -0.22 -0.00 0.00 2.20 0.00 0.00 35.95 39.16 1fgt h PHE 286 CO 0.39 0.43 -0.04 0.37 -0.60 0.00 0.00 178.31 178.86 1fgt h GLN 287 N 0.70 0.00 -0.11 1.51 5.75 -1.99 -0.55 115.11 120.43 1fgt h GLN 287 Ca 0.19 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.65 1fgt h GLN 287 Cb -0.06 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.49 1fgt h GLN 287 CO -0.04 0.04 -0.09 -0.44 -2.65 0.00 0.00 178.83 175.65 1fgt h ASP 288 N 0.00 0.15 0.01 -0.69 3.32 -1.70 0.47 116.42 117.99 1fgt h ASP 288 Ca -0.00 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.93 1fgt h ASP 288 Cb 0.07 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.58 1fgt h ASP 288 CO 0.00 0.27 -0.37 0.58 -1.72 0.00 0.00 179.24 178.01 1fgt h VAL 289 N 0.16 1.53 -0.36 -1.35 2.07 -1.18 -3.25 116.25 113.87 1fgt h VAL 289 Ca 0.04 -2.05 0.05 0.00 0.82 0.00 0.00 66.70 65.55 1fgt h VAL 289 Cb 0.27 2.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.82 1fgt h VAL 289 CO 0.01 0.57 0.25 0.45 0.02 0.00 0.00 177.57 178.87 1fgt h HIS 290 N -0.42 0.28 -0.51 1.57 3.86 -0.95 -1.24 115.15 117.74 1fgt h HIS 290 Ca -0.05 0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.28 1fgt h HIS 290 Cb 1.13 -0.09 -0.03 0.00 1.06 0.00 0.00 27.41 29.49 1fgt h HIS 290 CO 0.18 0.16 0.35 -0.44 0.86 0.00 0.00 177.93 179.04 1fgt h ASP 291 N 0.28 0.18 -0.72 2.45 3.32 -0.94 -2.56 116.42 118.44 1fgt h ASP 291 Ca 0.16 0.01 0.16 0.00 0.02 0.00 0.00 57.03 57.37 1fgt h ASP 291 Cb 0.27 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 1fgt h ASP 291 CO -0.03 0.11 0.49 -0.07 -1.72 0.00 0.00 179.24 178.01 1fgt h LEU 292 N 0.20 0.28 -2.83 1.55 3.38 -1.32 0.27 115.31 116.83 1fgt h LEU 292 Ca 0.24 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1fgt h LEU 292 Cb 0.68 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1fgt h LEU 292 CO -0.04 0.14 0.00 0.00 0.09 0.00 0.00 178.44 178.63 1fgt n TYR 293 N -4.45 0.47 0.00 1.13 0.18 -0.97 -0.71 117.16 112.81 1fgt n TYR 293 Ca 0.14 -0.48 0.00 0.00 1.88 0.00 0.00 57.90 59.43 1fgt n TYR 293 Cb 0.58 -0.02 0.00 0.00 -0.38 0.00 0.00 39.34 39.52 1fgt n TYR 293 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1fgt n GLU 294 N 0.57 0.00 0.24 -3.48 1.02 -0.51 -4.53 120.64 113.95 1fgt n GLU 294 Ca 0.12 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.39 1fgt n GLU 294 Cb 0.43 0.00 0.41 0.00 -0.02 0.00 0.00 31.44 32.26 1fgt n GLU 294 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1fgt h GLY 295 N 0.00 0.00 0.00 0.62 0.00 -1.84 -3.49 103.07 98.36 1fgt h GLY 295 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1fgt h GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1fgt n GLY 296 N 0.54 -1.74 3.28 4.60 0.00 0.82 -4.87 105.19 107.83 1fgt n GLY 296 Ca 0.02 -1.97 -0.30 0.00 0.00 0.00 0.00 46.02 43.77 1fgt n GLY 296 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1fgt s ILE 297 N 0.00 1.95 -0.18 -0.61 2.07 0.15 -4.42 121.20 120.17 1fgt s ILE 297 Ca 0.00 -1.04 -0.17 0.00 -1.41 0.00 0.00 60.65 58.02 1fgt s ILE 297 Cb 0.00 -1.62 -0.04 0.00 0.13 0.00 0.00 42.46 40.93 1fgt s ILE 297 CO 0.00 0.55 0.46 -0.54 -1.91 0.00 0.00 174.94 173.50 1fgt s LYS 298 N -0.47 4.22 0.23 3.50 1.02 -1.26 -1.54 119.74 125.44 1fgt s LYS 298 Ca 0.06 0.34 0.06 0.00 0.02 0.00 0.00 55.97 56.45 1fgt s LYS 298 Cb -0.10 -3.52 -0.05 0.00 -0.52 0.00 0.00 37.83 33.64 1fgt s LYS 298 CO 0.00 -0.02 -0.07 -0.51 -0.92 0.00 0.00 175.35 173.83 1fgt s LEU 299 N 1.24 2.42 0.44 3.17 1.43 0.12 -4.85 118.68 122.65 1fgt s LEU 299 Ca 0.23 -1.14 -0.25 0.00 -1.03 0.00 0.00 54.13 51.94 1fgt s LEU 299 Cb -0.15 -0.50 -0.09 0.00 0.03 0.00 0.00 46.19 45.48 1fgt s LEU 299 CO 0.09 -0.36 1.22 -2.65 0.23 0.00 0.00 176.35 174.89 1fgt n PRO 300 N -0.45 1.77 -0.20 1.29 -0.02 -1.26 -4.56 135.00 131.57 1fgt n PRO 300 Ca -0.06 0.63 0.01 0.00 -2.02 0.00 0.00 63.50 62.05 1fgt n PRO 300 Cb 0.63 -2.33 0.10 0.00 -0.02 0.00 0.00 33.50 31.87 1fgt n PRO 300 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fgt h ARG 301 N 1.87 0.12 0.00 -0.52 3.08 -1.93 0.12 114.38 117.11 1fgt h ARG 301 Ca -0.48 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 59.54 1fgt h ARG 301 Cb 1.31 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.33 1fgt h ARG 301 CO 0.59 0.08 -0.11 0.38 -1.07 0.00 0.00 179.97 179.83 1fgt h ASP 302 N 0.12 0.00 -0.05 7.04 2.03 -1.90 0.25 116.42 123.91 1fgt h ASP 302 Ca 0.31 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.49 1fgt h ASP 302 Cb 0.50 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.01 1fgt h ASP 302 CO -0.51 0.11 -0.45 0.58 -1.03 0.00 0.00 179.24 177.93 1fgt h VAL 303 N 0.00 1.42 -0.78 4.15 2.07 -1.15 -2.37 116.25 119.59 1fgt h VAL 303 Ca -0.00 -1.88 -0.05 0.00 0.82 0.00 0.00 66.70 65.59 1fgt h VAL 303 Cb 0.33 2.40 -0.03 0.00 -1.52 0.00 0.00 31.29 32.46 1fgt h VAL 303 CO 0.01 0.55 0.30 0.40 0.02 0.00 0.00 177.57 178.85 1fgt h ILE 304 N -0.09 1.26 0.00 4.57 1.08 -0.83 -2.51 117.51 120.99 1fgt h ILE 304 Ca -0.04 -0.84 -0.04 0.00 -0.39 0.00 0.00 64.86 63.55 1fgt h ILE 304 Cb 1.13 0.34 -0.01 0.00 -3.07 0.00 0.00 36.82 35.21 1fgt h ILE 304 CO 0.09 0.34 -0.19 0.28 -0.69 0.00 0.00 178.15 177.98 1fgt h SER 305 N 1.14 0.00 0.90 1.72 0.02 -0.96 0.61 113.55 116.98 1fgt h SER 305 Ca 0.26 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 61.01 1fgt h SER 305 Cb 0.23 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 1fgt h SER 305 CO -0.02 0.19 -0.92 0.74 -1.14 0.00 0.00 176.83 175.68 1fgt h THR 306 N 0.00 1.65 0.03 -2.27 2.02 -0.99 -3.38 112.91 109.97 1fgt h THR 306 Ca -0.00 -3.13 -0.31 0.00 0.77 0.00 0.00 66.41 63.74 1fgt h THR 306 Cb 0.60 2.69 -0.04 0.00 -1.74 0.00 0.00 68.15 69.67 1fgt h THR 306 CO 0.02 0.89 -1.74 -0.38 0.37 0.00 0.00 175.52 174.69 1fgt n ILE 307 N -3.46 1.59 -0.17 3.11 5.41 -1.00 -4.56 119.36 120.29 1fgt n ILE 307 Ca -0.01 -0.27 0.29 0.00 1.00 0.00 0.00 62.75 63.77 1fgt n ILE 307 Cb 0.87 -1.90 0.72 0.00 -0.71 0.00 0.00 39.64 38.61 1fgt n ILE 307 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 176.55 176.26 1fgt h ILE 308 N -0.69 0.41 -0.01 1.39 2.10 -1.06 -2.40 117.51 117.25 1fgt h ILE 308 Ca -0.45 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.49 1fgt h ILE 308 Cb 1.57 0.48 0.00 0.00 -1.09 0.00 0.00 36.82 37.77 1fgt h ILE 308 CO -0.17 0.00 -0.27 -0.81 -1.08 0.00 0.00 178.15 175.81 1fgt n PRO 309 N -4.01 1.29 -2.54 2.19 -0.04 -1.26 -4.68 135.00 125.95 1fgt n PRO 309 Ca 0.19 -0.94 -0.41 0.00 -0.04 0.00 0.00 63.50 62.29 1fgt n PRO 309 Cb 1.03 -1.48 -0.04 0.00 -0.04 0.00 0.00 33.50 32.97 1fgt n PRO 309 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fgt s LEU 310 N -2.36 4.45 0.52 1.53 1.43 -0.90 -4.95 118.68 118.40 1fgt s LEU 310 Ca 0.24 2.00 -0.23 0.00 -1.03 0.00 0.00 54.13 55.11 1fgt s LEU 310 Cb 0.19 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.76 1fgt s LEU 310 CO 0.49 -0.26 1.34 -2.84 0.23 0.00 0.00 176.35 175.31 1fgt s PRO 311 N 0.12 3.33 0.00 1.29 0.02 -1.26 -0.76 135.00 137.74 1fgt s PRO 311 Ca 0.51 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.74 1fgt s PRO 311 Cb -0.28 -2.36 0.00 0.00 0.02 0.00 0.00 34.50 31.88 1fgt s PRO 311 CO 0.32 -1.03 0.00 0.28 -0.33 0.00 0.00 177.00 176.25 1fgt n VAL 312 N -0.79 0.00 -0.28 3.83 0.31 -1.26 -4.42 118.33 115.72 1fgt n VAL 312 Ca 0.09 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.39 1fgt n VAL 312 Cb 0.45 0.00 0.09 0.00 -0.91 0.00 0.00 33.84 33.47 1fgt n VAL 312 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1fgt h ILE 313 N 0.00 1.12 0.00 2.52 1.08 -1.90 -1.62 117.51 118.71 1fgt h ILE 313 Ca 0.00 -0.33 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 1fgt h ILE 313 Cb 0.00 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 33.82 1fgt h ILE 313 CO 0.00 0.18 0.00 0.07 -0.69 0.00 0.00 178.15 177.71 1fgt h LYS 314 N 0.97 0.00 0.00 2.37 2.10 -1.13 -0.67 116.57 120.21 1fgt h LYS 314 Ca 0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.96 1fgt h LYS 314 Cb -0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1fgt h LYS 314 CO -0.11 0.00 -0.20 0.39 -2.00 0.00 0.00 179.45 177.53 1fgt n GLU 315 N -2.93 0.03 0.21 0.07 -0.58 -0.61 -3.84 120.64 113.00 1fgt n GLU 315 Ca -0.02 0.02 0.11 0.00 -0.42 0.00 0.00 57.16 56.85 1fgt n GLU 315 Cb 0.12 -1.53 0.23 0.00 -0.57 0.00 0.00 31.44 29.69 1fgt n GLU 315 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1fgt h LEU 316 N 0.00 0.00 -7.86 -4.62 3.38 -1.13 -3.46 115.31 101.62 1fgt h LEU 316 Ca 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1fgt h LEU 316 Cb 0.53 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.06 1fgt h LEU 316 CO 0.00 0.12 -0.62 -0.31 0.09 0.00 0.00 178.44 177.72 1fgt s TYR 317 N -3.25 0.14 0.27 1.13 1.51 -1.25 -4.46 117.35 111.44 1fgt s TYR 317 Ca 0.05 -0.31 -0.10 0.00 -1.01 0.00 0.00 57.07 55.70 1fgt s TYR 317 Cb 0.06 -0.11 -0.07 0.00 -0.11 0.00 0.00 41.96 41.73 1fgt s TYR 317 CO 0.67 -0.21 0.60 1.03 -1.11 0.00 0.00 175.55 176.53 1fgt s ARG 318 N -1.26 3.81 0.11 -0.62 0.52 -0.23 -4.84 118.95 116.44 1fgt s ARG 318 Ca -0.14 0.33 -0.11 0.00 -0.52 0.00 0.00 55.73 55.29 1fgt s ARG 318 Cb -0.08 -2.59 0.01 0.00 0.52 0.00 0.00 34.95 32.81 1fgt s ARG 318 CO 0.00 0.25 0.27 -0.08 0.02 0.00 0.00 175.30 175.76 1fgt s THR 319 N -1.92 0.11 -2.53 0.02 -1.32 -1.26 -0.63 115.64 108.12 1fgt s THR 319 Ca 0.48 -1.03 0.23 0.00 -1.21 0.00 0.00 61.69 60.17 1fgt s THR 319 Cb -0.11 -1.36 0.40 0.00 -1.51 0.00 0.00 72.50 69.93 1fgt s THR 319 CO 0.22 -0.50 1.45 -0.90 -2.21 0.00 0.00 174.62 172.68 1fgt n ASP 320 N -0.13 2.63 0.00 8.08 5.75 -1.24 -4.92 116.55 126.72 1fgt n ASP 320 Ca -0.14 -1.86 0.00 0.00 -0.01 0.00 0.00 54.79 52.78 1fgt n ASP 320 Cb 0.63 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 1fgt n ASP 320 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fgt n GLY 321 N 1.33 0.81 1.04 6.12 0.00 -1.26 -4.81 105.19 108.41 1fgt n GLY 321 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1fgt n GLY 321 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fgt n GLN 322 N -2.04 0.00 0.00 1.61 1.13 -1.26 -4.87 117.38 111.95 1fgt n GLN 322 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1fgt n GLN 322 Cb 0.01 -0.31 0.00 0.00 0.11 0.00 0.00 30.24 30.04 1fgt n GLN 322 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1fgt n HIS 323 N -3.13 0.00 -4.23 1.08 8.25 -1.26 -4.17 115.22 111.76 1fgt n HIS 323 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 1fgt n HIS 323 Cb 0.00 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.02 1fgt n HIS 323 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1fgt s ILE 324 N -0.19 4.61 -0.09 1.59 1.01 -1.26 0.16 121.20 127.02 1fgt s ILE 324 Ca 0.00 -0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.54 1fgt s ILE 324 Cb 0.00 -2.97 0.01 0.00 0.01 0.00 0.00 42.46 39.51 1fgt s ILE 324 CO 0.00 0.59 -0.16 -0.76 0.00 0.00 0.00 174.94 174.61 1fgt s LEU 325 N -0.79 1.77 -0.14 2.97 1.43 -0.59 -3.69 118.68 119.65 1fgt s LEU 325 Ca 0.12 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.83 1fgt s LEU 325 Cb -0.12 -1.06 0.02 0.00 0.03 0.00 0.00 46.19 45.06 1fgt s LEU 325 CO 0.03 0.05 -0.17 -0.54 0.23 0.00 0.00 176.35 175.95 1fgt s LYS 326 N 0.72 2.52 0.60 1.70 1.02 0.20 -0.67 119.74 125.84 1fgt s LYS 326 Ca -0.12 -0.66 -0.10 0.00 0.02 0.00 0.00 55.97 55.11 1fgt s LYS 326 Cb -0.16 -2.17 -0.03 0.00 -0.52 0.00 0.00 37.83 34.95 1fgt s LYS 326 CO 0.03 -0.13 0.99 -0.06 -0.92 0.00 0.00 175.35 175.25 1fgt s PHE 327 N 1.16 3.57 0.51 3.18 0.40 0.11 -1.07 117.98 125.84 1fgt s PHE 327 Ca -0.01 1.15 -0.19 0.00 -0.60 0.00 0.00 56.93 57.28 1fgt s PHE 327 Cb -0.14 -2.68 -0.08 0.00 0.51 0.00 0.00 43.02 40.64 1fgt s PHE 327 CO -0.06 -0.67 1.03 -1.25 0.70 0.00 0.00 175.22 174.97 1fgt s PRO 328 N -5.11 3.74 -0.10 0.24 0.04 -1.26 -4.13 135.00 128.42 1fgt s PRO 328 Ca 0.54 1.27 -0.29 0.00 0.04 0.00 0.00 61.00 62.56 1fgt s PRO 328 Cb -0.11 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1fgt s PRO 328 CO 0.52 -0.47 1.64 -1.14 0.04 0.00 0.00 177.00 177.59 1fgt s GLN 329 N -3.48 4.08 0.46 4.56 0.74 -1.26 -4.83 119.66 119.92 1fgt s GLN 329 Ca 0.65 2.06 -0.25 0.00 0.05 0.00 0.00 55.36 57.88 1fgt s GLN 329 Cb -0.15 -4.00 -0.08 0.00 1.10 0.00 0.00 33.01 29.89 1fgt s GLN 329 CO 0.24 -0.96 1.36 -2.14 -0.55 0.00 0.00 175.29 173.24 1fgt s PRO 330 N 4.20 3.67 0.30 1.67 0.02 -1.26 -4.90 135.00 138.70 1fgt s PRO 330 Ca 0.73 2.26 0.05 0.00 0.02 0.00 0.00 61.00 64.05 1fgt s PRO 330 Cb -0.31 -2.59 0.69 0.00 0.02 0.00 0.00 34.50 32.30 1fgt s PRO 330 CO 0.29 -0.77 1.79 0.45 -0.33 0.00 0.00 177.00 178.43 1fgt h HIS 331 N 2.25 1.08 0.00 6.54 3.86 -1.80 -2.12 115.15 124.97 1fgt h HIS 331 Ca -0.50 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.74 1fgt h HIS 331 Cb 1.26 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 29.40 1fgt h HIS 331 CO 0.50 0.28 0.08 -0.24 0.86 0.00 0.00 177.93 179.42 1fgt h VAL 332 N 0.82 0.00 -0.15 2.45 3.04 -1.36 -1.74 116.25 119.31 1fgt h VAL 332 Ca 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.25 1fgt h VAL 332 Cb 0.80 0.86 0.00 0.00 -2.01 0.00 0.00 31.29 30.93 1fgt h VAL 332 CO -0.36 0.00 0.00 1.33 -1.01 0.00 0.00 177.57 177.53 1fgt n VAL 333 N -2.93 0.57 0.28 1.51 0.24 -0.80 -4.65 118.33 112.54 1fgt n VAL 333 Ca -0.03 -0.78 0.14 0.00 -2.04 0.00 0.00 64.34 61.63 1fgt n VAL 333 Cb 0.14 0.79 0.82 0.00 -1.47 0.00 0.00 33.84 34.13 1fgt n VAL 333 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1fgt h GLN 334 N 1.52 0.00 0.00 7.34 4.20 -1.24 -3.27 115.11 123.65 1fgt h GLN 334 Ca 0.00 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.51 1fgt h GLN 334 Cb 0.52 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 1fgt h GLN 334 CO 0.00 0.06 -1.73 0.28 -0.67 0.00 0.00 178.83 176.78 1fgt n VAL 335 N -3.72 0.72 -3.78 -0.54 0.31 -1.26 -4.99 118.33 105.08 1fgt n VAL 335 Ca -0.02 -0.24 -0.23 0.00 -0.01 0.00 0.00 64.34 63.83 1fgt n VAL 335 Cb 0.16 -1.23 -0.18 0.00 -0.91 0.00 0.00 33.84 31.69 1fgt n VAL 335 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1fgt s SER 336 N -5.60 1.62 0.00 4.52 0.15 -1.23 -5.01 113.70 108.15 1fgt s SER 336 Ca -0.18 -0.10 0.27 0.00 0.70 0.00 0.00 55.95 56.65 1fgt s SER 336 Cb 0.05 -0.46 1.17 0.00 -1.71 0.00 0.00 66.02 65.07 1fgt s SER 336 CO 0.27 -0.19 1.88 0.00 1.20 0.00 0.00 173.24 176.40 1fgt n GLN 337 N 5.14 0.01 -0.00 5.44 10.64 -1.25 -3.48 117.38 133.87 1fgt n GLN 337 Ca -0.07 0.03 0.07 0.00 -1.83 0.00 0.00 57.00 55.19 1fgt n GLN 337 Cb 0.50 -1.50 -0.09 0.00 -0.86 0.00 0.00 30.24 28.29 1fgt n GLN 337 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 1fgt n SER 338 N -1.50 0.81 0.26 2.61 3.41 -1.26 -4.60 113.62 113.36 1fgt n SER 338 Ca 0.07 -0.72 0.11 0.00 -0.26 0.00 0.00 58.87 58.08 1fgt n SER 338 Cb 0.32 1.10 0.75 0.00 -0.26 0.00 0.00 64.21 66.12 1fgt n SER 338 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fgt h ALA 339 N 1.92 1.84 -0.10 7.33 0.00 -1.88 -1.29 119.26 127.09 1fgt h ALA 339 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1fgt h ALA 339 Cb 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1fgt h ALA 339 CO 0.00 -0.04 0.10 0.11 0.00 0.00 0.00 179.25 179.42 1fgt h TRP 340 N 0.00 0.00 -0.01 0.00 5.08 -1.82 -1.72 115.95 117.49 1fgt h TRP 340 Ca 0.01 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.98 1fgt h TRP 340 Cb 0.06 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.22 1fgt h TRP 340 CO 0.00 0.00 -0.03 0.00 -1.28 0.00 0.00 178.44 177.13 1fgt n MET 341 N -3.96 1.18 -2.61 0.12 0.00 -0.49 -4.45 117.12 106.91 1fgt n MET 341 Ca -0.01 -0.42 -0.36 0.00 0.00 0.00 0.00 57.70 56.92 1fgt n MET 341 Cb 0.20 -1.49 -0.05 0.00 0.00 0.00 0.00 33.22 31.89 1fgt n MET 341 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 1fgt s THR 342 N -2.11 3.88 0.38 3.17 -4.23 -0.65 -4.94 115.64 111.15 1fgt s THR 342 Ca 0.40 1.41 0.06 0.00 -1.18 0.00 0.00 61.69 62.38 1fgt s THR 342 Cb 0.21 -3.72 0.23 0.00 1.34 0.00 0.00 72.50 70.56 1fgt s THR 342 CO 0.38 -0.02 1.99 0.44 -0.54 0.00 0.00 174.62 176.88 1fgt h ASP 343 N 2.50 0.48 -0.52 3.99 5.19 -1.88 -1.97 116.42 124.21 1fgt h ASP 343 Ca -0.48 -0.04 0.02 0.00 -0.62 0.00 0.00 57.03 55.91 1fgt h ASP 343 Cb 1.21 -0.12 -0.03 0.00 0.18 0.00 0.00 39.33 40.56 1fgt h ASP 343 CO 0.62 0.42 0.31 -0.33 -3.12 0.00 0.00 179.24 177.15 1fgt h GLU 344 N 0.54 0.61 -0.16 3.56 3.07 -1.92 -2.06 114.58 118.22 1fgt h GLU 344 Ca 0.14 -0.04 -0.19 0.00 -0.50 0.00 0.00 59.36 58.77 1fgt h GLU 344 Cb 0.08 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 27.85 1fgt h GLU 344 CO -0.02 0.40 -0.67 1.49 -1.40 0.00 0.00 179.01 178.81 1fgt h GLU 345 N 0.63 0.65 -0.35 2.33 4.57 -1.69 -0.79 114.58 119.93 1fgt h GLU 345 Ca 0.20 -0.48 0.06 0.00 -1.18 0.00 0.00 59.36 57.97 1fgt h GLU 345 Cb 0.00 0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 28.62 1fgt h GLU 345 CO -0.08 1.10 -0.01 0.35 -1.18 0.00 0.00 179.01 179.19 1fgt h PHE 346 N 0.47 -0.03 -0.18 0.92 3.57 -1.18 -0.84 116.94 119.65 1fgt h PHE 346 Ca -0.02 0.03 -0.21 0.00 3.53 0.00 0.00 57.97 61.29 1fgt h PHE 346 Cb 1.27 0.07 0.01 0.00 2.79 0.00 0.00 35.95 40.08 1fgt h PHE 346 CO 0.06 -0.07 -0.72 0.00 -2.23 0.00 0.00 178.31 175.35 1fgt h ALA 347 N 1.31 0.35 -0.59 2.41 0.00 -1.35 -3.25 119.26 118.14 1fgt h ALA 347 Ca 0.17 -0.58 0.02 0.00 0.00 0.00 0.00 54.91 54.52 1fgt h ALA 347 Cb 0.23 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1fgt h ALA 347 CO -0.29 0.69 0.39 -0.09 0.00 0.00 0.00 179.25 179.94 1fgt h ARG 348 N 0.57 0.71 0.00 0.00 2.43 -0.64 -1.04 114.38 116.41 1fgt h ARG 348 Ca -0.04 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1fgt h ARG 348 Cb 1.35 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1fgt h ARG 348 CO 0.15 0.47 0.00 0.39 -1.51 0.00 0.00 179.97 179.47 1fgt n GLU 349 N -4.46 0.15 0.11 0.20 1.02 -0.37 -1.03 120.64 116.26 1fgt n GLU 349 Ca 0.06 0.39 0.12 0.00 -0.02 0.00 0.00 57.16 57.71 1fgt n GLU 349 Cb 0.09 -1.79 0.46 0.00 -0.02 0.00 0.00 31.44 30.18 1fgt n GLU 349 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1fgt n MET 350 N -2.07 0.20 0.00 3.49 2.81 -0.39 -0.81 117.12 120.35 1fgt n MET 350 Ca 0.02 0.32 0.00 0.00 -1.81 0.00 0.00 57.70 56.23 1fgt n MET 350 Cb 0.21 -1.81 0.00 0.00 -0.71 0.00 0.00 33.22 30.91 1fgt n MET 350 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1fgt n ILE 351 N -2.18 0.00 -1.85 2.02 -5.35 -0.40 -4.29 119.36 107.31 1fgt n ILE 351 Ca 0.04 -0.45 0.00 0.00 -0.27 0.00 0.00 62.75 62.07 1fgt n ILE 351 Cb 0.31 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.22 1fgt n ILE 351 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1fgt n ALA 352 N -0.80 1.79 -2.03 -1.28 0.00 -0.20 -2.43 120.51 115.56 1fgt n ALA 352 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.80 1fgt n ALA 352 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.17 1fgt n ALA 352 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fgt n GLY 353 N 0.00 1.99 0.22 0.00 0.00 0.01 -4.86 105.19 102.55 1fgt n GLY 353 Ca 0.00 -2.04 0.07 0.00 0.00 0.00 0.00 46.02 44.05 1fgt n GLY 353 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1fgt h VAL 354 N 0.00 0.93 -2.22 1.61 -1.51 -1.85 -3.32 116.25 109.89 1fgt h VAL 354 Ca 0.00 -0.97 -0.59 0.00 -1.23 0.00 0.00 66.70 63.92 1fgt h VAL 354 Cb 0.00 1.56 -0.41 0.00 -2.13 0.00 0.00 31.29 30.32 1fgt h VAL 354 CO 0.00 0.25 -0.82 -3.20 -1.23 0.00 0.00 177.57 172.57 1fgt n ASN 355 N -3.86 1.97 -0.88 4.19 4.05 -1.26 -4.30 115.26 115.17 1fgt n ASN 355 Ca -0.02 -3.05 0.02 0.00 0.45 0.00 0.00 54.58 51.99 1fgt n ASN 355 Cb 0.34 -0.66 0.12 0.00 1.23 0.00 0.00 39.78 40.82 1fgt n ASN 355 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1fgt n PRO 356 N 1.33 2.14 -0.81 1.20 -0.04 -1.25 -4.30 135.00 133.27 1fgt n PRO 356 Ca 0.26 -0.97 0.05 0.00 -0.04 0.00 0.00 63.50 62.80 1fgt n PRO 356 Cb 0.46 -1.67 0.13 0.00 -0.04 0.00 0.00 33.50 32.37 1fgt n PRO 356 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fgt n VAL 358 N -0.56 0.44 -1.61 0.00 0.31 -1.26 -5.03 118.33 110.62 1fgt n VAL 358 Ca 0.13 -0.27 -0.41 0.00 -0.01 0.00 0.00 64.34 63.78 1fgt n VAL 358 Cb 0.83 -0.83 0.01 0.00 -0.91 0.00 0.00 33.84 32.94 1fgt n VAL 358 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1fgt n ILE 359 N -2.26 2.44 -4.15 2.52 3.06 -1.26 -4.74 119.36 114.97 1fgt n ILE 359 Ca -0.11 -0.50 -0.14 0.00 -2.50 0.00 0.00 62.75 59.51 1fgt n ILE 359 Cb 0.71 -1.14 -0.11 0.00 0.54 0.00 0.00 39.64 39.63 1fgt n ILE 359 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 1fgt s ARG 360 N -2.01 0.77 0.49 9.51 0.52 -0.05 -4.87 118.95 123.31 1fgt s ARG 360 Ca 0.63 -1.09 -0.20 0.00 -0.52 0.00 0.00 55.73 54.55 1fgt s ARG 360 Cb -0.56 -0.43 -0.08 0.00 0.52 0.00 0.00 34.95 34.40 1fgt s ARG 360 CO 0.57 0.06 1.07 0.20 0.02 0.00 0.00 175.30 177.21 1fgt s GLY 361 N -2.32 2.57 -0.22 -3.53 0.00 0.26 -0.33 107.32 103.74 1fgt s GLY 361 Ca 0.03 0.68 0.01 0.00 0.00 0.00 0.00 44.72 45.44 1fgt s GLY 361 CO -0.01 1.02 -0.14 -2.27 0.00 0.00 0.00 173.10 171.70 1fgt s LEU 362 N -3.48 2.84 0.00 0.66 2.96 -0.13 -4.76 118.68 116.77 1fgt s LEU 362 Ca 0.68 -0.99 0.15 0.00 -0.22 0.00 0.00 54.13 53.75 1fgt s LEU 362 Cb -0.19 -1.54 0.28 0.00 0.50 0.00 0.00 46.19 45.24 1fgt s LEU 362 CO 0.23 -0.10 1.18 -0.62 -1.32 0.00 0.00 176.35 175.72 1fgt n GLU 363 N 4.55 2.01 -3.98 1.98 1.02 -1.26 -4.54 120.64 120.42 1fgt n GLU 363 Ca -0.17 -1.86 -0.09 0.00 -0.02 0.00 0.00 57.16 55.02 1fgt n GLU 363 Cb 0.46 -1.34 -0.08 0.00 -0.02 0.00 0.00 31.44 30.46 1fgt n GLU 363 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1fgt s GLU 364 N -1.15 0.91 -0.13 3.49 -1.05 -1.26 -4.98 118.70 114.53 1fgt s GLU 364 Ca 0.25 -1.15 -0.10 0.00 -0.15 0.00 0.00 54.97 53.83 1fgt s GLU 364 Cb 0.15 0.31 0.04 0.00 -0.44 0.00 0.00 34.13 34.19 1fgt s GLU 364 CO 0.21 -0.28 0.32 0.12 0.95 0.00 0.00 175.26 176.58 1fgt s PHE 365 N -3.93 -0.38 0.87 4.83 2.19 -1.26 -4.36 117.98 115.94 1fgt s PHE 365 Ca 0.12 0.91 -0.12 0.00 0.33 0.00 0.00 56.93 58.17 1fgt s PHE 365 Cb 0.05 0.13 0.12 0.00 -1.31 0.00 0.00 43.02 42.01 1fgt s PHE 365 CO -0.05 -0.20 1.10 -1.25 1.83 0.00 0.00 175.22 176.64 1fgt s PRO 366 N 0.49 1.44 0.45 10.12 0.04 -1.26 -5.10 135.00 141.18 1fgt s PRO 366 Ca -0.03 0.69 -0.24 0.00 0.04 0.00 0.00 61.00 61.47 1fgt s PRO 366 Cb -0.04 -1.84 -0.07 0.00 0.04 0.00 0.00 34.50 32.58 1fgt s PRO 366 CO -0.03 -2.08 1.24 -1.25 0.04 0.00 0.00 177.00 174.92 1fgt s PRO 367 N -5.04 3.73 0.32 0.56 0.04 -1.26 -5.00 135.00 128.35 1fgt s PRO 367 Ca 0.63 1.98 0.07 0.00 0.04 0.00 0.00 61.00 63.72 1fgt s PRO 367 Cb -0.17 -2.51 -0.03 0.00 0.04 0.00 0.00 34.50 31.84 1fgt s PRO 367 CO 0.56 -0.63 0.30 0.15 0.04 0.00 0.00 177.00 177.41 1fgt s LYS 368 N -2.56 2.83 0.06 4.56 1.02 -1.26 -4.31 119.74 120.08 1fgt s LYS 368 Ca 0.62 -1.20 0.08 0.00 0.02 0.00 0.00 55.97 55.49 1fgt s LYS 368 Cb -0.34 -2.55 -0.03 0.00 -0.52 0.00 0.00 37.83 34.40 1fgt s LYS 368 CO 0.42 0.16 -0.21 0.45 -0.92 0.00 0.00 175.35 175.24 1fgt s SER 369 N -3.99 2.56 0.00 2.83 0.15 -1.26 -5.01 113.70 108.98 1fgt s SER 369 Ca 0.40 -0.56 0.22 0.00 0.70 0.00 0.00 55.95 56.71 1fgt s SER 369 Cb -0.07 -0.20 0.42 0.00 -1.71 0.00 0.00 66.02 64.47 1fgt s SER 369 CO 0.27 0.15 1.38 0.59 1.20 0.00 0.00 173.24 176.83 1fgt n ASN 370 N 1.69 3.44 -4.83 5.45 3.02 -1.26 -4.98 115.26 117.78 1fgt n ASN 370 Ca -0.18 -1.97 -0.32 0.00 -0.03 0.00 0.00 54.58 52.08 1fgt n ASN 370 Cb 0.53 -0.26 -0.03 0.00 -0.61 0.00 0.00 39.78 39.41 1fgt n ASN 370 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1fgt s LEU 371 N -1.39 3.66 -0.33 3.41 1.43 -1.26 -4.99 118.68 119.21 1fgt s LEU 371 Ca 0.38 1.64 -0.29 0.00 -1.03 0.00 0.00 54.13 54.84 1fgt s LEU 371 Cb 0.22 -4.52 -0.01 0.00 0.03 0.00 0.00 46.19 41.91 1fgt s LEU 371 CO 0.30 -0.66 1.59 -0.62 0.23 0.00 0.00 176.35 177.19 1fgt s ASP 372 N -2.85 6.21 0.59 2.29 -1.08 -1.26 -4.89 116.67 115.68 1fgt s ASP 372 Ca 0.60 1.20 0.36 0.00 -0.52 0.00 0.00 52.55 54.19 1fgt s ASP 372 Cb -0.11 -2.53 1.80 0.00 -1.46 0.00 0.00 42.92 40.61 1fgt s ASP 372 CO 0.29 -1.47 2.16 1.55 0.52 0.00 0.00 175.17 178.23 1fgt h PRO 373 N 11.37 0.00 0.00 4.34 0.13 -1.95 -0.84 132.00 145.05 1fgt h PRO 373 Ca -0.31 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.76 1fgt h PRO 373 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1fgt h PRO 373 CO 1.04 0.04 -0.28 0.00 -0.23 0.00 0.00 178.00 178.57 1fgt h ALA 374 N 1.96 1.47 0.06 -0.56 0.00 -1.90 0.19 119.26 120.48 1fgt h ALA 374 Ca -0.00 -0.26 -0.33 0.00 0.00 0.00 0.00 54.91 54.33 1fgt h ALA 374 Cb 0.25 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1fgt h ALA 374 CO 0.01 0.35 -1.81 -0.89 0.00 0.00 0.00 179.25 176.91 1fgt n ILE 375 N -4.12 1.64 0.71 0.00 5.41 -0.40 -4.60 119.36 118.01 1fgt n ILE 375 Ca -0.02 -0.39 0.08 0.00 1.00 0.00 0.00 62.75 63.42 1fgt n ILE 375 Cb 0.34 -1.84 0.03 0.00 -0.71 0.00 0.00 39.64 37.45 1fgt n ILE 375 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1fgt n TYR 376 N -3.89 0.00 0.00 1.39 4.01 -0.73 -4.67 117.16 113.26 1fgt n TYR 376 Ca -0.35 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.39 1fgt n TYR 376 Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.92 1fgt n TYR 376 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fgt n GLY 377 N 1.08 -0.05 3.64 2.72 0.00 0.68 -0.79 105.19 112.47 1fgt n GLY 377 Ca 0.08 -1.79 -0.58 0.00 0.00 0.00 0.00 46.02 43.73 1fgt n GLY 377 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fgt n ASP 378 N -1.05 1.47 -1.22 1.61 -0.08 -1.26 -4.28 116.55 111.75 1fgt n ASP 378 Ca 0.00 1.13 0.11 0.00 -1.51 0.00 0.00 54.79 54.52 1fgt n ASP 378 Cb 0.00 -1.07 0.27 0.00 2.34 0.00 0.00 41.12 42.67 1fgt n ASP 378 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1fgt n GLN 379 N 3.47 2.65 -1.86 -0.67 1.13 -1.26 -4.99 117.38 115.86 1fgt n GLN 379 Ca 0.23 -2.49 -0.39 0.00 -1.94 0.00 0.00 57.00 52.42 1fgt n GLN 379 Cb 0.11 -1.52 0.03 0.00 0.11 0.00 0.00 30.24 28.96 1fgt n GLN 379 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1fgt s SER 380 N -1.13 5.60 0.41 1.08 1.04 -1.26 -4.61 113.70 114.83 1fgt s SER 380 Ca 0.43 2.75 -0.24 0.00 0.48 0.00 0.00 55.95 59.37 1fgt s SER 380 Cb 0.23 -2.64 -0.09 0.00 0.10 0.00 0.00 66.02 63.63 1fgt s SER 380 CO 0.31 -1.34 1.10 -0.55 0.98 0.00 0.00 173.24 173.73 1fgt s SER 381 N -0.86 6.59 0.00 7.02 0.15 -1.26 -4.95 113.70 120.39 1fgt s SER 381 Ca 0.67 2.16 0.24 0.00 0.70 0.00 0.00 55.95 59.71 1fgt s SER 381 Cb -0.40 -2.60 0.34 0.00 -1.71 0.00 0.00 66.02 61.66 1fgt s SER 381 CO 0.49 -0.61 1.35 0.29 1.20 0.00 0.00 173.24 175.96 1fgt n LYS 382 N -0.11 2.40 -2.53 5.44 4.76 -1.26 -4.93 118.16 121.93 1fgt n LYS 382 Ca 0.05 -2.08 -0.42 0.00 -2.87 0.00 0.00 58.31 52.99 1fgt n LYS 382 Cb 0.49 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 32.16 1fgt n LYS 382 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1fgt s ILE 383 N -1.74 4.40 -0.12 -0.18 1.01 -1.26 -4.94 121.20 118.37 1fgt s ILE 383 Ca 0.34 1.71 -0.08 0.00 0.00 0.00 0.00 60.65 62.62 1fgt s ILE 383 Cb 0.21 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.54 1fgt s ILE 383 CO 0.31 0.05 0.17 0.42 0.00 0.00 0.00 174.94 175.89 1fgt s THR 384 N 1.74 5.44 0.23 2.92 -4.23 -1.26 -4.88 115.64 115.59 1fgt s THR 384 Ca 0.55 0.28 -0.08 0.00 -1.18 0.00 0.00 61.69 61.26 1fgt s THR 384 Cb -0.24 -3.45 0.19 0.00 1.34 0.00 0.00 72.50 70.34 1fgt s THR 384 CO 0.24 0.58 1.89 0.00 -0.54 0.00 0.00 174.62 176.79 1fgt h ALA 385 N 5.26 1.08 0.00 3.99 0.00 -1.98 -2.59 119.26 125.01 1fgt h ALA 385 Ca -0.52 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1fgt h ALA 385 Cb 1.22 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1fgt h ALA 385 CO 0.62 0.44 0.00 -0.44 0.00 0.00 0.00 179.25 179.87 1fgt h ASP 386 N 1.11 0.00 0.57 0.00 3.32 -2.03 -2.15 116.42 117.24 1fgt h ASP 386 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 1fgt h ASP 386 Cb -0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.46 1fgt h ASP 386 CO -0.08 0.00 -0.34 -1.54 -1.72 0.00 0.00 179.24 175.56 1fgt n SER 387 N -2.37 0.44 -4.82 6.45 3.41 -0.98 -4.92 113.62 110.84 1fgt n SER 387 Ca -0.00 -0.18 -0.37 0.00 -0.26 0.00 0.00 58.87 58.05 1fgt n SER 387 Cb 0.13 0.05 -0.06 0.00 -0.26 0.00 0.00 64.21 64.08 1fgt n SER 387 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1fgt s LEU 388 N -2.90 4.46 -0.56 1.04 1.43 -0.81 -5.04 118.68 116.30 1fgt s LEU 388 Ca 0.15 1.26 -0.17 0.00 -1.03 0.00 0.00 54.13 54.34 1fgt s LEU 388 Cb 0.18 -3.11 0.12 0.00 0.03 0.00 0.00 46.19 43.41 1fgt s LEU 388 CO 0.63 0.20 0.57 -0.62 0.23 0.00 0.00 176.35 177.35 1fgt s ASP 389 N -1.34 6.19 -0.54 2.29 -1.08 -1.26 -4.91 116.67 116.02 1fgt s ASP 389 Ca 0.33 -1.65 0.01 0.00 -0.52 0.00 0.00 52.55 50.72 1fgt s ASP 389 Cb -0.18 -2.24 0.47 0.00 -1.46 0.00 0.00 42.92 39.51 1fgt s ASP 389 CO 0.20 -0.94 1.79 0.18 0.52 0.00 0.00 175.17 176.91 1fgt n LEU 390 N 5.63 6.76 -3.22 -1.34 4.77 -1.26 -4.89 117.00 123.45 1fgt n LEU 390 Ca -0.12 -4.32 -0.23 0.00 -0.03 0.00 0.00 56.01 51.30 1fgt n LEU 390 Cb 0.41 -0.79 0.02 0.00 -2.33 0.00 0.00 43.42 40.72 1fgt n LEU 390 CO 0.55 1.58 -0.01 0.47 -1.33 0.00 0.00 177.39 178.66 1fgt n ASP 391 N -0.90 -4.94 0.00 -1.43 8.00 -1.26 -1.30 116.55 114.72 1fgt n ASP 391 Ca 0.56 -0.35 0.00 0.00 0.71 0.00 0.00 54.79 55.71 1fgt n ASP 391 Cb 0.83 -4.03 0.00 0.00 -0.02 0.00 0.00 41.12 37.91 1fgt n ASP 391 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fgt n GLY 392 N -1.37 0.86 3.81 0.44 0.00 -1.26 -5.06 105.19 102.61 1fgt n GLY 392 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1fgt n GLY 392 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fgt s TYR 393 N -2.38 3.45 0.59 1.61 1.51 -0.42 -5.06 117.35 116.65 1fgt s TYR 393 Ca 0.00 1.67 -0.06 0.00 -1.01 0.00 0.00 57.07 57.67 1fgt s TYR 393 Cb 0.00 -2.87 0.01 0.00 -0.11 0.00 0.00 41.96 38.99 1fgt s TYR 393 CO 0.00 0.01 0.90 0.95 -1.11 0.00 0.00 175.55 176.30 1fgt s THR 394 N -1.97 3.62 0.19 -0.71 -4.23 -1.26 -4.55 115.64 106.73 1fgt s THR 394 Ca 0.58 -0.01 -0.12 0.00 -1.18 0.00 0.00 61.69 60.96 1fgt s THR 394 Cb -0.13 -3.44 0.11 0.00 1.34 0.00 0.00 72.50 70.38 1fgt s THR 394 CO 0.17 -0.45 1.85 -0.03 -0.54 0.00 0.00 174.62 175.62 1fgt h MET 395 N -0.18 0.80 -0.69 3.99 4.05 -1.97 -0.38 114.93 120.55 1fgt h MET 395 Ca -0.45 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 58.90 1fgt h MET 395 Cb 1.26 -0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 31.84 1fgt h MET 395 CO 0.61 0.53 0.37 -0.44 0.23 0.00 0.00 176.91 178.20 1fgt h ASP 396 N 0.82 0.85 -0.45 1.39 3.32 -1.99 0.20 116.42 120.56 1fgt h ASP 396 Ca 0.24 -0.07 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 1fgt h ASP 396 Cb -0.06 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 1fgt h ASP 396 CO -0.07 0.69 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.73 1fgt h GLU 397 N 0.96 0.86 -0.38 3.56 5.08 -1.77 -0.86 114.58 122.03 1fgt h GLU 397 Ca 0.24 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1fgt h GLU 397 Cb 0.03 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1fgt h GLU 397 CO -0.04 0.95 0.14 0.00 -1.00 0.00 0.00 179.01 179.06 1fgt h ALA 398 N 0.88 0.49 -0.12 3.43 0.00 -0.59 -1.28 119.26 122.06 1fgt h ALA 398 Ca 0.12 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1fgt h ALA 398 Cb 0.62 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1fgt h ALA 398 CO 0.04 0.11 0.06 -0.07 0.00 0.00 0.00 179.25 179.39 1fgt h LEU 399 N 0.46 0.15 -1.11 0.00 3.38 -0.88 -0.92 115.31 116.40 1fgt h LEU 399 Ca 0.12 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1fgt h LEU 399 Cb 0.21 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1fgt h LEU 399 CO -0.01 0.22 -0.33 1.23 0.09 0.00 0.00 178.44 179.64 1fgt h GLY 400 N 0.08 0.22 -0.18 0.83 0.00 -1.05 -2.41 103.07 100.56 1fgt h GLY 400 Ca 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1fgt h GLY 400 CO -0.01 0.17 0.00 -1.14 0.00 0.00 0.00 176.54 175.56 1fgt n SER 401 N -4.10 0.87 -3.62 0.19 3.41 -0.49 -4.91 113.62 104.96 1fgt n SER 401 Ca -0.01 -1.60 -0.22 0.00 -0.26 0.00 0.00 58.87 56.78 1fgt n SER 401 Cb 0.41 -0.06 0.06 0.00 -0.26 0.00 0.00 64.21 64.36 1fgt n SER 401 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1fgt n ARG 402 N -0.19 -6.09 -0.01 4.33 5.12 -0.91 -4.92 116.66 113.99 1fgt n ARG 402 Ca 0.14 0.73 0.07 0.00 -1.93 0.00 0.00 57.85 56.87 1fgt n ARG 402 Cb 0.20 -5.57 0.07 0.00 -1.16 0.00 0.00 32.46 25.99 1fgt n ARG 402 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1fgt n ARG 403 N -4.41 1.15 -4.20 5.56 1.74 -0.37 -4.95 116.66 111.19 1fgt n ARG 403 Ca -0.20 -1.43 -0.34 0.00 -0.77 0.00 0.00 57.85 55.11 1fgt n ARG 403 Cb 0.63 -1.29 -0.11 0.00 -1.02 0.00 0.00 32.46 30.68 1fgt n ARG 403 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1fgt s LEU 404 N -1.21 3.57 0.30 0.55 2.96 -1.23 0.01 118.68 123.63 1fgt s LEU 404 Ca 0.18 0.01 0.03 0.00 -0.22 0.00 0.00 54.13 54.12 1fgt s LEU 404 Cb 0.12 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 1fgt s LEU 404 CO 0.18 0.19 0.15 -0.36 -1.32 0.00 0.00 176.35 175.20 1fgt s PHE 405 N 0.24 1.59 0.05 5.38 0.40 -0.17 -0.96 117.98 124.51 1fgt s PHE 405 Ca 0.01 -1.35 -0.23 0.00 -0.60 0.00 0.00 56.93 54.75 1fgt s PHE 405 Cb -0.13 -0.86 0.06 0.00 0.51 0.00 0.00 43.02 42.59 1fgt s PHE 405 CO 0.01 -0.50 0.54 0.00 0.70 0.00 0.00 175.22 175.97 1fgt s MET 406 N -3.84 1.06 -0.40 0.44 0.23 0.55 -0.52 119.30 116.82 1fgt s MET 406 Ca 0.36 -0.21 -0.03 0.00 -1.03 0.00 0.00 55.69 54.78 1fgt s MET 406 Cb 0.05 0.49 0.11 0.00 -1.53 0.00 0.00 34.83 33.95 1fgt s MET 406 CO 0.17 -0.39 0.18 -1.17 -2.03 0.00 0.00 175.02 171.79 1fgt s LEU 407 N -1.98 5.15 -0.47 0.18 2.96 -0.36 -0.87 118.68 123.28 1fgt s LEU 407 Ca -0.05 -1.99 -0.12 0.00 -0.22 0.00 0.00 54.13 51.75 1fgt s LEU 407 Cb -0.01 -1.81 0.10 0.00 0.50 0.00 0.00 46.19 44.97 1fgt s LEU 407 CO -0.02 -0.52 0.36 -0.62 -1.32 0.00 0.00 176.35 174.24 1fgt s ASP 408 N 1.75 5.88 -0.09 3.68 2.15 -1.26 -1.33 116.67 127.44 1fgt s ASP 408 Ca 0.08 -1.65 0.14 0.00 0.43 0.00 0.00 52.55 51.54 1fgt s ASP 408 Cb -0.22 -2.08 0.46 0.00 -0.30 0.00 0.00 42.92 40.77 1fgt s ASP 408 CO -0.04 -0.68 1.37 -1.22 -0.17 0.00 0.00 175.17 174.44 1fgt n TYR 409 N 5.04 0.80 0.27 -5.34 4.01 0.66 -4.72 117.16 117.89 1fgt n TYR 409 Ca -0.11 -0.68 -0.14 0.00 -0.16 0.00 0.00 57.90 56.81 1fgt n TYR 409 Cb 0.42 -0.18 -0.08 0.00 -0.31 0.00 0.00 39.34 39.19 1fgt n TYR 409 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1fgt h HIS 410 N 2.17 -0.67 -0.02 -0.72 2.76 -1.66 -1.30 115.15 115.72 1fgt h HIS 410 Ca 0.00 -0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.04 1fgt h HIS 410 Cb 1.14 0.22 -0.02 0.00 1.55 0.00 0.00 27.41 30.30 1fgt h HIS 410 CO 0.42 -0.34 -0.53 -0.44 -1.30 0.00 0.00 177.93 175.73 1fgt h ASP 411 N -1.00 0.05 -0.29 3.26 5.19 -1.90 -1.73 116.42 119.99 1fgt h ASP 411 Ca -0.07 -0.03 -0.05 0.00 -0.62 0.00 0.00 57.03 56.26 1fgt h ASP 411 Cb 0.63 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.11 1fgt h ASP 411 CO 0.12 0.58 0.00 0.40 -3.12 0.00 0.00 179.24 177.22 1fgt h ILE 412 N 0.04 1.26 0.00 0.35 2.04 -1.84 -3.34 117.51 116.01 1fgt h ILE 412 Ca -0.00 -0.93 -0.17 0.00 1.00 0.00 0.00 64.86 64.75 1fgt h ILE 412 Cb 0.96 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 38.29 1fgt h ILE 412 CO 0.07 0.30 -1.44 0.49 0.00 0.00 0.00 178.15 177.57 1fgt n PHE 413 N -4.58 0.95 -0.26 1.37 3.01 -0.49 -4.40 117.46 113.06 1fgt n PHE 413 Ca -0.03 0.32 0.06 0.00 1.01 0.00 0.00 57.45 58.81 1fgt n PHE 413 Cb 0.26 -1.08 0.19 0.00 -0.01 0.00 0.00 39.48 38.84 1fgt n PHE 413 CO 0.00 0.00 0.00 1.98 1.01 0.00 0.00 176.76 179.75 1fgt h MET 414 N 0.00 0.42 0.00 -1.08 4.05 -1.43 0.37 114.93 117.25 1fgt h MET 414 Ca -0.17 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.23 1fgt h MET 414 Cb 1.59 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 32.29 1fgt h MET 414 CO 0.04 0.28 0.00 -1.35 0.23 0.00 0.00 176.91 176.11 1fgt h PRO 415 N 0.43 0.00 -0.01 0.39 0.11 -1.77 -2.65 132.00 128.50 1fgt h PRO 415 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 1fgt h PRO 415 Cb 0.65 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1fgt h PRO 415 CO -0.42 0.00 -0.17 0.66 -0.21 0.00 0.00 178.00 177.86 1fgt n TYR 416 N -2.98 0.00 -0.18 0.65 4.02 0.07 -4.68 117.16 114.05 1fgt n TYR 416 Ca -0.03 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.79 1fgt n TYR 416 Cb 0.07 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.41 1fgt n TYR 416 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1fgt h VAL 417 N 1.67 1.19 -0.01 -0.72 2.07 -1.04 -1.05 116.25 118.36 1fgt h VAL 417 Ca 0.00 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1fgt h VAL 417 Cb 0.44 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1fgt h VAL 417 CO 0.00 0.21 -0.01 -0.09 0.02 0.00 0.00 177.57 177.70 1fgt h ARG 418 N 0.70 -0.02 -0.24 1.57 2.43 -1.84 0.99 114.38 117.97 1fgt h ARG 418 Ca 0.18 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.24 1fgt h ARG 418 Cb 0.10 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1fgt h ARG 418 CO -0.02 -0.01 -0.31 -0.56 -1.51 0.00 0.00 179.97 177.55 1fgt h GLN 419 N -0.02 0.49 -0.26 0.20 3.07 -1.85 -2.29 115.11 114.46 1fgt h GLN 419 Ca 0.01 -0.21 -0.05 0.00 0.09 0.00 0.00 58.65 58.49 1fgt h GLN 419 Cb 0.03 -0.02 -0.01 0.00 0.08 0.00 0.00 27.48 27.57 1fgt h GLN 419 CO -0.02 0.75 -0.04 0.82 0.09 0.00 0.00 178.83 180.43 1fgt h ILE 420 N 0.42 1.27 0.00 1.86 2.04 -0.93 -2.98 117.51 119.20 1fgt h ILE 420 Ca 0.05 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1fgt h ILE 420 Cb 0.76 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 1fgt h ILE 420 CO 0.06 0.32 0.00 0.59 0.00 0.00 0.00 178.15 179.12 1fgt n ASN 421 N -4.57 0.60 0.17 1.72 3.02 0.32 -1.17 115.26 115.35 1fgt n ASN 421 Ca -0.04 0.68 0.13 0.00 -0.03 0.00 0.00 54.58 55.32 1fgt n ASN 421 Cb 0.28 -0.79 0.41 0.00 -0.61 0.00 0.00 39.78 39.07 1fgt n ASN 421 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1fgt h GLN 422 N 0.00 0.00 -7.11 3.52 1.08 -1.25 -3.46 115.11 107.90 1fgt h GLN 422 Ca 0.00 0.00 -0.49 0.00 -1.45 0.00 0.00 58.65 56.71 1fgt h GLN 422 Cb 0.27 0.00 0.05 0.00 -0.05 0.00 0.00 27.48 27.75 1fgt h GLN 422 CO 0.00 0.00 0.40 -0.51 -0.95 0.00 0.00 178.83 177.77 1fgt s LEU 423 N -5.23 3.73 0.42 1.46 1.43 -0.32 -5.00 118.68 115.18 1fgt s LEU 423 Ca 0.07 1.97 -0.23 0.00 -1.03 0.00 0.00 54.13 54.91 1fgt s LEU 423 Cb 0.09 -4.56 -0.08 0.00 0.03 0.00 0.00 46.19 41.67 1fgt s LEU 423 CO 0.56 -1.02 1.10 0.20 0.23 0.00 0.00 176.35 177.42 1fgt s ASN 424 N -2.12 6.51 -1.70 2.29 0.01 -1.26 -3.30 114.94 115.37 1fgt s ASN 424 Ca 0.68 2.14 0.00 0.00 -0.71 0.00 0.00 52.86 54.97 1fgt s ASN 424 Cb -0.18 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 38.88 1fgt s ASN 424 CO 0.26 -0.67 0.00 -1.20 -1.51 0.00 0.00 177.10 173.98 1fgt n SER 425 N -0.26 -4.42 -3.89 -1.22 7.64 -1.26 -4.96 113.62 105.24 1fgt n SER 425 Ca 0.06 0.36 -0.21 0.00 1.01 0.00 0.00 58.87 60.09 1fgt n SER 425 Cb 0.49 -3.96 -0.16 0.00 -1.01 0.00 0.00 64.21 59.56 1fgt n SER 425 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fgt s ALA 426 N -2.46 0.73 -0.17 -0.43 0.00 -1.21 -4.42 121.76 113.81 1fgt s ALA 426 Ca 0.00 -0.10 -0.09 0.00 0.00 0.00 0.00 51.96 51.77 1fgt s ALA 426 Cb 0.00 -0.46 0.06 0.00 0.00 0.00 0.00 23.12 22.72 1fgt s ALA 426 CO 0.00 -0.04 0.40 0.15 0.00 0.00 0.00 175.76 176.27 1fgt s LYS 427 N 0.98 0.38 0.20 0.00 -0.14 -0.59 -4.31 119.74 116.27 1fgt s LYS 427 Ca -0.10 0.79 -0.01 0.00 -1.36 0.00 0.00 55.97 55.29 1fgt s LYS 427 Cb -0.14 -0.01 -0.04 0.00 -1.68 0.00 0.00 37.83 35.96 1fgt s LYS 427 CO -0.00 -0.17 0.15 -0.08 -0.76 0.00 0.00 175.35 174.49 1fgt s THR 428 N 1.49 0.00 0.21 2.17 -1.32 -1.26 -4.00 115.64 112.92 1fgt s THR 428 Ca -0.09 -1.97 0.09 0.00 -1.21 0.00 0.00 61.69 58.51 1fgt s THR 428 Cb -0.09 -2.49 -0.05 0.00 -1.51 0.00 0.00 72.50 68.37 1fgt s THR 428 CO -0.13 0.00 -0.18 -0.31 -2.21 0.00 0.00 174.62 171.80 1fgt s TYR 429 N -4.14 1.92 -0.41 9.09 2.02 -1.26 -4.95 117.35 119.63 1fgt s TYR 429 Ca 0.38 -0.46 -0.20 0.00 -0.37 0.00 0.00 57.07 56.42 1fgt s TYR 429 Cb 0.07 -0.90 0.02 0.00 -0.40 0.00 0.00 41.96 40.74 1fgt s TYR 429 CO 0.12 0.44 0.58 0.00 -1.57 0.00 0.00 175.55 175.12 1fgt s ALA 430 N -2.44 3.39 0.19 3.71 0.00 -0.05 -4.85 121.76 121.71 1fgt s ALA 430 Ca 0.22 -1.20 0.03 0.00 0.00 0.00 0.00 51.96 51.02 1fgt s ALA 430 Cb -0.04 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.85 1fgt s ALA 430 CO 0.09 -1.61 0.32 0.95 0.00 0.00 0.00 175.76 175.51 1fgt s THR 431 N 2.61 5.29 -0.03 0.00 -4.23 -1.26 -1.68 115.64 116.34 1fgt s THR 431 Ca 0.20 -0.80 -0.01 0.00 -1.18 0.00 0.00 61.69 59.90 1fgt s THR 431 Cb -0.15 -3.79 0.03 0.00 1.34 0.00 0.00 72.50 69.93 1fgt s THR 431 CO 0.17 -0.20 0.05 -0.60 -0.54 0.00 0.00 174.62 173.50 1fgt s ARG 432 N -3.57 -0.02 -0.11 3.99 3.52 -0.66 -0.25 118.95 121.85 1fgt s ARG 432 Ca 0.34 0.25 0.02 0.00 -0.13 0.00 0.00 55.73 56.21 1fgt s ARG 432 Cb -0.10 -0.27 -0.01 0.00 -1.56 0.00 0.00 34.95 33.00 1fgt s ARG 432 CO 0.29 -0.19 -0.16 0.99 -0.81 0.00 0.00 175.30 175.41 1fgt s THR 433 N 1.26 2.80 -0.15 4.11 2.01 -0.44 -0.54 115.64 124.68 1fgt s THR 433 Ca -0.07 -0.77 -0.09 0.00 0.31 0.00 0.00 61.69 61.07 1fgt s THR 433 Cb -0.13 -2.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.20 1fgt s THR 433 CO -0.04 0.54 0.16 -0.63 -0.69 0.00 0.00 174.62 173.97 1fgt s ILE 434 N 0.17 5.42 0.05 1.82 -1.09 -0.07 -1.23 121.20 126.27 1fgt s ILE 434 Ca -0.09 0.26 0.09 0.00 -2.23 0.00 0.00 60.65 58.68 1fgt s ILE 434 Cb -0.15 -3.47 -0.03 0.00 -1.58 0.00 0.00 42.46 37.23 1fgt s ILE 434 CO 0.06 0.52 -0.24 -0.76 -1.23 0.00 0.00 174.94 173.28 1fgt s LEU 435 N -0.26 2.18 -0.09 2.97 1.43 0.32 -1.01 118.68 124.21 1fgt s LEU 435 Ca 0.12 -0.57 0.04 0.00 -1.03 0.00 0.00 54.13 52.69 1fgt s LEU 435 Cb -0.12 -1.16 -0.00 0.00 0.03 0.00 0.00 46.19 44.94 1fgt s LEU 435 CO 0.02 0.22 -0.24 0.12 0.23 0.00 0.00 176.35 176.70 1fgt s PHE 436 N -0.82 2.54 -0.48 0.29 5.36 0.10 -1.00 117.98 123.97 1fgt s PHE 436 Ca 0.10 -0.93 -0.25 0.00 -0.96 0.00 0.00 56.93 54.89 1fgt s PHE 436 Cb -0.10 -1.69 0.03 0.00 -0.34 0.00 0.00 43.02 40.93 1fgt s PHE 436 CO 0.02 -0.35 0.90 -1.17 -1.46 0.00 0.00 175.22 173.16 1fgt s LEU 437 N 0.19 4.07 0.79 6.12 2.96 0.10 -0.75 118.68 132.17 1fgt s LEU 437 Ca -0.14 -0.02 -0.11 0.00 -0.22 0.00 0.00 54.13 53.64 1fgt s LEU 437 Cb -0.17 -3.08 0.07 0.00 0.50 0.00 0.00 46.19 43.51 1fgt s LEU 437 CO 0.07 -1.06 1.09 -0.13 -1.32 0.00 0.00 176.35 175.00 1fgt s ARG 438 N 3.70 2.11 0.56 1.98 0.52 -0.01 -4.88 118.95 122.93 1fgt s ARG 438 Ca 0.34 0.95 0.26 0.00 -0.52 0.00 0.00 55.73 56.76 1fgt s ARG 438 Cb -0.11 -1.90 1.64 0.00 0.52 0.00 0.00 34.95 35.10 1fgt s ARG 438 CO 0.24 -1.68 2.21 0.93 0.02 0.00 0.00 175.30 177.02 1fgt h GLU 439 N -1.15 0.00 0.00 3.54 5.08 -1.96 0.12 114.58 120.21 1fgt h GLU 439 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1fgt h GLU 439 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1fgt h GLU 439 CO 0.55 0.02 0.00 -0.40 -1.00 0.00 0.00 179.01 178.17 1fgt n ASP 440 N -4.01 0.00 0.00 1.42 5.68 -1.26 -4.88 116.55 113.50 1fgt n ASP 440 Ca -0.03 -1.01 0.00 0.00 -0.50 0.00 0.00 54.79 53.25 1fgt n ASP 440 Cb 0.10 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.08 1fgt n ASP 440 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fgt n GLY 441 N 0.78 0.87 3.95 6.12 0.00 0.03 -5.05 105.19 111.88 1fgt n GLY 441 Ca 0.19 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 1fgt n GLY 441 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fgt s THR 442 N -2.78 5.21 0.11 2.61 -4.23 -1.26 -4.79 115.64 110.51 1fgt s THR 442 Ca 0.00 -0.64 -0.13 0.00 -1.18 0.00 0.00 61.69 59.74 1fgt s THR 442 Cb 0.00 -3.81 -0.06 0.00 1.34 0.00 0.00 72.50 69.96 1fgt s THR 442 CO 0.00 -0.33 0.49 -0.76 -0.54 0.00 0.00 174.62 173.48 1fgt s LEU 443 N -3.82 4.37 -0.03 4.79 1.43 -1.26 -0.83 118.68 123.33 1fgt s LEU 443 Ca 0.37 0.99 0.03 0.00 -1.03 0.00 0.00 54.13 54.48 1fgt s LEU 443 Cb -0.10 -3.09 0.00 0.00 0.03 0.00 0.00 46.19 43.03 1fgt s LEU 443 CO 0.31 0.16 -0.10 -1.59 0.23 0.00 0.00 176.35 175.35 1fgt s LYS 444 N -1.81 1.08 0.11 1.70 -2.85 0.07 -4.70 119.74 113.34 1fgt s LYS 444 Ca 0.34 -0.35 -0.30 0.00 -1.00 0.00 0.00 55.97 54.66 1fgt s LYS 444 Cb -0.15 -0.99 -0.06 0.00 -2.06 0.00 0.00 37.83 34.56 1fgt s LYS 444 CO 0.18 0.14 1.09 -1.25 0.10 0.00 0.00 175.35 175.61 1fgt s PRO 445 N 0.16 4.56 -0.00 1.78 0.04 -1.26 -0.72 135.00 139.55 1fgt s PRO 445 Ca -0.03 1.66 0.01 0.00 0.04 0.00 0.00 61.00 62.68 1fgt s PRO 445 Cb -0.09 -3.33 -0.02 0.00 0.04 0.00 0.00 34.50 31.10 1fgt s PRO 445 CO 0.01 -0.01 0.05 1.33 0.04 0.00 0.00 177.00 178.41 1fgt n VAL 446 N 3.05 0.00 -3.59 -0.36 0.24 -0.18 -4.84 118.33 112.66 1fgt n VAL 446 Ca 0.05 -0.33 -0.09 0.00 -2.04 0.00 0.00 64.34 61.92 1fgt n VAL 446 Cb 0.47 0.84 -0.05 0.00 -1.47 0.00 0.00 33.84 33.63 1fgt n VAL 446 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fgt s ALA 447 N -1.42 -1.96 -0.07 2.33 0.00 -1.23 -4.46 121.76 114.95 1fgt s ALA 447 Ca 0.00 1.64 0.01 0.00 0.00 0.00 0.00 51.96 53.61 1fgt s ALA 447 Cb 0.01 -0.87 0.02 0.00 0.00 0.00 0.00 23.12 22.28 1fgt s ALA 447 CO 0.06 -0.29 -0.08 0.42 0.00 0.00 0.00 175.76 175.87 1fgt s ILE 448 N -0.99 0.88 -0.21 0.00 1.01 -0.41 -0.90 121.20 120.59 1fgt s ILE 448 Ca -0.00 -0.28 -0.07 0.00 0.00 0.00 0.00 60.65 60.30 1fgt s ILE 448 Cb -0.01 -0.87 -0.03 0.00 0.01 0.00 0.00 42.46 41.56 1fgt s ILE 448 CO -0.00 0.31 0.05 -0.70 0.00 0.00 0.00 174.94 174.60 1fgt s GLU 449 N 1.11 3.78 -0.45 2.79 2.12 0.30 -0.61 118.70 127.74 1fgt s GLU 449 Ca -0.07 -0.43 -0.07 0.00 0.36 0.00 0.00 54.97 54.76 1fgt s GLU 449 Cb -0.14 -3.21 0.12 0.00 0.26 0.00 0.00 34.13 31.16 1fgt s GLU 449 CO -0.01 0.07 0.29 -0.51 -0.54 0.00 0.00 175.26 174.56 1fgt s LEU 450 N 0.90 5.53 -0.07 2.70 1.43 0.31 -1.65 118.68 127.84 1fgt s LEU 450 Ca 0.03 -1.98 -0.04 0.00 -1.03 0.00 0.00 54.13 51.11 1fgt s LEU 450 Cb -0.14 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 1fgt s LEU 450 CO 0.02 -0.63 0.14 -0.44 0.23 0.00 0.00 176.35 175.67 1fgt s SER 451 N 2.31 6.20 0.06 2.29 0.01 -0.68 -1.22 113.70 122.67 1fgt s SER 451 Ca 0.07 0.36 0.06 0.00 1.31 0.00 0.00 55.95 57.75 1fgt s SER 451 Cb -0.25 -1.95 -0.03 0.00 0.21 0.00 0.00 66.02 64.01 1fgt s SER 451 CO -0.02 0.34 -0.16 -0.76 0.41 0.00 0.00 173.24 173.05 1fgt s LEU 452 N -1.41 2.22 0.50 2.44 1.43 -1.26 -0.87 118.68 121.72 1fgt s LEU 452 Ca 0.20 -0.55 -0.19 0.00 -1.03 0.00 0.00 54.13 52.56 1fgt s LEU 452 Cb -0.12 -0.67 -0.08 0.00 0.03 0.00 0.00 46.19 45.34 1fgt s LEU 452 CO 0.10 0.02 1.03 -2.16 0.23 0.00 0.00 176.35 175.57 1fgt s PRO 453 N -1.43 3.78 -0.01 1.29 0.04 -1.26 -4.74 135.00 132.66 1fgt s PRO 453 Ca 0.02 1.28 0.03 0.00 0.04 0.00 0.00 61.00 62.37 1fgt s PRO 453 Cb -0.09 -2.10 -0.00 0.00 0.04 0.00 0.00 34.50 32.35 1fgt s PRO 453 CO 0.02 -0.44 -0.09 -1.01 0.04 0.00 0.00 177.00 175.53 1fgt s HIS 454 N -2.12 0.82 -0.09 0.56 3.76 0.03 -5.02 115.29 113.22 1fgt s HIS 454 Ca 0.66 -0.17 -0.06 0.00 -0.15 0.00 0.00 55.06 55.33 1fgt s HIS 454 Cb -0.15 -0.54 0.03 0.00 1.11 0.00 0.00 32.58 33.03 1fgt s HIS 454 CO 0.23 -0.04 0.23 0.45 -0.85 0.00 0.00 174.74 174.76 1fgt s SER 455 N -0.09 -0.24 0.15 1.40 0.15 -1.26 -2.75 113.70 111.06 1fgt s SER 455 Ca 0.02 0.47 -0.34 0.00 0.70 0.00 0.00 55.95 56.79 1fgt s SER 455 Cb -0.05 0.42 -0.15 0.00 -1.71 0.00 0.00 66.02 64.54 1fgt s SER 455 CO -0.00 -0.12 1.45 0.00 1.20 0.00 0.00 173.24 175.78 1fgt n ALA 456 N 3.53 0.42 -0.03 5.45 0.00 -1.26 -1.29 120.51 127.32 1fgt n ALA 456 Ca -0.18 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1fgt n ALA 456 Cb 0.56 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1fgt n ALA 456 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fgt n GLY 457 N 2.89 0.64 3.77 0.00 0.00 -1.26 -5.06 105.19 106.17 1fgt n GLY 457 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1fgt n GLY 457 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fgt s ASP 458 N -2.74 6.72 0.12 1.61 1.01 -0.41 -4.92 116.67 118.05 1fgt s ASP 458 Ca 0.00 2.71 0.03 0.00 0.71 0.00 0.00 52.55 56.00 1fgt s ASP 458 Cb 0.00 -2.65 -0.19 0.00 1.01 0.00 0.00 42.92 41.09 1fgt s ASP 458 CO 0.00 -0.59 1.26 -0.07 0.21 0.00 0.00 175.17 175.98 1fgt h LEU 459 N 3.70 0.14 -9.80 1.23 3.38 -1.97 -3.46 115.31 108.54 1fgt h LEU 459 Ca -0.48 -0.15 -0.51 0.00 0.09 0.00 0.00 57.88 56.83 1fgt h LEU 459 Cb 1.23 -0.05 0.02 0.00 0.09 0.00 0.00 40.66 41.95 1fgt h LEU 459 CO 0.68 1.09 0.50 -0.55 0.09 0.00 0.00 178.44 180.25 1fgt s SER 460 N -6.86 7.19 0.00 -0.43 0.15 -1.26 -4.94 113.70 107.55 1fgt s SER 460 Ca -0.01 2.32 0.24 0.00 0.70 0.00 0.00 55.95 59.20 1fgt s SER 460 Cb 0.09 -2.63 0.23 0.00 -1.71 0.00 0.00 66.02 62.00 1fgt s SER 460 CO 0.84 -0.22 1.27 0.00 1.20 0.00 0.00 173.24 176.33 1fgt n ALA 461 N 1.30 2.63 -1.77 5.45 0.00 -1.26 -4.97 120.51 121.89 1fgt n ALA 461 Ca -0.00 -0.66 -0.40 0.00 0.00 0.00 0.00 53.44 52.37 1fgt n ALA 461 Cb 0.44 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 1fgt n ALA 461 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fgt s ALA 462 N -2.07 3.33 0.27 0.00 0.00 -1.26 -5.02 121.76 117.00 1fgt s ALA 462 Ca 0.27 1.29 0.05 0.00 0.00 0.00 0.00 51.96 53.57 1fgt s ALA 462 Cb 0.20 -3.51 -0.06 0.00 0.00 0.00 0.00 23.12 19.76 1fgt s ALA 462 CO 0.34 -0.85 -0.02 0.14 0.00 0.00 0.00 175.76 175.38 1fgt s VAL 463 N -1.22 1.33 0.67 0.00 -7.23 -1.26 -5.02 120.40 107.66 1fgt s VAL 463 Ca 0.55 -2.07 -0.15 0.00 -1.81 0.00 0.00 61.98 58.51 1fgt s VAL 463 Cb -0.40 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.09 1fgt s VAL 463 CO 0.52 -0.26 1.13 -0.44 -0.31 0.00 0.00 175.10 175.73 1fgt s SER 464 N -3.40 4.96 0.10 4.85 0.01 -1.26 -4.85 113.70 114.11 1fgt s SER 464 Ca 0.30 2.08 -0.23 0.00 1.31 0.00 0.00 55.95 59.41 1fgt s SER 464 Cb 0.05 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.78 1fgt s SER 464 CO 0.11 -1.74 0.56 0.00 0.41 0.00 0.00 173.24 172.59 1fgt s GLN 465 N -4.01 1.17 -0.12 12.44 -2.07 -0.36 -5.01 119.66 121.70 1fgt s GLN 465 Ca 0.69 -0.36 -0.03 0.00 -1.82 0.00 0.00 55.36 53.84 1fgt s GLN 465 Cb -0.22 0.54 -0.03 0.00 -1.09 0.00 0.00 33.01 32.20 1fgt s GLN 465 CO 0.41 -0.47 -0.01 0.08 -1.32 0.00 0.00 175.29 173.98 1fgt s VAL 466 N -3.15 4.17 -0.06 3.63 1.01 -1.26 -0.53 120.40 124.21 1fgt s VAL 466 Ca -0.02 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 61.73 1fgt s VAL 466 Cb -0.00 -2.79 -0.00 0.00 0.00 0.00 0.00 36.38 33.58 1fgt s VAL 466 CO -0.08 0.55 -0.21 -0.69 0.00 0.00 0.00 175.10 174.68 1fgt s VAL 467 N -0.31 1.72 0.24 2.92 1.01 0.22 -5.00 120.40 121.20 1fgt s VAL 467 Ca 0.06 -0.87 0.08 0.00 0.00 0.00 0.00 61.98 61.26 1fgt s VAL 467 Cb -0.12 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1fgt s VAL 467 CO 0.02 0.49 0.04 -0.76 0.00 0.00 0.00 175.10 174.89 1fgt s LEU 468 N 0.04 3.35 0.46 3.92 1.43 -1.26 -1.28 118.68 125.33 1fgt s LEU 468 Ca -0.06 -0.50 -0.24 0.00 -1.03 0.00 0.00 54.13 52.30 1fgt s LEU 468 Cb -0.13 -1.91 -0.09 0.00 0.03 0.00 0.00 46.19 44.09 1fgt s LEU 468 CO 0.04 0.02 1.10 -2.65 0.23 0.00 0.00 176.35 175.09 1fgt n PRO 469 N -0.76 1.48 -3.66 1.29 -0.02 -1.26 -4.73 135.00 127.33 1fgt n PRO 469 Ca -0.08 0.54 -0.13 0.00 -2.02 0.00 0.00 63.50 61.81 1fgt n PRO 469 Cb 0.58 -2.20 -0.08 0.00 -0.02 0.00 0.00 33.50 31.78 1fgt n PRO 469 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fgt s ALA 470 N -1.29 -1.55 -0.23 3.55 0.00 -1.26 -5.03 121.76 115.95 1fgt s ALA 470 Ca 0.65 1.83 0.17 0.00 0.00 0.00 0.00 51.96 54.61 1fgt s ALA 470 Cb -0.51 -1.07 -0.24 0.00 0.00 0.00 0.00 23.12 21.30 1fgt s ALA 470 CO 0.55 -0.30 0.46 1.63 0.00 0.00 0.00 175.76 178.10 1fgt n LYS 471 N 3.07 0.80 -4.33 0.00 5.02 -1.26 -4.23 118.16 117.22 1fgt n LYS 471 Ca -0.15 -0.11 -0.18 0.00 -2.02 0.00 0.00 58.31 55.85 1fgt n LYS 471 Cb 0.56 -1.37 -0.10 0.00 -0.02 0.00 0.00 35.03 34.10 1fgt n LYS 471 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1fgt s GLU 472 N -3.01 1.30 1.62 1.97 2.02 -1.26 -4.81 118.70 116.53 1fgt s GLU 472 Ca -0.03 -1.59 0.00 0.00 0.02 0.00 0.00 54.97 53.38 1fgt s GLU 472 Cb 0.11 -1.00 0.00 0.00 0.10 0.00 0.00 34.13 33.34 1fgt s GLU 472 CO 0.70 0.14 0.00 0.41 0.02 0.00 0.00 175.26 176.53 1fgt n GLY 473 N -0.37 -1.36 0.25 -1.39 0.00 -1.26 -2.58 105.19 98.48 1fgt n GLY 473 Ca -0.08 -1.19 0.10 0.00 0.00 0.00 0.00 46.02 44.85 1fgt n GLY 473 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1fgt h VAL 474 N 0.00 0.79 -0.66 1.61 3.04 -1.93 -1.54 116.25 117.55 1fgt h VAL 474 Ca 0.00 -0.48 -0.01 0.00 -1.01 0.00 0.00 66.70 65.20 1fgt h VAL 474 Cb 0.00 1.28 -0.03 0.00 -2.01 0.00 0.00 31.29 30.53 1fgt h VAL 474 CO 0.00 0.12 0.36 -0.33 -1.01 0.00 0.00 177.57 176.71 1fgt h GLU 475 N 0.00 0.92 -0.11 4.17 3.07 -1.96 0.05 114.58 120.71 1fgt h GLU 475 Ca -0.00 -0.10 -0.10 0.00 -0.50 0.00 0.00 59.36 58.66 1fgt h GLU 475 Cb 0.27 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.98 1fgt h GLU 475 CO 0.02 0.68 -0.39 0.66 -1.40 0.00 0.00 179.01 178.58 1fgt h SER 476 N 0.92 0.24 -0.24 1.42 4.64 -1.01 -1.35 113.55 118.17 1fgt h SER 476 Ca 0.24 -0.09 -0.18 0.00 -0.47 0.00 0.00 61.79 61.28 1fgt h SER 476 Cb 0.03 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1fgt h SER 476 CO -0.04 0.61 -0.56 0.74 -0.87 0.00 0.00 176.83 176.71 1fgt h THR 477 N 0.20 1.29 -0.77 2.95 2.02 -1.15 -0.94 112.91 116.50 1fgt h THR 477 Ca 0.02 -1.75 -0.05 0.00 0.77 0.00 0.00 66.41 65.40 1fgt h THR 477 Cb 0.77 1.75 -0.03 0.00 -1.74 0.00 0.00 68.15 68.90 1fgt h THR 477 CO 0.06 0.56 0.27 0.40 0.37 0.00 0.00 175.52 177.18 1fgt h ILE 478 N 0.56 1.26 -0.54 3.11 2.04 -0.86 -0.81 117.51 122.27 1fgt h ILE 478 Ca -0.00 -0.87 -0.09 0.00 1.00 0.00 0.00 64.86 64.90 1fgt h ILE 478 Cb 1.17 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 1fgt h ILE 478 CO 0.12 0.35 -0.00 -0.25 0.00 0.00 0.00 178.15 178.37 1fgt h TRP 479 N 1.13 1.05 -0.85 1.37 2.91 -1.17 0.67 115.95 121.06 1fgt h TRP 479 Ca 0.25 -0.18 -0.01 0.00 1.13 0.00 0.00 58.89 60.08 1fgt h TRP 479 Cb 0.26 -0.27 -0.04 0.00 -0.51 0.00 0.00 29.16 28.60 1fgt h TRP 479 CO 0.02 0.96 0.49 1.25 -1.03 0.00 0.00 178.44 180.13 1fgt h LEU 480 N 0.84 1.03 -0.67 0.65 5.85 -0.83 -1.11 115.31 121.08 1fgt h LEU 480 Ca 0.15 -0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 1fgt h LEU 480 Cb 0.54 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1fgt h LEU 480 CO 0.03 0.81 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.85 1fgt h LEU 481 N 1.17 0.99 -0.86 2.25 3.38 -0.90 -1.56 115.31 119.78 1fgt h LEU 481 Ca 0.30 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1fgt h LEU 481 Cb -0.01 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 1fgt h LEU 481 CO -0.05 1.06 0.56 0.00 0.09 0.00 0.00 178.44 180.10 1fgt h ALA 482 N 1.04 1.12 -0.77 1.53 0.00 -0.38 0.25 119.26 122.05 1fgt h ALA 482 Ca 0.16 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1fgt h ALA 482 Cb 0.57 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1fgt h ALA 482 CO 0.03 0.44 0.33 0.87 0.00 0.00 0.00 179.25 180.93 1fgt h LYS 483 N 1.12 1.13 -0.74 0.00 1.57 -0.82 -1.62 116.57 117.22 1fgt h LYS 483 Ca 0.33 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 1fgt h LYS 483 Cb -0.05 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.03 1fgt h LYS 483 CO -0.10 0.90 0.38 0.00 -0.57 0.00 0.00 179.45 180.06 1fgt h ALA 484 N 1.25 0.95 -0.83 3.86 0.00 -0.18 0.57 119.26 124.88 1fgt h ALA 484 Ca 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1fgt h ALA 484 Cb 0.17 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1fgt h ALA 484 CO -0.03 0.48 0.38 1.88 0.00 0.00 0.00 179.25 181.97 1fgt h TYR 485 N 1.02 1.20 -0.08 0.00 0.05 -0.56 0.36 116.97 118.96 1fgt h TYR 485 Ca 0.26 -0.06 -0.00 0.00 0.05 0.00 0.00 58.73 58.97 1fgt h TYR 485 Cb 0.07 -0.37 -0.00 0.00 1.01 0.00 0.00 36.73 37.44 1fgt h TYR 485 CO 0.00 0.88 0.04 0.28 -1.05 0.00 0.00 178.16 178.31 1fgt h VAL 486 N 1.18 1.10 0.00 -2.88 2.07 -0.88 -2.23 116.25 114.61 1fgt h VAL 486 Ca 0.28 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1fgt h VAL 486 Cb 0.14 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1fgt h VAL 486 CO -0.03 0.08 -0.28 0.40 0.02 0.00 0.00 177.57 177.76 1fgt h ILE 487 N 0.02 0.95 -0.37 4.57 1.08 -0.46 0.13 117.51 123.43 1fgt h ILE 487 Ca 0.03 -1.07 -0.03 0.00 -0.39 0.00 0.00 64.86 63.40 1fgt h ILE 487 Cb 0.10 1.62 -0.02 0.00 -3.07 0.00 0.00 36.82 35.45 1fgt h ILE 487 CO -0.00 0.28 0.12 0.58 -0.69 0.00 0.00 178.15 178.43 1fgt h VAL 488 N 0.00 1.21 -0.36 1.67 2.07 -0.74 0.52 116.25 120.61 1fgt h VAL 488 Ca -0.00 -0.69 0.02 0.00 0.82 0.00 0.00 66.70 66.85 1fgt h VAL 488 Cb 0.60 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1fgt h VAL 488 CO 0.04 0.24 0.19 0.78 0.02 0.00 0.00 177.57 178.84 1fgt h ASN 489 N 0.45 0.29 -0.77 0.57 -0.26 -0.78 -1.78 115.58 113.29 1fgt h ASN 489 Ca 0.12 0.01 -0.05 0.00 -0.56 0.00 0.00 56.30 55.82 1fgt h ASN 489 Cb 0.25 -0.04 -0.03 0.00 -1.06 0.00 0.00 38.32 37.44 1fgt h ASN 489 CO -0.00 0.21 0.29 -0.78 -1.06 0.00 0.00 177.43 176.09 1fgt h ASP 490 N 0.39 1.08 -0.49 5.81 3.58 -0.56 -0.14 116.42 126.09 1fgt h ASP 490 Ca 0.15 -0.18 -0.11 0.00 0.42 0.00 0.00 57.03 57.30 1fgt h ASP 490 Cb 0.05 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.80 1fgt h ASP 490 CO -0.10 0.97 -0.13 -1.28 -2.88 0.00 0.00 179.24 175.83 1fgt h SER 491 N 1.12 0.98 -0.23 2.28 0.87 0.21 0.49 113.55 119.27 1fgt h SER 491 Ca 0.25 -0.33 -0.02 0.00 -1.23 0.00 0.00 61.79 60.47 1fgt h SER 491 Cb 0.24 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 1fgt h SER 491 CO -0.02 1.10 0.07 0.00 -0.53 0.00 0.00 176.83 177.46 1fgt h TYR 493 N 0.20 1.19 0.17 0.00 3.20 -0.80 -1.24 116.97 119.69 1fgt h TYR 493 Ca 0.07 -0.17 -0.01 0.00 3.14 0.00 0.00 58.73 61.77 1fgt h TYR 493 Cb 0.24 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.19 1fgt h TYR 493 CO 0.00 1.00 -0.08 1.25 -1.64 0.00 0.00 178.16 178.69 1fgt h HIS 494 N 1.05 -0.21 -0.35 -3.82 2.76 0.20 0.13 115.15 114.92 1fgt h HIS 494 Ca 0.20 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.31 1fgt h HIS 494 Cb 0.45 0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.47 1fgt h HIS 494 CO 0.03 -0.10 -0.00 0.37 -1.30 0.00 0.00 177.93 176.94 1fgt h GLN 495 N -0.27 0.61 0.11 5.26 5.75 -0.74 0.90 115.11 126.73 1fgt h GLN 495 Ca -0.02 -0.20 -0.30 0.00 -0.15 0.00 0.00 58.65 57.98 1fgt h GLN 495 Cb 0.21 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1fgt h GLN 495 CO 0.04 0.73 -1.55 -0.07 -2.65 0.00 0.00 178.83 175.33 1fgt h LEU 496 N 0.42 0.36 0.00 -2.39 3.38 -1.26 -1.48 115.31 114.34 1fgt h LEU 496 Ca 0.10 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1fgt h LEU 496 Cb 0.46 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1fgt h LEU 496 CO 0.02 1.43 -0.58 0.23 0.09 0.00 0.00 178.44 179.63 1fgt n MET 497 N -3.43 0.31 -0.34 1.13 2.81 0.39 -0.77 117.12 117.21 1fgt n MET 497 Ca -0.17 0.12 0.03 0.00 -1.81 0.00 0.00 57.70 55.87 1fgt n MET 497 Cb 1.04 -1.01 0.20 0.00 -0.71 0.00 0.00 33.22 32.74 1fgt n MET 497 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 1fgt h SER 498 N -0.58 1.00 0.00 7.83 0.02 -1.20 -0.17 113.55 120.46 1fgt h SER 498 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1fgt h SER 498 Cb 0.58 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1fgt h SER 498 CO 0.00 0.65 0.00 1.57 -1.14 0.00 0.00 176.83 177.91 1fgt n HIS 499 N -4.48 0.00 0.43 3.45 -0.00 0.30 -4.24 115.22 110.68 1fgt n HIS 499 Ca 0.14 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.67 1fgt n HIS 499 Cb 0.17 -0.11 -0.09 0.00 -0.00 0.00 0.00 29.99 29.95 1fgt n HIS 499 CO 0.00 0.00 0.00 2.35 -0.00 0.00 0.00 176.34 178.69 1fgt h TRP 500 N 0.00 -1.00 0.36 1.57 2.91 -1.36 -2.11 115.95 116.32 1fgt h TRP 500 Ca 0.00 -0.02 -0.02 0.00 1.13 0.00 0.00 58.89 59.98 1fgt h TRP 500 Cb 0.00 0.33 0.00 0.00 -0.51 0.00 0.00 29.16 28.98 1fgt h TRP 500 CO 0.00 -0.62 -0.17 1.25 -1.03 0.00 0.00 178.44 177.86 1fgt h LEU 501 N -1.08 -0.41 -1.29 0.65 5.85 -0.89 -0.08 115.31 118.06 1fgt h LEU 501 Ca -0.11 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1fgt h LEU 501 Cb 0.83 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.96 1fgt h LEU 501 CO 0.18 -0.13 -0.08 0.78 -0.34 0.00 0.00 178.44 178.85 1fgt h ASN 502 N -0.69 0.00 0.00 1.25 2.35 -1.11 -0.82 115.58 116.56 1fgt h ASN 502 Ca -0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1fgt h ASN 502 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1fgt h ASN 502 CO 0.08 0.08 0.00 0.35 -1.65 0.00 0.00 177.43 176.29 1fgt n THR 503 N -3.20 0.00 -0.19 2.81 -2.24 -0.80 -4.58 114.28 106.08 1fgt n THR 503 Ca 0.01 0.04 -0.12 0.00 -2.27 0.00 0.00 64.05 61.71 1fgt n THR 503 Cb 0.36 -0.80 -0.08 0.00 -2.10 0.00 0.00 70.33 67.71 1fgt n THR 503 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1fgt h HIS 504 N 0.00 -1.57 -0.13 4.78 3.86 -1.51 -1.37 115.15 119.22 1fgt h HIS 504 Ca 0.00 0.09 -0.18 0.00 -1.16 0.00 0.00 60.37 59.12 1fgt h HIS 504 Cb 0.00 0.75 0.01 0.00 1.06 0.00 0.00 27.41 29.23 1fgt h HIS 504 CO 0.00 -0.46 -0.62 0.00 0.86 0.00 0.00 177.93 177.72 1fgt h ALA 505 N 0.25 0.25 0.00 2.45 0.00 -1.08 -3.10 119.26 118.02 1fgt h ALA 505 Ca 0.12 -0.54 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 1fgt h ALA 505 Cb 0.57 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1fgt h ALA 505 CO -0.66 0.51 -0.31 0.00 0.00 0.00 0.00 179.25 178.79 1fgt h ALA 506 N 0.51 1.27 0.02 0.00 0.00 -1.04 -3.17 119.26 116.85 1fgt h ALA 506 Ca -0.04 -0.28 -0.23 0.00 0.00 0.00 0.00 54.91 54.36 1fgt h ALA 506 Cb 1.25 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1fgt h ALA 506 CO 0.13 0.38 -1.12 1.98 0.00 0.00 0.00 179.25 180.62 1fgt h MET 507 N 0.00 0.05 -0.80 0.00 4.05 -1.28 -3.37 114.93 113.58 1fgt h MET 507 Ca -0.00 -0.09 0.12 0.00 -0.28 0.00 0.00 59.70 59.44 1fgt h MET 507 Cb 0.63 0.03 -0.08 0.00 -0.80 0.00 0.00 31.60 31.38 1fgt h MET 507 CO 0.04 1.00 0.42 1.49 0.23 0.00 0.00 176.91 180.09 1fgt h GLU 508 N 0.01 0.64 -0.85 0.39 4.81 -1.50 -0.73 114.58 117.35 1fgt h GLU 508 Ca -0.06 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.22 1fgt h GLU 508 Cb 1.83 -0.15 -0.06 0.00 0.63 0.00 0.00 28.75 31.01 1fgt h GLU 508 CO 0.14 0.43 0.55 -1.35 -0.73 0.00 0.00 179.01 178.05 1fgt h PRO 509 N 0.66 0.81 -0.09 0.92 0.11 -1.73 -0.82 132.00 131.85 1fgt h PRO 509 Ca 0.41 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.36 1fgt h PRO 509 Cb 0.48 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 1fgt h PRO 509 CO -0.30 0.53 -0.44 0.74 -0.21 0.00 0.00 178.00 178.32 1fgt h PHE 510 N 0.83 0.26 -0.13 0.65 0.04 -1.36 -1.19 116.94 116.03 1fgt h PHE 510 Ca 0.39 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 61.07 1fgt h PHE 510 Cb 0.41 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.50 1fgt h PHE 510 CO -0.00 0.63 -0.00 0.28 -0.60 0.00 0.00 178.31 178.61 1fgt h VAL 511 N 0.18 1.26 0.20 -0.55 2.07 -0.87 -1.71 116.25 116.82 1fgt h VAL 511 Ca 0.01 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 1fgt h VAL 511 Cb 0.86 1.56 -0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1fgt h VAL 511 CO 0.07 0.25 -0.11 0.40 0.02 0.00 0.00 177.57 178.19 1fgt h ILE 512 N -0.04 0.77 -0.87 4.57 2.04 -1.16 -2.50 117.51 120.32 1fgt h ILE 512 Ca 0.04 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.97 1fgt h ILE 512 Cb 0.38 0.77 -0.07 0.00 -0.74 0.00 0.00 36.82 37.16 1fgt h ILE 512 CO 0.01 0.00 0.53 0.00 0.00 0.00 0.00 178.15 178.69 1fgt h ALA 513 N 0.50 1.21 -0.45 1.87 0.00 -1.20 -1.39 119.26 119.80 1fgt h ALA 513 Ca -0.02 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1fgt h ALA 513 Cb 0.23 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1fgt h ALA 513 CO 0.03 0.25 0.27 1.15 0.00 0.00 0.00 179.25 180.95 1fgt h THR 514 N 0.95 1.06 -0.00 0.00 2.02 -1.04 -0.20 112.91 115.70 1fgt h THR 514 Ca 0.39 -0.19 -0.15 0.00 0.77 0.00 0.00 66.41 67.24 1fgt h THR 514 Cb 0.23 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1fgt h THR 514 CO -0.19 0.10 -0.69 0.45 0.37 0.00 0.00 175.52 175.56 1fgt h HIS 515 N 0.55 0.00 0.00 3.16 3.86 -1.08 -0.99 115.15 120.65 1fgt h HIS 515 Ca 0.17 -0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.24 1fgt h HIS 515 Cb -0.01 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 1fgt h HIS 515 CO -0.06 0.69 -0.67 0.00 0.86 0.00 0.00 177.93 178.75 1fgt h ARG 516 N 0.00 0.00 0.00 2.45 3.08 -0.92 -3.40 114.38 115.58 1fgt h ARG 516 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1fgt h ARG 516 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 1fgt h ARG 516 CO 0.09 0.67 -0.43 0.72 -1.07 0.00 0.00 179.97 179.95 1fgt n HIS 517 N -3.61 0.00 -3.81 3.04 8.25 -0.12 -4.77 115.22 114.21 1fgt n HIS 517 Ca -0.01 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.09 1fgt n HIS 517 Cb 0.69 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.67 1fgt n HIS 517 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1fgt s LEU 518 N -1.98 3.31 0.72 2.41 1.43 -0.38 -4.67 118.68 119.52 1fgt s LEU 518 Ca 0.00 -0.33 -0.15 0.00 -1.03 0.00 0.00 54.13 52.62 1fgt s LEU 518 Cb 0.00 -1.86 0.04 0.00 0.03 0.00 0.00 46.19 44.40 1fgt s LEU 518 CO 0.00 -0.05 1.18 -0.55 0.23 0.00 0.00 176.35 177.16 1fgt s SER 519 N 1.55 4.37 0.65 2.29 0.15 -1.26 -4.64 113.70 116.82 1fgt s SER 519 Ca 0.06 2.24 0.36 0.00 0.70 0.00 0.00 55.95 59.30 1fgt s SER 519 Cb -0.15 -2.58 1.96 0.00 -1.71 0.00 0.00 66.02 63.54 1fgt s SER 519 CO 0.01 -2.14 2.13 -0.37 1.20 0.00 0.00 173.24 174.07 1fgt h VAL 520 N -0.32 0.08 0.00 4.45 -1.51 -1.95 0.11 116.25 117.11 1fgt h VAL 520 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 1fgt h VAL 520 Cb 1.28 0.83 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1fgt h VAL 520 CO 0.50 0.00 -0.00 -0.07 -1.23 0.00 0.00 177.57 176.77 1fgt h LEU 521 N 0.00 0.00 -9.63 4.19 3.38 -1.89 -3.43 115.31 107.93 1fgt h LEU 521 Ca 0.02 -0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.46 1fgt h LEU 521 Cb 0.38 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.16 1fgt h LEU 521 CO -0.00 0.00 0.71 -2.28 0.09 0.00 0.00 178.44 176.96 1fgt s HIS 522 N -3.15 3.21 0.42 1.13 2.46 0.38 -0.98 115.29 118.75 1fgt s HIS 522 Ca 0.09 1.06 0.10 0.00 0.47 0.00 0.00 55.06 56.78 1fgt s HIS 522 Cb 0.09 -3.68 0.93 0.00 -0.13 0.00 0.00 32.58 29.79 1fgt s HIS 522 CO 0.63 -2.26 2.02 -1.00 -2.47 0.00 0.00 174.74 171.65 1fgt h PRO 523 N 5.93 0.49 0.00 2.88 0.13 -1.88 -1.20 132.00 138.35 1fgt h PRO 523 Ca -0.44 -0.03 -0.18 0.00 -0.87 0.00 0.00 66.00 64.49 1fgt h PRO 523 Cb 1.21 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 1fgt h PRO 523 CO 0.81 0.32 -0.83 0.82 -0.23 0.00 0.00 178.00 178.90 1fgt h ILE 524 N 0.50 1.59 -0.20 -3.56 1.08 -1.94 -0.34 117.51 114.64 1fgt h ILE 524 Ca 0.21 -2.81 -0.01 0.00 -0.39 0.00 0.00 64.86 61.86 1fgt h ILE 524 Cb 0.21 2.52 -0.01 0.00 -3.07 0.00 0.00 36.82 36.48 1fgt h ILE 524 CO -0.06 0.80 0.07 0.22 -0.69 0.00 0.00 178.15 178.50 1fgt h TYR 525 N 0.01 0.31 -0.20 1.37 5.03 -1.57 -0.87 116.97 121.04 1fgt h TYR 525 Ca -0.01 -0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.21 1fgt h TYR 525 Cb 1.46 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 39.64 1fgt h TYR 525 CO 0.00 0.36 -0.15 0.87 -1.32 0.00 0.00 178.16 177.93 1fgt h LYS 526 N 0.16 0.34 -0.27 1.82 1.57 -1.04 -0.92 116.57 118.23 1fgt h LYS 526 Ca 0.07 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 1fgt h LYS 526 Cb 0.19 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1fgt h LYS 526 CO -0.00 0.49 -0.21 1.25 -0.57 0.00 0.00 179.45 180.40 1fgt h LEU 527 N 0.32 0.65 0.08 2.94 5.85 -0.74 -3.39 115.31 121.02 1fgt h LEU 527 Ca 0.06 -0.45 -0.33 0.00 0.84 0.00 0.00 57.88 58.00 1fgt h LEU 527 Cb 0.45 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1fgt h LEU 527 CO 0.03 0.96 -1.86 -0.07 -0.34 0.00 0.00 178.44 177.16 1fgt h LEU 528 N 0.35 0.25 -1.84 2.25 3.38 -1.03 -3.41 115.31 115.26 1fgt h LEU 528 Ca 0.05 -0.56 0.15 0.00 0.09 0.00 0.00 57.88 57.61 1fgt h LEU 528 Cb 0.76 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 1fgt h LEU 528 CO 0.06 1.50 0.43 0.71 0.09 0.00 0.00 178.44 181.22 1fgt h THR 529 N 0.04 0.76 0.00 0.22 1.35 -1.35 0.55 112.91 114.49 1fgt h THR 529 Ca -0.36 -0.06 -0.01 0.00 -0.55 0.00 0.00 66.41 65.43 1fgt h THR 529 Cb 2.03 0.59 -0.00 0.00 -1.73 0.00 0.00 68.15 69.03 1fgt h THR 529 CO 0.09 0.03 -0.06 -0.65 -0.25 0.00 0.00 175.52 174.68 1fgt h PRO 530 N 0.16 0.00 -0.06 4.72 0.11 -1.80 -0.83 132.00 134.31 1fgt h PRO 530 Ca 0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.40 1fgt h PRO 530 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1fgt h PRO 530 CO -0.04 0.06 0.00 0.72 -0.21 0.00 0.00 178.00 178.53 1fgt n HIS 531 N -3.82 0.08 0.29 0.65 8.25 0.19 -3.20 115.22 117.65 1fgt n HIS 531 Ca -0.02 -0.04 0.03 0.00 -0.26 0.00 0.00 57.72 57.43 1fgt n HIS 531 Cb 0.15 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.28 1fgt n HIS 531 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1fgt n TYR 532 N -0.39 0.00 -1.69 4.41 4.01 -0.32 -4.24 117.16 118.95 1fgt n TYR 532 Ca 0.08 0.00 -0.56 0.00 -0.16 0.00 0.00 57.90 57.26 1fgt n TYR 532 Cb 0.09 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.06 1fgt n TYR 532 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1fgt n ARG 533 N -0.03 1.24 -0.73 -0.72 0.63 -1.19 -1.58 116.66 114.27 1fgt n ARG 533 Ca 0.03 0.45 0.00 0.00 -0.92 0.00 0.00 57.85 57.42 1fgt n ARG 533 Cb 0.15 -2.14 0.00 0.00 0.45 0.00 0.00 32.46 30.92 1fgt n ARG 533 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1fgt n ASN 534 N 4.91 0.00 0.02 6.15 5.15 -1.26 -4.09 115.26 126.14 1fgt n ASN 534 Ca 0.25 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 54.10 1fgt n ASN 534 Cb 0.15 -1.32 -0.08 0.00 -0.53 0.00 0.00 39.78 38.00 1fgt n ASN 534 CO 0.00 0.00 0.00 -1.13 1.40 0.00 0.00 177.26 177.53 1fgt h ASN 535 N 0.00 -0.02 -0.28 1.20 -0.00 -1.17 -0.06 115.58 115.25 1fgt h ASN 535 Ca 0.00 -0.22 -0.05 0.00 -0.00 0.00 0.00 56.30 56.03 1fgt h ASN 535 Cb 0.00 0.01 -0.02 0.00 -0.00 0.00 0.00 38.32 38.31 1fgt h ASN 535 CO 0.00 0.20 0.01 0.24 -0.00 0.00 0.00 177.43 177.88 1fgt h MET 536 N -0.24 0.59 0.30 6.67 2.86 -1.88 -1.15 114.93 122.08 1fgt h MET 536 Ca -0.00 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1fgt h MET 536 Cb 0.23 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.81 1fgt h MET 536 CO 0.00 0.61 -0.15 -0.97 1.06 0.00 0.00 176.91 177.47 1fgt h ASN 537 N 0.57 -0.34 -0.15 1.22 -1.24 -1.70 -0.72 115.58 113.22 1fgt h ASN 537 Ca 0.12 -0.11 -0.05 0.00 0.71 0.00 0.00 56.30 56.96 1fgt h ASN 537 Cb 0.35 0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.47 1fgt h ASN 537 CO 0.01 -0.08 -0.06 0.16 -1.29 0.00 0.00 177.43 176.17 1fgt h ILE 538 N -0.60 1.20 -0.53 2.57 3.07 -0.92 -1.86 117.51 120.44 1fgt h ILE 538 Ca -0.04 -0.83 -0.05 0.00 1.55 0.00 0.00 64.86 65.49 1fgt h ILE 538 Cb 0.44 1.05 -0.02 0.00 -0.27 0.00 0.00 36.82 38.01 1fgt h ILE 538 CO 0.07 0.28 0.12 0.78 -1.05 0.00 0.00 178.15 178.34 1fgt h ASN 539 N 0.43 0.81 -0.64 2.16 4.21 -1.04 0.61 115.58 122.12 1fgt h ASN 539 Ca 0.09 -0.24 -0.07 0.00 1.21 0.00 0.00 56.30 57.29 1fgt h ASN 539 Cb 0.37 -0.21 -0.03 0.00 -1.12 0.00 0.00 38.32 37.33 1fgt h ASN 539 CO 0.02 0.84 0.14 0.00 -1.29 0.00 0.00 177.43 177.14 1fgt h ALA 540 N 1.00 0.85 0.00 -0.83 0.00 -0.76 -0.09 119.26 119.42 1fgt h ALA 540 Ca 0.16 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1fgt h ALA 540 Cb 0.36 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1fgt h ALA 540 CO 0.00 0.58 -0.32 -0.07 0.00 0.00 0.00 179.25 179.44 1fgt h LEU 541 N 0.96 0.00 -0.22 0.00 3.38 -1.15 -2.29 115.31 115.99 1fgt h LEU 541 Ca 0.20 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.01 1fgt h LEU 541 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1fgt h LEU 541 CO 0.01 0.32 -0.49 0.00 0.09 0.00 0.00 178.44 178.37 1fgt h ALA 542 N 1.68 0.35 0.00 1.53 0.00 -0.13 -1.27 119.26 121.43 1fgt h ALA 542 Ca -0.00 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1fgt h ALA 542 Cb 0.60 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1fgt h ALA 542 CO 0.04 0.52 -0.14 0.00 0.00 0.00 0.00 179.25 179.67 1fgt h ARG 543 N 0.43 0.00 0.21 0.00 3.08 -0.71 0.17 114.38 117.57 1fgt h ARG 543 Ca 0.00 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.72 1fgt h ARG 543 Cb 1.10 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.17 1fgt h ARG 543 CO 0.11 0.14 -1.52 0.37 -1.07 0.00 0.00 179.97 178.00 1fgt h GLN 544 N 0.00 0.45 0.00 0.04 4.15 -1.23 -3.32 115.11 115.19 1fgt h GLN 544 Ca -0.00 -0.77 0.00 0.00 0.77 0.00 0.00 58.65 58.65 1fgt h GLN 544 Cb 0.26 0.29 0.00 0.00 0.21 0.00 0.00 27.48 28.24 1fgt h GLN 544 CO 0.02 1.36 -0.29 0.43 -1.93 0.00 0.00 178.83 178.42 1fgt n SER 545 N -3.64 1.45 -0.13 -0.69 7.64 -0.49 -4.69 113.62 113.07 1fgt n SER 545 Ca -0.17 -0.13 -0.27 0.00 1.01 0.00 0.00 58.87 59.31 1fgt n SER 545 Cb 1.08 0.54 -0.11 0.00 -1.01 0.00 0.00 64.21 64.72 1fgt n SER 545 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1fgt n LEU 546 N -0.69 2.13 -0.65 -3.43 7.94 0.37 -2.12 117.00 120.55 1fgt n LEU 546 Ca 0.00 0.27 0.08 0.00 -1.11 0.00 0.00 56.01 55.25 1fgt n LEU 546 Cb 0.00 -0.87 0.20 0.00 0.53 0.00 0.00 43.42 43.28 1fgt n LEU 546 CO 0.00 0.60 0.65 2.30 -1.11 0.00 0.00 177.39 179.84 1fgt n ILE 547 N -4.09 1.84 -1.87 1.96 -5.35 0.16 -1.53 119.36 110.47 1fgt n ILE 547 Ca -0.49 -1.67 -0.30 0.00 -0.27 0.00 0.00 62.75 60.02 1fgt n ILE 547 Cb 0.88 -0.03 0.07 0.00 -1.74 0.00 0.00 39.64 38.82 1fgt n ILE 547 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1fgt s ASN 548 N -1.80 5.02 0.10 7.28 4.22 -1.25 -4.92 114.94 123.59 1fgt s ASN 548 Ca 0.33 1.00 -0.31 0.00 -2.14 0.00 0.00 52.86 51.74 1fgt s ASN 548 Cb 0.26 -1.67 -0.09 0.00 1.28 0.00 0.00 41.25 41.02 1fgt s ASN 548 CO 0.09 -1.60 1.76 0.00 -2.04 0.00 0.00 177.10 175.31 1fgt s ALA 549 N -3.44 3.72 -0.97 3.54 0.00 -0.11 -0.75 121.76 123.75 1fgt s ALA 549 Ca 0.60 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1fgt s ALA 549 Cb -0.11 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.27 1fgt s ALA 549 CO 0.51 -1.19 0.00 -1.71 0.00 0.00 0.00 175.76 173.37 1fgt n ASN 550 N 5.74 -4.32 -2.26 0.00 5.15 -1.26 -4.93 115.26 113.38 1fgt n ASN 550 Ca 0.17 0.23 -0.03 0.00 -0.60 0.00 0.00 54.58 54.35 1fgt n ASN 550 Cb 0.39 -2.62 0.02 0.00 -0.53 0.00 0.00 39.78 37.04 1fgt n ASN 550 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1fgt n GLY 551 N -1.57 -1.43 0.07 8.20 0.00 0.07 -4.74 105.19 105.79 1fgt n GLY 551 Ca -0.09 -1.63 -0.11 0.00 0.00 0.00 0.00 46.02 44.19 1fgt n GLY 551 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1fgt h ILE 552 N -1.18 0.91 -0.27 -0.61 1.08 -1.42 -1.90 117.51 114.11 1fgt h ILE 552 Ca -0.04 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.41 1fgt h ILE 552 Cb 0.11 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 34.76 1fgt h ILE 552 CO 0.03 0.00 0.09 0.40 -0.69 0.00 0.00 178.15 177.97 1fgt h ILE 553 N -0.03 1.20 -0.16 -0.67 1.08 -1.56 -1.73 117.51 115.64 1fgt h ILE 553 Ca 0.03 -0.62 -0.02 0.00 -0.39 0.00 0.00 64.86 63.86 1fgt h ILE 553 Cb 0.07 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 34.91 1fgt h ILE 553 CO -0.07 0.21 0.01 -0.33 -0.69 0.00 0.00 178.15 177.28 1fgt h GLU 554 N 0.28 0.22 -0.01 2.37 5.08 -1.74 0.10 114.58 120.88 1fgt h GLU 554 Ca 0.09 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1fgt h GLU 554 Cb 0.24 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1fgt h GLU 554 CO -0.00 0.24 -0.26 0.25 -1.00 0.00 0.00 179.01 178.24 1fgt n THR 555 N -4.41 0.00 0.00 1.13 -2.24 -0.72 -4.08 114.28 103.95 1fgt n THR 555 Ca -0.01 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1fgt n THR 555 Cb 0.16 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 1fgt n THR 555 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1fgt n THR 556 N -0.46 0.00 -4.15 4.28 -2.24 -0.67 -4.85 114.28 106.19 1fgt n THR 556 Ca 0.12 -0.19 -0.29 0.00 -2.27 0.00 0.00 64.05 61.43 1fgt n THR 556 Cb 0.37 0.68 -0.08 0.00 -2.10 0.00 0.00 70.33 69.20 1fgt n THR 556 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1fgt s PHE 557 N -1.50 2.94 0.21 4.78 0.40 -0.03 -4.49 117.98 120.29 1fgt s PHE 557 Ca 0.00 -0.06 -0.14 0.00 -0.60 0.00 0.00 56.93 56.12 1fgt s PHE 557 Cb 0.00 -1.49 0.23 0.00 0.51 0.00 0.00 43.02 42.27 1fgt s PHE 557 CO 0.00 0.48 1.36 -0.11 0.70 0.00 0.00 175.22 177.65 1fgt n LEU 558 N 0.41 -0.54 0.04 -0.37 7.94 -0.50 -2.15 117.00 121.83 1fgt n LEU 558 Ca -0.11 1.52 0.07 0.00 -1.11 0.00 0.00 56.01 56.39 1fgt n LEU 558 Cb 0.53 -0.36 0.32 0.00 0.53 0.00 0.00 43.42 44.43 1fgt n LEU 558 CO 0.39 -1.38 0.73 -2.65 -1.11 0.00 0.00 177.39 173.37 1fgt n PRO 559 N -5.30 0.05 0.00 1.96 -0.02 -1.26 -4.93 135.00 125.50 1fgt n PRO 559 Ca 0.09 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1fgt n PRO 559 Cb 0.36 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 1fgt n PRO 559 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1fgt n SER 560 N -1.71 0.00 0.00 2.55 2.88 -0.91 -0.94 113.62 115.50 1fgt n SER 560 Ca 0.02 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.58 1fgt n SER 560 Cb 0.15 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 63.69 1fgt n SER 560 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1fgt n LYS 561 N 14.00 0.04 0.00 -1.46 2.85 -1.26 -1.36 118.16 130.97 1fgt n LYS 561 Ca 0.00 0.30 0.12 0.00 -1.05 0.00 0.00 58.31 57.68 1fgt n LYS 561 Cb 0.00 -1.50 0.12 0.00 -0.65 0.00 0.00 35.03 33.00 1fgt n LYS 561 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1fgt n TYR 562 N -1.34 0.00 0.18 5.58 4.01 -0.11 -4.67 117.16 120.81 1fgt n TYR 562 Ca 0.01 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.59 1fgt n TYR 562 Cb 0.03 -0.01 -0.09 0.00 -0.31 0.00 0.00 39.34 38.96 1fgt n TYR 562 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1fgt h SER 563 N 3.01 -1.39 -0.47 7.72 0.02 -1.29 -1.70 113.55 119.45 1fgt h SER 563 Ca 0.00 0.14 -0.11 0.00 -0.84 0.00 0.00 61.79 60.97 1fgt h SER 563 Cb 0.78 0.49 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 1fgt h SER 563 CO 0.00 -0.57 -0.15 0.58 -1.14 0.00 0.00 176.83 175.55 1fgt h VAL 564 N -0.81 1.27 0.00 2.27 2.07 -1.83 -2.74 116.25 116.48 1fgt h VAL 564 Ca -0.02 -1.29 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 1fgt h VAL 564 Cb 0.77 1.12 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1fgt h VAL 564 CO -0.19 0.45 -0.12 1.05 0.02 0.00 0.00 177.57 178.78 1fgt h GLU 565 N 0.78 0.00 -0.82 1.57 4.11 -1.83 -0.77 114.58 117.62 1fgt h GLU 565 Ca 0.11 0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.58 1fgt h GLU 565 Cb 0.71 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.91 1fgt h GLU 565 CO 0.05 0.12 0.54 0.52 0.07 0.00 0.00 179.01 180.31 1fgt h MET 566 N 0.00 0.98 0.00 1.06 2.86 -0.99 -0.43 114.93 118.40 1fgt h MET 566 Ca -0.00 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1fgt h MET 566 Cb 0.21 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1fgt h MET 566 CO 0.02 0.65 -0.20 0.66 1.06 0.00 0.00 176.91 179.09 1fgt h SER 567 N 1.01 0.00 -0.28 1.22 4.64 -1.08 -1.89 113.55 117.16 1fgt h SER 567 Ca 0.33 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.49 1fgt h SER 567 Cb 0.05 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1fgt h SER 567 CO -0.10 0.20 -0.43 -1.28 -0.87 0.00 0.00 176.83 174.35 1fgt h SER 568 N 0.00 0.87 -0.85 4.97 0.87 -0.92 -1.22 113.55 117.27 1fgt h SER 568 Ca -0.00 -0.51 -0.02 0.00 -1.23 0.00 0.00 61.79 60.02 1fgt h SER 568 Cb 0.48 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 62.15 1fgt h SER 568 CO 0.03 1.21 0.45 0.00 -0.53 0.00 0.00 176.83 177.99 1fgt h ALA 569 N 0.68 1.09 -0.32 6.23 0.00 -0.74 -2.08 119.26 124.11 1fgt h ALA 569 Ca 0.03 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 1fgt h ALA 569 Cb 1.03 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1fgt h ALA 569 CO 0.10 0.62 -0.24 0.28 0.00 0.00 0.00 179.25 180.01 1fgt h VAL 570 N 1.19 1.27 0.00 0.00 2.07 -1.26 -2.78 116.25 116.75 1fgt h VAL 570 Ca 0.30 -1.31 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 1fgt h VAL 570 Cb 0.05 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1fgt h VAL 570 CO -0.04 0.43 -0.01 0.22 0.02 0.00 0.00 177.57 178.18 1fgt h TYR 571 N 0.55 0.00 -0.52 1.57 3.20 -0.52 -0.41 116.97 120.85 1fgt h TYR 571 Ca 0.08 0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.10 1fgt h TYR 571 Cb 0.70 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.95 1fgt h TYR 571 CO 0.03 0.01 0.44 0.87 -1.64 0.00 0.00 178.16 177.87 1fgt h LYS 572 N 0.00 0.00 -0.46 1.82 1.57 -1.21 -0.17 116.57 118.12 1fgt h LYS 572 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fgt h LYS 572 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1fgt h LYS 572 CO 0.00 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.97 1fgt n ASN 573 N -4.03 3.29 -4.72 0.86 5.03 -0.17 -4.99 115.26 110.53 1fgt n ASN 573 Ca 0.10 -1.95 -0.42 0.00 0.87 0.00 0.00 54.58 53.17 1fgt n ASN 573 Cb 0.66 -0.30 -0.03 0.00 -1.02 0.00 0.00 39.78 39.08 1fgt n ASN 573 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1fgt s TRP 574 N -1.08 3.37 -0.16 3.10 -0.00 -0.08 -5.02 118.94 119.08 1fgt s TRP 574 Ca 0.34 1.22 -0.00 0.00 -0.00 0.00 0.00 56.10 57.65 1fgt s TRP 574 Cb 0.18 -3.51 0.04 0.00 -0.00 0.00 0.00 33.47 30.18 1fgt s TRP 574 CO 0.24 -1.63 -0.06 0.08 -0.00 0.00 0.00 176.95 175.58 1fgt s VAL 575 N 0.79 1.13 0.18 5.86 1.01 -1.26 -5.04 120.40 123.07 1fgt s VAL 575 Ca 0.59 -0.59 -0.16 0.00 0.00 0.00 0.00 61.98 61.83 1fgt s VAL 575 Cb -0.33 -1.27 0.13 0.00 0.00 0.00 0.00 36.38 34.92 1fgt s VAL 575 CO 0.32 0.18 1.66 0.15 0.00 0.00 0.00 175.10 177.40 1fgt h PHE 576 N 8.12 -0.23 0.00 5.22 3.57 -1.95 -0.84 116.94 130.83 1fgt h PHE 576 Ca -0.26 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.28 1fgt h PHE 576 Cb 1.11 0.18 0.00 0.00 2.79 0.00 0.00 35.95 40.03 1fgt h PHE 576 CO 0.46 -0.20 0.00 1.79 -2.23 0.00 0.00 178.31 178.13 1fgt h THR 577 N 0.01 0.00 -0.01 4.41 1.35 -1.96 -1.60 112.91 115.10 1fgt h THR 577 Ca 0.22 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1fgt h THR 577 Cb 0.34 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1fgt h THR 577 CO -0.47 0.00 -0.04 0.47 -0.25 0.00 0.00 175.52 175.23 1fgt n ASP 578 N -2.37 0.77 0.09 5.36 8.00 -0.33 -3.14 116.55 124.93 1fgt n ASP 578 Ca 0.02 -1.10 0.13 0.00 0.71 0.00 0.00 54.79 54.55 1fgt n ASP 578 Cb 0.26 -0.01 0.36 0.00 -0.02 0.00 0.00 41.12 41.71 1fgt n ASP 578 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fgt n GLN 579 N -0.49 0.25 -1.93 -1.24 1.13 -0.60 -3.59 117.38 110.90 1fgt n GLN 579 Ca 0.19 0.17 -0.41 0.00 -1.94 0.00 0.00 57.00 55.01 1fgt n GLN 579 Cb 0.26 -1.76 -0.02 0.00 0.11 0.00 0.00 30.24 28.83 1fgt n GLN 579 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1fgt s ALA 580 N -3.11 3.66 0.16 -1.58 0.00 -1.19 -4.87 121.76 114.83 1fgt s ALA 580 Ca 0.10 1.41 -0.16 0.00 0.00 0.00 0.00 51.96 53.31 1fgt s ALA 580 Cb 0.13 -3.58 0.08 0.00 0.00 0.00 0.00 23.12 19.74 1fgt s ALA 580 CO 0.63 -0.83 1.75 1.25 0.00 0.00 0.00 175.76 178.56 1fgt h LEU 581 N 4.82 0.16 -0.46 0.00 5.85 -1.92 -0.86 115.31 122.90 1fgt h LEU 581 Ca -0.47 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.30 1fgt h LEU 581 Cb 1.22 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 1fgt h LEU 581 CO 0.77 0.13 0.30 -0.65 -0.34 0.00 0.00 178.44 178.65 1fgt h PRO 582 N 0.30 0.59 -0.91 5.25 0.11 -1.95 -1.37 132.00 134.02 1fgt h PRO 582 Ca 0.18 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.26 1fgt h PRO 582 Cb 0.15 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 31.08 1fgt h PRO 582 CO -0.17 0.39 0.60 0.00 -0.21 0.00 0.00 178.00 178.61 1fgt h ALA 583 N 1.18 1.15 -0.32 -0.75 0.00 -1.79 -1.50 119.26 117.23 1fgt h ALA 583 Ca 0.17 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1fgt h ALA 583 Cb -0.06 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 1fgt h ALA 583 CO -0.05 0.54 0.16 0.22 0.00 0.00 0.00 179.25 180.12 1fgt h ASP 584 N 1.22 0.42 -0.71 0.00 3.58 -0.70 0.11 116.42 120.34 1fgt h ASP 584 Ca 0.33 -0.12 -0.02 0.00 0.42 0.00 0.00 57.03 57.65 1fgt h ASP 584 Cb -0.13 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 40.78 1fgt h ASP 584 CO -0.08 0.42 0.38 -0.07 -2.88 0.00 0.00 179.24 177.01 1fgt h LEU 585 N 0.39 0.90 -0.29 2.28 3.38 -0.94 -1.03 115.31 119.99 1fgt h LEU 585 Ca 0.11 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1fgt h LEU 585 Cb 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1fgt h LEU 585 CO -0.01 0.75 -0.14 0.40 0.09 0.00 0.00 178.44 179.52 1fgt h ILE 586 N 0.98 1.29 -1.01 1.22 2.04 -1.11 -1.89 117.51 119.04 1fgt h ILE 586 Ca 0.25 -1.23 0.02 0.00 1.00 0.00 0.00 64.86 64.90 1fgt h ILE 586 Cb 0.06 1.48 -0.05 0.00 -0.74 0.00 0.00 36.82 37.57 1fgt h ILE 586 CO -0.04 0.39 0.66 0.50 0.00 0.00 0.00 178.15 179.67 1fgt h LYS 587 N 0.35 1.28 -0.00 2.37 3.64 -0.55 -1.45 116.57 122.21 1fgt h LYS 587 Ca 0.06 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1fgt h LYS 587 Cb 0.66 -0.29 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1fgt h LYS 587 CO 0.04 0.85 0.00 0.54 -2.27 0.00 0.00 179.45 178.61 1fgt n ARG 588 N -4.41 1.04 -1.91 1.90 1.74 -0.41 -4.91 116.66 109.71 1fgt n ARG 588 Ca 0.13 -0.06 -0.12 0.00 -0.77 0.00 0.00 57.85 57.02 1fgt n ARG 588 Cb 0.05 -1.46 -0.02 0.00 -1.02 0.00 0.00 32.46 30.01 1fgt n ARG 588 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fgt n GLY 589 N 0.98 0.39 0.63 -0.13 0.00 -0.55 -0.58 105.19 105.92 1fgt n GLY 589 Ca 0.22 -0.41 0.07 0.00 0.00 0.00 0.00 46.02 45.90 1fgt n GLY 589 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1fgt n VAL 590 N -3.52 0.29 -3.43 1.61 0.24 -0.74 -3.31 118.33 109.46 1fgt n VAL 590 Ca -0.14 -0.64 -0.12 0.00 -2.04 0.00 0.00 64.34 61.40 1fgt n VAL 590 Cb 0.53 1.06 -0.02 0.00 -1.47 0.00 0.00 33.84 33.94 1fgt n VAL 590 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fgt s ALA 591 N -1.11 -1.58 0.13 2.33 0.00 -1.13 -0.48 121.76 119.92 1fgt s ALA 591 Ca 0.20 0.50 0.07 0.00 0.00 0.00 0.00 51.96 52.73 1fgt s ALA 591 Cb 0.13 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1fgt s ALA 591 CO 0.18 -0.75 -0.16 0.96 0.00 0.00 0.00 175.76 176.00 1fgt s ILE 592 N -3.64 1.49 0.29 0.00 -4.36 -0.26 -4.21 121.20 110.52 1fgt s ILE 592 Ca 0.01 -1.77 -0.29 0.00 -0.26 0.00 0.00 60.65 58.33 1fgt s ILE 592 Cb -0.01 -1.63 -0.10 0.00 1.25 0.00 0.00 42.46 41.98 1fgt s ILE 592 CO -0.12 -0.37 1.28 -0.75 0.24 0.00 0.00 174.94 175.21 1fgt s LYS 593 N -2.68 4.41 -0.34 0.37 2.20 -1.26 -0.61 119.74 121.84 1fgt s LYS 593 Ca 0.11 2.12 0.07 0.00 -0.36 0.00 0.00 55.97 57.90 1fgt s LYS 593 Cb -0.05 -3.12 0.19 0.00 -1.51 0.00 0.00 37.83 33.34 1fgt s LYS 593 CO 0.04 -0.14 0.60 0.34 -0.36 0.00 0.00 175.35 175.83 1fgt s ASP 594 N -0.37 -1.50 0.61 1.43 2.15 0.05 -4.76 116.67 114.28 1fgt s ASP 594 Ca 0.50 -0.22 0.31 0.00 0.43 0.00 0.00 52.55 53.56 1fgt s ASP 594 Cb -0.38 1.96 1.69 0.00 -0.30 0.00 0.00 42.92 45.90 1fgt s ASP 594 CO 0.48 -0.25 2.05 -0.65 -0.17 0.00 0.00 175.17 176.62 1fgt h PRO 595 N 7.61 0.00 0.00 4.34 0.11 -1.95 -1.80 132.00 140.31 1fgt h PRO 595 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1fgt h PRO 595 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1fgt h PRO 595 CO 0.14 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.80 1fgt n SER 596 N -3.52 0.00 -4.90 -2.05 3.41 -1.26 -4.74 113.62 100.56 1fgt n SER 596 Ca 0.02 -0.61 -0.26 0.00 -0.26 0.00 0.00 58.87 57.76 1fgt n SER 596 Cb 0.38 -0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.23 1fgt n SER 596 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1fgt s THR 597 N -2.12 5.03 0.25 6.66 -4.23 -0.68 -5.02 115.64 115.53 1fgt s THR 597 Ca 0.33 -0.84 -0.03 0.00 -1.18 0.00 0.00 61.69 59.97 1fgt s THR 597 Cb 0.17 -3.60 0.22 0.00 1.34 0.00 0.00 72.50 70.63 1fgt s THR 597 CO 0.30 -0.11 1.73 -0.65 -0.54 0.00 0.00 174.62 175.34 1fgt h PRO 598 N 2.16 0.44 -0.37 3.99 0.11 -1.87 -2.37 132.00 134.09 1fgt h PRO 598 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1fgt h PRO 598 Cb 1.20 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1fgt h PRO 598 CO 0.66 0.29 0.00 0.72 -0.21 0.00 0.00 178.00 179.46 1fgt n HIS 599 N -5.00 0.47 -0.97 0.65 8.25 -1.26 -4.95 115.22 112.42 1fgt n HIS 599 Ca 0.15 -0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 1fgt n HIS 599 Cb 0.43 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.54 1fgt n HIS 599 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fgt n GLY 600 N 1.47 0.94 2.94 -1.41 0.00 -0.89 -5.00 105.19 103.24 1fgt n GLY 600 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 1fgt n GLY 600 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fgt s VAL 601 N -3.74 0.10 -0.21 1.61 -7.23 -1.24 -0.77 120.40 108.92 1fgt s VAL 601 Ca 0.00 -0.56 -0.04 0.00 -1.81 0.00 0.00 61.98 59.57 1fgt s VAL 601 Cb 0.00 -0.18 -0.01 0.00 0.56 0.00 0.00 36.38 36.74 1fgt s VAL 601 CO 0.00 -0.29 -0.04 -0.60 -0.31 0.00 0.00 175.10 173.86 1fgt s ARG 602 N -0.88 3.45 0.23 4.82 3.52 0.23 -4.81 118.95 125.50 1fgt s ARG 602 Ca -0.09 -0.60 -0.30 0.00 -0.13 0.00 0.00 55.73 54.61 1fgt s ARG 602 Cb -0.06 -3.00 -0.09 0.00 -1.56 0.00 0.00 34.95 30.24 1fgt s ARG 602 CO -0.01 -0.10 1.12 -0.51 -0.81 0.00 0.00 175.30 174.99 1fgt s LEU 603 N 1.25 4.51 0.18 -0.88 1.43 -1.26 -1.10 118.68 122.81 1fgt s LEU 603 Ca 0.03 2.21 0.25 0.00 -1.03 0.00 0.00 54.13 55.59 1fgt s LEU 603 Cb -0.14 -3.62 0.53 0.00 0.03 0.00 0.00 46.19 42.99 1fgt s LEU 603 CO -0.01 -0.21 1.52 -0.07 0.23 0.00 0.00 176.35 177.82 1fgt h LEU 604 N 4.47 0.00 -7.77 1.79 3.38 -1.13 -3.36 115.31 112.68 1fgt h LEU 604 Ca -0.46 -0.10 -0.67 0.00 0.09 0.00 0.00 57.88 56.74 1fgt h LEU 604 Cb 1.21 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 41.58 1fgt h LEU 604 CO 0.70 0.05 -0.69 -0.63 0.09 0.00 0.00 178.44 177.95 1fgt s ILE 605 N -3.15 2.52 0.27 1.22 1.01 -1.26 -4.98 121.20 116.84 1fgt s ILE 605 Ca 0.08 -2.12 -0.03 0.00 0.00 0.00 0.00 60.65 58.59 1fgt s ILE 605 Cb 0.12 -2.75 0.17 0.00 0.01 0.00 0.00 42.46 40.01 1fgt s ILE 605 CO 0.67 -0.50 1.84 1.05 0.00 0.00 0.00 174.94 178.00 1fgt h GLU 606 N 7.75 0.94 -2.76 2.79 4.11 -1.91 -3.15 114.58 122.35 1fgt h GLU 606 Ca -0.09 -0.16 -0.80 0.00 0.07 0.00 0.00 59.36 58.38 1fgt h GLU 606 Cb 1.03 -0.16 -0.29 0.00 0.50 0.00 0.00 28.75 29.84 1fgt h GLU 606 CO 0.55 0.78 0.73 -3.47 0.07 0.00 0.00 179.01 177.67 1fgt n ASP 607 N -4.30 6.41 -4.21 3.06 2.03 -1.26 -4.89 116.55 113.39 1fgt n ASP 607 Ca 0.05 -3.47 -0.41 0.00 0.52 0.00 0.00 54.79 51.49 1fgt n ASP 607 Cb 0.19 -1.21 -0.07 0.00 -0.72 0.00 0.00 41.12 39.30 1fgt n ASP 607 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1fgt s TYR 608 N -3.04 3.50 0.18 -0.67 6.14 -1.19 -4.82 117.35 117.43 1fgt s TYR 608 Ca 0.33 -2.12 -0.18 0.00 0.64 0.00 0.00 57.07 55.74 1fgt s TYR 608 Cb 0.08 -3.50 0.12 0.00 0.42 0.00 0.00 41.96 39.08 1fgt s TYR 608 CO 0.06 -0.95 1.64 -1.35 0.64 0.00 0.00 175.55 175.59 1fgt h PRO 609 N 7.92 -0.08 -0.18 4.97 0.11 -1.88 0.96 132.00 143.82 1fgt h PRO 609 Ca -0.09 0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.04 1fgt h PRO 609 Cb 1.03 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1fgt h PRO 609 CO 0.80 -0.06 0.07 -0.92 -0.21 0.00 0.00 178.00 177.68 1fgt h TYR 610 N -0.09 0.13 -0.40 0.65 3.20 -1.85 -1.19 116.97 117.43 1fgt h TYR 610 Ca 0.21 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.01 1fgt h TYR 610 Cb 0.41 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 1fgt h TYR 610 CO -0.44 0.07 -0.08 0.00 -1.64 0.00 0.00 178.16 176.08 1fgt h ALA 611 N 1.11 0.55 -0.36 1.82 0.00 -1.68 0.19 119.26 120.89 1fgt h ALA 611 Ca 0.08 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1fgt h ALA 611 Cb 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1fgt h ALA 611 CO -0.07 0.40 -0.01 0.00 0.00 0.00 0.00 179.25 179.58 1fgt h ALA 612 N 0.85 0.49 -0.24 0.00 0.00 -0.73 0.14 119.26 119.76 1fgt h ALA 612 Ca 0.10 -0.25 -0.18 0.00 0.00 0.00 0.00 54.91 54.58 1fgt h ALA 612 Cb 0.59 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1fgt h ALA 612 CO 0.04 0.26 -0.57 -0.44 0.00 0.00 0.00 179.25 178.53 1fgt h ASP 613 N 0.45 0.85 -0.94 0.00 5.19 -1.23 -3.16 116.42 117.59 1fgt h ASP 613 Ca 0.10 -0.47 0.01 0.00 -0.62 0.00 0.00 57.03 56.06 1fgt h ASP 613 Cb 0.47 -0.25 -0.05 0.00 0.18 0.00 0.00 39.33 39.69 1fgt h ASP 613 CO 0.02 1.24 0.62 1.23 -3.12 0.00 0.00 179.24 179.23 1fgt h GLY 614 N 0.81 1.33 1.58 2.75 0.00 -0.40 -1.88 103.07 107.26 1fgt h GLY 614 Ca 0.01 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.83 1fgt h GLY 614 CO 0.12 0.47 0.14 1.41 0.00 0.00 0.00 176.54 178.67 1fgt h LEU 615 N 1.25 0.50 -0.11 3.11 3.38 -0.93 0.23 115.31 122.74 1fgt h LEU 615 Ca 0.35 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 1fgt h LEU 615 Cb -0.12 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 1fgt h LEU 615 CO -0.08 0.47 0.02 -0.33 0.09 0.00 0.00 178.44 178.60 1fgt h GLU 616 N 0.55 0.18 -0.37 1.13 4.39 -1.34 -0.84 114.58 118.27 1fgt h GLU 616 Ca 0.13 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.75 1fgt h GLU 616 Cb 0.14 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 1fgt h GLU 616 CO -0.01 0.38 0.10 0.82 -1.16 0.00 0.00 179.01 179.13 1fgt h ILE 617 N -0.05 1.22 -0.56 3.13 1.08 -0.93 -2.10 117.51 119.30 1fgt h ILE 617 Ca 0.03 -0.74 0.10 0.00 -0.39 0.00 0.00 64.86 63.86 1fgt h ILE 617 Cb 0.28 1.00 -0.07 0.00 -3.07 0.00 0.00 36.82 34.96 1fgt h ILE 617 CO 0.00 0.25 0.14 -0.25 -0.69 0.00 0.00 178.15 177.61 1fgt h TRP 618 N 0.45 0.24 -0.81 1.37 2.91 -0.51 -1.10 115.95 118.50 1fgt h TRP 618 Ca 0.12 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.15 1fgt h TRP 618 Cb 0.29 -0.02 -0.04 0.00 -0.51 0.00 0.00 29.16 28.88 1fgt h TRP 618 CO 0.01 0.02 0.41 0.00 -1.03 0.00 0.00 178.44 177.85 1fgt h ALA 619 N 1.42 1.04 -0.45 2.65 0.00 -0.90 -0.76 119.26 122.26 1fgt h ALA 619 Ca 0.28 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1fgt h ALA 619 Cb 0.39 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1fgt h ALA 619 CO -0.34 0.57 0.15 0.00 0.00 0.00 0.00 179.25 179.63 1fgt h ALA 620 N 1.22 0.59 -0.61 0.00 0.00 -0.66 -0.66 119.26 119.13 1fgt h ALA 620 Ca 0.28 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1fgt h ALA 620 Cb 0.08 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1fgt h ALA 620 CO -0.04 0.24 0.21 0.82 0.00 0.00 0.00 179.25 180.48 1fgt h ILE 621 N 0.60 1.24 -0.16 0.00 2.04 -1.00 -2.31 117.51 117.91 1fgt h ILE 621 Ca 0.15 -0.80 0.02 0.00 1.00 0.00 0.00 64.86 65.23 1fgt h ILE 621 Cb 0.26 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1fgt h ILE 621 CO -0.01 0.31 0.02 0.50 0.00 0.00 0.00 178.15 178.97 1fgt h LYS 622 N 0.86 0.09 -0.84 2.37 3.64 -0.82 -0.17 116.57 121.70 1fgt h LYS 622 Ca 0.20 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.66 1fgt h LYS 622 Cb 0.26 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 31.99 1fgt h LYS 622 CO -0.01 0.06 0.50 1.15 -2.27 0.00 0.00 179.45 178.88 1fgt h THR 623 N 0.09 0.96 -0.13 1.00 2.02 -0.96 0.29 112.91 116.18 1fgt h THR 623 Ca 0.07 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 1fgt h THR 623 Cb 0.07 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.50 1fgt h THR 623 CO -0.11 0.16 0.03 -0.25 0.37 0.00 0.00 175.52 175.72 1fgt h TRP 624 N 0.86 0.21 -0.53 3.16 -0.00 -0.84 -0.79 115.95 118.03 1fgt h TRP 624 Ca 0.39 -0.03 -0.04 0.00 -0.00 0.00 0.00 58.89 59.21 1fgt h TRP 624 Cb 0.30 -0.06 -0.02 0.00 -0.00 0.00 0.00 29.16 29.38 1fgt h TRP 624 CO -0.05 0.36 0.16 0.28 -0.00 0.00 0.00 178.44 179.20 1fgt h VAL 625 N 0.00 1.23 0.00 2.65 2.07 -0.64 -0.73 116.25 120.83 1fgt h VAL 625 Ca 0.04 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.75 1fgt h VAL 625 Cb 0.25 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1fgt h VAL 625 CO 0.00 0.29 -0.11 1.56 0.02 0.00 0.00 177.57 179.33 1fgt h GLN 626 N 0.73 0.00 0.03 1.57 4.20 -0.84 -1.19 115.11 119.61 1fgt h GLN 626 Ca 0.17 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.60 1fgt h GLN 626 Cb 0.28 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.02 1fgt h GLN 626 CO -0.01 0.11 -1.54 1.49 -0.67 0.00 0.00 178.83 178.21 1fgt h GLU 627 N 0.00 0.07 0.11 1.46 4.81 -0.70 -3.38 114.58 116.95 1fgt h GLU 627 Ca -0.00 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1fgt h GLU 627 Cb 0.23 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1fgt h GLU 627 CO 0.01 0.79 -0.05 -0.92 -0.73 0.00 0.00 179.01 178.10 1fgt h TYR 628 N 0.02 -0.14 -0.61 0.92 3.20 -0.71 -3.36 116.97 116.28 1fgt h TYR 628 Ca -0.23 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 61.77 1fgt h TYR 628 Cb 1.96 0.05 -0.11 0.00 1.54 0.00 0.00 36.73 40.17 1fgt h TYR 628 CO 0.02 0.35 -0.05 0.28 -1.64 0.00 0.00 178.16 177.13 1fgt h VAL 629 N -0.78 0.46 -0.01 1.81 2.07 -1.44 -0.99 116.25 117.37 1fgt h VAL 629 Ca -0.02 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1fgt h VAL 629 Cb 0.56 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1fgt h VAL 629 CO 0.03 0.01 0.04 -0.65 0.02 0.00 0.00 177.57 177.02 1fgt h PRO 630 N 0.08 0.00 0.00 1.57 0.11 -1.72 -0.11 132.00 131.93 1fgt h PRO 630 Ca 0.32 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.41 1fgt h PRO 630 Cb 0.51 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 1fgt h PRO 630 CO -0.56 0.00 -0.08 -0.07 -0.21 0.00 0.00 178.00 177.08 1fgt h LEU 631 N 0.00 0.00 0.00 2.35 3.38 -1.32 -3.30 115.31 116.42 1fgt h LEU 631 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1fgt h LEU 631 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1fgt h LEU 631 CO -0.00 0.08 -0.63 -1.22 0.09 0.00 0.00 178.44 176.76 1fgt n TYR 632 N -3.23 0.00 -3.81 1.13 4.01 -0.27 -4.97 117.16 110.02 1fgt n TYR 632 Ca 0.00 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.48 1fgt n TYR 632 Cb 0.32 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.18 1fgt n TYR 632 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1fgt s TYR 633 N -1.62 1.17 0.02 -0.72 1.51 -0.21 -4.94 117.35 112.55 1fgt s TYR 633 Ca 0.00 -0.71 -0.09 0.00 -1.01 0.00 0.00 57.07 55.26 1fgt s TYR 633 Cb 0.00 -1.07 -0.31 0.00 -0.11 0.00 0.00 41.96 40.47 1fgt s TYR 633 CO 0.00 -0.52 0.95 0.00 -1.11 0.00 0.00 175.55 174.87 1fgt h ALA 634 N 8.22 0.05 -2.50 3.71 0.00 -1.86 -3.36 119.26 123.52 1fgt h ALA 634 Ca -0.21 -0.97 -0.22 0.00 0.00 0.00 0.00 54.91 53.51 1fgt h ALA 634 Cb 1.12 0.21 -0.15 0.00 0.00 0.00 0.00 17.79 18.97 1fgt h ALA 634 CO 0.34 0.92 -0.63 1.03 0.00 0.00 0.00 179.25 180.90 1fgt s ARG 635 N -2.61 1.09 0.42 0.00 0.52 -1.26 -5.04 118.95 112.07 1fgt s ARG 635 Ca -0.09 -1.55 0.14 0.00 -0.52 0.00 0.00 55.73 53.71 1fgt s ARG 635 Cb 0.06 0.22 1.01 0.00 0.52 0.00 0.00 34.95 36.75 1fgt s ARG 635 CO 0.90 -0.32 1.94 -0.44 0.02 0.00 0.00 175.30 177.39 1fgt h ASP 636 N 2.71 0.42 -0.16 0.23 3.32 -1.93 -0.93 116.42 120.08 1fgt h ASP 636 Ca -0.36 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.68 1fgt h ASP 636 Cb 1.23 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 1fgt h ASP 636 CO 0.56 0.23 0.01 0.44 -1.72 0.00 0.00 179.24 178.77 1fgt h ASP 637 N 0.45 0.35 0.39 6.45 5.19 -1.97 -1.74 116.42 125.54 1fgt h ASP 637 Ca 0.34 -0.05 -0.05 0.00 -0.62 0.00 0.00 57.03 56.65 1fgt h ASP 637 Cb 0.70 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 40.11 1fgt h ASP 637 CO -0.11 0.40 -0.23 0.44 -3.12 0.00 0.00 179.24 176.62 1fgt h ASP 638 N 0.38 0.00 0.18 6.45 3.32 -1.54 -0.93 116.42 124.28 1fgt h ASP 638 Ca 0.09 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.87 1fgt h ASP 638 Cb 0.23 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.81 1fgt h ASP 638 CO 0.00 0.23 -1.17 0.58 -1.72 0.00 0.00 179.24 177.17 1fgt h VAL 639 N 0.00 1.37 -0.16 -1.35 2.07 -1.34 -3.21 116.25 113.64 1fgt h VAL 639 Ca -0.00 -2.57 -0.07 0.00 0.82 0.00 0.00 66.70 64.87 1fgt h VAL 639 Cb 0.49 3.03 -0.01 0.00 -1.52 0.00 0.00 31.29 33.27 1fgt h VAL 639 CO 0.03 0.76 -0.22 0.50 0.02 0.00 0.00 177.57 178.66 1fgt h LYS 640 N -0.02 0.27 -0.47 1.57 3.64 -1.03 -2.97 116.57 117.55 1fgt h LYS 640 Ca -0.20 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1fgt h LYS 640 Cb 1.91 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.70 1fgt h LYS 640 CO 0.22 0.49 0.00 0.09 -2.27 0.00 0.00 179.45 177.98 1fgt n ASN 641 N -4.18 2.52 -4.51 4.20 5.03 -0.38 -4.76 115.26 113.16 1fgt n ASN 641 Ca -0.01 -2.03 -0.43 0.00 0.87 0.00 0.00 54.58 52.99 1fgt n ASN 641 Cb 0.35 -0.32 -0.05 0.00 -1.02 0.00 0.00 39.78 38.74 1fgt n ASN 641 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1fgt s ASP 642 N -0.98 6.34 0.27 6.41 -1.08 -1.12 -4.90 116.67 121.61 1fgt s ASP 642 Ca 0.31 -0.37 -0.03 0.00 -0.52 0.00 0.00 52.55 51.94 1fgt s ASP 642 Cb 0.16 -2.40 0.35 0.00 -1.46 0.00 0.00 42.92 39.58 1fgt s ASP 642 CO 0.20 -1.08 1.84 -1.28 0.52 0.00 0.00 175.17 175.38 1fgt h SER 643 N 9.16 0.88 -0.15 -0.34 0.87 -1.90 -0.87 113.55 121.20 1fgt h SER 643 Ca -0.26 -0.13 -0.04 0.00 -1.23 0.00 0.00 61.79 60.13 1fgt h SER 643 Cb 1.08 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.81 1fgt h SER 643 CO 1.03 0.80 -0.06 -0.33 -0.53 0.00 0.00 176.83 177.73 1fgt h GLU 644 N 0.94 0.31 -0.72 2.24 5.08 -1.91 -1.91 114.58 118.62 1fgt h GLU 644 Ca 0.22 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1fgt h GLU 644 Cb 0.20 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 1fgt h GLU 644 CO -0.02 0.62 0.48 1.25 -1.00 0.00 0.00 179.01 180.34 1fgt h LEU 645 N -0.01 0.82 -0.67 1.33 5.85 -1.79 0.25 115.31 121.08 1fgt h LEU 645 Ca 0.03 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 1fgt h LEU 645 Cb 0.53 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1fgt h LEU 645 CO 0.02 0.59 -0.13 1.56 -0.34 0.00 0.00 178.44 180.15 1fgt h GLN 646 N 0.97 0.90 -0.25 1.25 1.08 -1.12 -1.80 115.11 116.14 1fgt h GLN 646 Ca 0.26 -0.32 -0.14 0.00 -1.45 0.00 0.00 58.65 57.00 1fgt h GLN 646 Cb -0.11 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 1fgt h GLN 646 CO -0.06 0.97 -0.44 0.45 -0.95 0.00 0.00 178.83 178.81 1fgt h HIS 647 N 0.80 0.74 0.64 2.96 3.86 -1.04 -1.71 115.15 121.41 1fgt h HIS 647 Ca 0.13 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 59.08 1fgt h HIS 647 Cb 0.66 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.97 1fgt h HIS 647 CO 0.04 0.95 -0.34 2.35 0.86 0.00 0.00 177.93 181.78 1fgt h TRP 648 N 0.50 -0.90 -0.32 2.45 7.01 -0.73 -1.61 115.95 122.35 1fgt h TRP 648 Ca 0.04 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.00 1fgt h TRP 648 Cb 0.96 0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 28.31 1fgt h TRP 648 CO 0.04 -0.54 0.12 2.35 -2.79 0.00 0.00 178.44 177.62 1fgt h TRP 649 N -0.91 0.49 -0.93 2.65 -0.00 -1.35 -0.12 115.95 115.78 1fgt h TRP 649 Ca -0.08 -0.04 0.09 0.00 -0.00 0.00 0.00 58.89 58.85 1fgt h TRP 649 Cb 0.72 -0.15 -0.07 0.00 -0.00 0.00 0.00 29.16 29.66 1fgt h TRP 649 CO -0.06 0.48 0.60 -0.22 -0.00 0.00 0.00 178.44 179.24 1fgt h LYS 650 N 0.36 0.93 0.06 2.65 3.64 -1.29 -1.76 116.57 121.16 1fgt h LYS 650 Ca 0.10 -0.06 -0.27 0.00 -1.27 0.00 0.00 60.65 59.16 1fgt h LYS 650 Cb 0.21 -0.21 0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1fgt h LYS 650 CO -0.01 0.62 -1.11 1.49 -2.27 0.00 0.00 179.45 178.17 1fgt h GLU 651 N 0.96 0.55 -0.78 1.90 4.81 -0.97 -0.56 114.58 120.49 1fgt h GLU 651 Ca 0.42 -0.67 0.02 0.00 -0.13 0.00 0.00 59.36 59.00 1fgt h GLU 651 Cb 0.36 0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.90 1fgt h GLU 651 CO -0.18 1.28 0.51 0.00 -0.73 0.00 0.00 179.01 179.88 1fgt h ALA 652 N 0.47 1.01 0.04 2.92 0.00 -0.56 0.16 119.26 123.30 1fgt h ALA 652 Ca -0.14 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1fgt h ALA 652 Cb 1.77 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1fgt h ALA 652 CO 0.21 0.36 -0.02 0.28 0.00 0.00 0.00 179.25 180.08 1fgt h VAL 653 N 1.02 1.10 0.00 0.00 2.07 -1.38 -0.05 116.25 119.01 1fgt h VAL 653 Ca 0.30 -1.68 -0.06 0.00 0.82 0.00 0.00 66.70 66.08 1fgt h VAL 653 Cb -0.07 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1fgt h VAL 653 CO -0.08 0.35 -0.28 -0.33 0.02 0.00 0.00 177.57 177.25 1fgt h GLU 654 N -0.95 0.00 0.00 1.57 5.08 -1.10 -2.32 114.58 116.86 1fgt h GLU 654 Ca -0.01 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1fgt h GLU 654 Cb 0.61 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1fgt h GLU 654 CO 0.01 0.28 -0.86 1.63 -1.00 0.00 0.00 179.01 179.07 1fgt n LYS 655 N -3.45 0.16 -0.07 2.33 4.76 -0.04 -4.00 118.16 117.84 1fgt n LYS 655 Ca -0.00 0.07 -0.07 0.00 -2.87 0.00 0.00 58.31 55.44 1fgt n LYS 655 Cb 0.46 -0.78 -0.01 0.00 -1.84 0.00 0.00 35.03 32.86 1fgt n LYS 655 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1fgt h GLY 656 N -0.29 0.26 -3.16 0.72 0.00 -0.82 -2.42 103.07 97.36 1fgt h GLY 656 Ca -0.10 0.04 -0.44 0.00 0.00 0.00 0.00 47.33 46.83 1fgt h GLY 656 CO -0.06 -0.06 -0.54 1.42 0.00 0.00 0.00 176.54 177.29 1fgt n HIS 657 N -5.17 2.19 -0.02 5.60 8.25 -0.08 -1.15 115.22 124.84 1fgt n HIS 657 Ca -0.00 -2.12 0.23 0.00 -0.26 0.00 0.00 57.72 55.56 1fgt n HIS 657 Cb 0.15 -0.44 0.72 0.00 1.12 0.00 0.00 29.99 31.53 1fgt n HIS 657 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1fgt h GLY 658 N 1.86 0.00 2.00 -1.41 0.00 -0.89 -0.80 103.07 103.83 1fgt h GLY 658 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1fgt h GLY 658 CO 0.68 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.44 1fgt n ASP 659 N -4.12 0.52 -0.41 0.19 8.00 -1.26 -2.02 116.55 117.45 1fgt n ASP 659 Ca 0.12 0.63 0.09 0.00 0.71 0.00 0.00 54.79 56.34 1fgt n ASP 659 Cb 0.72 -0.74 0.18 0.00 -0.02 0.00 0.00 41.12 41.26 1fgt n ASP 659 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1fgt n LEU 660 N -2.08 2.96 0.31 0.64 4.77 -0.31 -4.67 117.00 118.61 1fgt n LEU 660 Ca 0.02 -2.98 0.20 0.00 -0.03 0.00 0.00 56.01 53.22 1fgt n LEU 660 Cb 0.20 -0.45 0.94 0.00 -2.33 0.00 0.00 43.42 41.79 1fgt n LEU 660 CO 0.18 0.69 1.08 0.07 -1.33 0.00 0.00 177.39 178.08 1fgt h LYS 661 N 0.77 0.00 -0.00 3.23 2.10 -1.41 -2.38 116.57 118.88 1fgt h LYS 661 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1fgt h LYS 661 Cb 1.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 1fgt h LYS 661 CO 0.09 0.01 -0.01 -0.40 -2.00 0.00 0.00 179.45 177.14 1fgt n ASP 662 N -3.14 0.06 -4.74 7.07 5.75 -1.26 -4.88 116.55 115.41 1fgt n ASP 662 Ca -0.01 -0.29 -0.41 0.00 -0.01 0.00 0.00 54.79 54.07 1fgt n ASP 662 Cb 0.19 -0.23 -0.05 0.00 -1.03 0.00 0.00 41.12 40.00 1fgt n ASP 662 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1fgt s LYS 663 N -2.50 4.72 0.14 0.11 -0.14 -0.90 -4.97 119.74 116.21 1fgt s LYS 663 Ca 0.31 1.61 0.23 0.00 -1.36 0.00 0.00 55.97 56.75 1fgt s LYS 663 Cb 0.20 -3.28 0.90 0.00 -1.68 0.00 0.00 37.83 33.97 1fgt s LYS 663 CO 0.45 0.29 1.70 -0.35 -0.76 0.00 0.00 175.35 176.68 1fgt n PRO 664 N 1.90 0.13 0.00 -1.68 -0.04 -1.26 -3.88 135.00 130.17 1fgt n PRO 664 Ca 0.00 0.26 0.15 0.00 -0.04 0.00 0.00 63.50 63.87 1fgt n PRO 664 Cb 0.47 -1.71 0.70 0.00 -0.04 0.00 0.00 33.50 32.92 1fgt n PRO 664 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1fgt n TRP 665 N -1.95 0.00 -2.05 0.54 4.27 -1.26 -4.89 117.44 112.11 1fgt n TRP 665 Ca 0.04 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.23 1fgt n TRP 665 Cb 0.28 -0.23 -0.03 0.00 -1.36 0.00 0.00 31.31 29.97 1fgt n TRP 665 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 1fgt s TRP 666 N -2.51 3.12 0.59 -2.67 0.52 -1.25 -4.73 118.94 112.01 1fgt s TRP 666 Ca 0.29 0.86 -0.20 0.00 0.02 0.00 0.00 56.10 57.08 1fgt s TRP 666 Cb 0.20 -3.80 -0.03 0.00 -1.15 0.00 0.00 33.47 28.69 1fgt s TRP 666 CO 0.47 -2.81 1.30 -2.14 0.02 0.00 0.00 176.95 173.78 1fgt s PRO 667 N 0.68 2.94 0.25 4.98 0.02 -1.26 -4.93 135.00 137.68 1fgt s PRO 667 Ca 0.65 2.07 0.23 0.00 0.02 0.00 0.00 61.00 63.97 1fgt s PRO 667 Cb -0.41 -2.06 0.20 0.00 0.02 0.00 0.00 34.50 32.25 1fgt s PRO 667 CO 0.34 -1.30 1.28 0.87 -0.33 0.00 0.00 177.00 177.87 1fgt h LYS 668 N 1.07 0.00 -5.61 5.54 1.79 -1.95 -3.49 116.57 113.92 1fgt h LYS 668 Ca -0.51 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 57.65 1fgt h LYS 668 Cb 1.31 0.00 0.18 0.00 -1.58 0.00 0.00 32.23 32.14 1fgt h LYS 668 CO 0.56 0.00 -0.80 -0.11 -1.08 0.00 0.00 179.45 178.02 1fgt n LEU 669 N -2.66 -4.47 0.00 2.94 7.94 -1.26 -4.93 117.00 114.57 1fgt n LEU 669 Ca 0.02 -0.65 0.00 0.00 -1.11 0.00 0.00 56.01 54.27 1fgt n LEU 669 Cb 0.52 -3.14 0.00 0.00 0.53 0.00 0.00 43.42 41.33 1fgt n LEU 669 CO 0.37 0.30 0.34 0.00 -1.11 0.00 0.00 177.39 177.30 1fgt n GLN 670 N -3.88 0.70 -4.17 1.96 1.13 -1.26 -4.56 117.38 107.30 1fgt n GLN 670 Ca -0.23 -0.89 -0.10 0.00 -1.94 0.00 0.00 57.00 53.84 1fgt n GLN 670 Cb 0.66 -0.97 -0.10 0.00 0.11 0.00 0.00 30.24 29.94 1fgt n GLN 670 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1fgt s THR 671 N -0.41 0.33 0.23 5.09 -4.23 -1.26 -4.37 115.64 111.02 1fgt s THR 671 Ca 0.00 -1.92 -0.06 0.00 -1.18 0.00 0.00 61.69 58.53 1fgt s THR 671 Cb 0.00 -1.95 0.16 0.00 1.34 0.00 0.00 72.50 72.04 1fgt s THR 671 CO 0.00 -0.59 1.79 -0.07 -0.54 0.00 0.00 174.62 175.21 1fgt h LEU 672 N 2.87 1.03 -0.23 4.79 3.38 -1.86 -2.23 115.31 123.05 1fgt h LEU 672 Ca -0.35 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.47 1fgt h LEU 672 Cb 1.19 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 1fgt h LEU 672 CO 0.62 0.93 0.06 -0.08 0.09 0.00 0.00 178.44 180.06 1fgt h GLU 673 N 1.07 0.16 -0.57 1.13 4.81 -1.99 -0.83 114.58 118.36 1fgt h GLU 673 Ca 0.24 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.40 1fgt h GLU 673 Cb 0.25 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1fgt h GLU 673 CO -0.02 0.10 0.11 -0.44 -0.73 0.00 0.00 179.01 178.04 1fgt h ASP 674 N 0.16 0.85 -0.37 1.04 5.19 -1.92 0.08 116.42 121.45 1fgt h ASP 674 Ca 0.10 -0.17 -0.06 0.00 -0.62 0.00 0.00 57.03 56.28 1fgt h ASP 674 Cb 0.09 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.36 1fgt h ASP 674 CO -0.12 0.85 0.01 0.25 -3.12 0.00 0.00 179.24 177.11 1fgt h LEU 675 N 0.86 0.64 -0.27 1.55 5.85 -1.03 -0.76 115.31 122.15 1fgt h LEU 675 Ca 0.18 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1fgt h LEU 675 Cb 0.35 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1fgt h LEU 675 CO 0.00 0.78 0.15 0.58 -0.34 0.00 0.00 178.44 179.61 1fgt h VAL 676 N 0.48 1.12 0.16 1.05 2.07 -0.91 -1.49 116.25 118.73 1fgt h VAL 676 Ca 0.11 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.32 1fgt h VAL 676 Cb 0.44 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1fgt h VAL 676 CO 0.02 0.12 -0.22 -0.08 0.02 0.00 0.00 177.57 177.42 1fgt h GLU 677 N 0.32 -0.43 -0.35 1.57 4.81 -0.77 0.67 114.58 120.40 1fgt h GLU 677 Ca 0.09 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 1fgt h GLU 677 Cb 0.06 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 1fgt h GLU 677 CO -0.02 -0.29 0.16 0.28 -0.73 0.00 0.00 179.01 178.42 1fgt h VAL 678 N -0.45 0.96 -0.57 0.32 2.07 -1.03 -0.79 116.25 116.76 1fgt h VAL 678 Ca 0.02 -0.11 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1fgt h VAL 678 Cb 0.44 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1fgt h VAL 678 CO -0.10 0.06 0.13 0.00 0.02 0.00 0.00 177.57 177.68 1fgt h LEU 680 N 0.81 0.37 -0.51 0.00 5.85 -0.55 -0.68 115.31 120.60 1fgt h LEU 680 Ca 0.18 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 1fgt h LEU 680 Cb 0.36 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1fgt h LEU 680 CO 0.00 0.27 0.10 0.40 -0.34 0.00 0.00 178.44 178.87 1fgt h ILE 681 N 0.45 1.25 -0.31 4.05 2.04 -1.04 -0.42 117.51 123.53 1fgt h ILE 681 Ca 0.14 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 1fgt h ILE 681 Cb -0.02 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1fgt h ILE 681 CO -0.05 0.32 0.17 0.40 0.00 0.00 0.00 178.15 178.99 1fgt h ILE 682 N 0.71 1.13 -0.60 -0.67 2.04 -1.09 -1.41 117.51 117.62 1fgt h ILE 682 Ca 0.16 -0.32 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 1fgt h ILE 682 Cb 0.37 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1fgt h ILE 682 CO 0.01 0.13 0.13 0.40 0.00 0.00 0.00 178.15 178.82 1fgt h ILE 683 N 0.38 1.24 -0.00 -0.67 2.04 -0.99 -2.29 117.51 117.22 1fgt h ILE 683 Ca 0.11 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 65.08 1fgt h ILE 683 Cb 0.05 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1fgt h ILE 683 CO -0.02 0.33 0.00 -0.25 0.00 0.00 0.00 178.15 178.22 1fgt h TRP 684 N 0.89 0.00 -0.52 1.37 2.91 -0.77 -1.34 115.95 118.48 1fgt h TRP 684 Ca 0.19 -0.00 0.01 0.00 1.13 0.00 0.00 58.89 60.22 1fgt h TRP 684 Cb 0.34 -0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 28.96 1fgt h TRP 684 CO 0.02 0.10 0.34 0.82 -1.03 0.00 0.00 178.44 178.69 1fgt h ILE 685 N -0.10 1.11 -0.02 2.65 2.04 -1.17 -1.23 117.51 120.81 1fgt h ILE 685 Ca 0.00 -0.24 -0.13 0.00 1.00 0.00 0.00 64.86 65.50 1fgt h ILE 685 Cb 0.10 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.53 1fgt h ILE 685 CO -0.00 0.13 -0.59 0.00 0.00 0.00 0.00 178.15 177.69 1fgt h ALA 686 N 1.20 0.99 -3.00 1.87 0.00 -1.31 -2.67 119.26 116.34 1fgt h ALA 686 Ca 0.20 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1fgt h ALA 686 Cb -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1fgt h ALA 686 CO -0.06 0.73 0.00 -1.13 0.00 0.00 0.00 179.25 178.80 1fgt n SER 687 N -3.85 0.00 -0.24 0.00 3.41 -0.52 -2.66 113.62 109.77 1fgt n SER 687 Ca -0.02 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.53 1fgt n SER 687 Cb 0.59 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.59 1fgt n SER 687 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fgt h ALA 688 N -1.78 0.86 0.20 7.33 0.00 -1.72 -0.83 119.26 123.32 1fgt h ALA 688 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1fgt h ALA 688 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1fgt h ALA 688 CO 0.00 0.48 -0.09 1.25 0.00 0.00 0.00 179.25 180.88 1fgt h LEU 689 N 0.94 -0.22 -0.91 0.00 5.85 -1.38 -0.75 115.31 118.83 1fgt h LEU 689 Ca 0.22 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.83 1fgt h LEU 689 Cb 0.20 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1fgt h LEU 689 CO -0.02 0.01 0.60 -0.74 -0.34 0.00 0.00 178.44 177.94 1fgt h HIS 690 N -0.45 1.12 -0.47 1.25 2.76 -1.44 -2.15 115.15 115.76 1fgt h HIS 690 Ca -0.03 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.15 1fgt h HIS 690 Cb 0.35 -0.38 -0.02 0.00 1.55 0.00 0.00 27.41 28.91 1fgt h HIS 690 CO -0.01 0.67 0.22 0.00 -1.30 0.00 0.00 177.93 177.50 1fgt h ALA 691 N 1.36 0.61 -0.33 5.26 0.00 -0.95 -0.07 119.26 125.13 1fgt h ALA 691 Ca 0.35 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1fgt h ALA 691 Cb -0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1fgt h ALA 691 CO -0.10 0.19 0.10 0.00 0.00 0.00 0.00 179.25 179.44 1fgt h ALA 692 N 1.06 1.56 -0.01 0.00 0.00 -0.75 -1.29 119.26 119.83 1fgt h ALA 692 Ca 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1fgt h ALA 692 Cb 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1fgt h ALA 692 CO -0.02 0.34 -0.45 1.33 0.00 0.00 0.00 179.25 180.45 1fgt n VAL 693 N -4.37 0.00 -0.09 0.00 0.24 -0.84 -4.61 118.33 108.65 1fgt n VAL 693 Ca 0.02 -0.18 -0.18 0.00 -2.04 0.00 0.00 64.34 61.95 1fgt n VAL 693 Cb 0.16 0.91 -0.06 0.00 -1.47 0.00 0.00 33.84 33.38 1fgt n VAL 693 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1fgt n ASN 694 N -0.41 1.40 0.00 -1.34 5.15 -0.07 -4.73 115.26 115.26 1fgt n ASN 694 Ca 0.10 0.18 0.11 0.00 -0.60 0.00 0.00 54.58 54.37 1fgt n ASN 694 Cb 0.41 -0.49 0.66 0.00 -0.53 0.00 0.00 39.78 39.84 1fgt n ASN 694 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1fgt n PHE 695 N -3.69 0.00 0.30 1.20 3.72 -0.53 -1.70 117.46 116.76 1fgt n PHE 695 Ca -0.34 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.18 1fgt n PHE 695 Cb 0.75 0.00 0.20 0.00 -0.94 0.00 0.00 39.48 39.50 1fgt n PHE 695 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fgt n GLY 696 N 0.44 1.69 0.48 1.37 0.00 -1.26 -4.28 105.19 103.64 1fgt n GLY 696 Ca 0.17 -0.72 -0.17 0.00 0.00 0.00 0.00 46.02 45.30 1fgt n GLY 696 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1fgt h ASN 697 N 4.34 -1.46 0.25 1.61 2.35 -1.62 0.07 115.58 121.12 1fgt h ASN 697 Ca 0.00 0.14 -0.30 0.00 -0.55 0.00 0.00 56.30 55.59 1fgt h ASN 697 Cb 0.97 0.52 0.03 0.00 0.05 0.00 0.00 38.32 39.88 1fgt h ASN 697 CO 0.00 -0.60 -1.26 0.22 -1.65 0.00 0.00 177.43 174.14 1fgt h TYR 698 N -0.86 0.89 -1.00 1.19 3.20 -1.83 0.25 116.97 118.81 1fgt h TYR 698 Ca -0.03 -0.58 0.17 0.00 3.14 0.00 0.00 58.73 61.43 1fgt h TYR 698 Cb 0.80 -0.06 -0.10 0.00 1.54 0.00 0.00 36.73 38.91 1fgt h TYR 698 CO -0.36 1.43 0.62 -1.35 -1.64 0.00 0.00 178.16 176.87 1fgt h PRO 699 N 0.22 0.81 0.02 1.82 0.11 -1.78 0.33 132.00 133.53 1fgt h PRO 699 Ca -0.18 -0.05 -0.38 0.00 0.11 0.00 0.00 66.00 65.50 1fgt h PRO 699 Cb 1.94 -0.18 -0.06 0.00 0.11 0.00 0.00 31.00 32.81 1fgt h PRO 699 CO 0.23 0.54 -2.36 0.66 -0.21 0.00 0.00 178.00 176.86 1fgt n TYR 700 N -4.71 0.24 1.32 0.65 4.01 0.00 -0.94 117.16 117.73 1fgt n TYR 700 Ca 0.22 0.06 0.13 0.00 -0.16 0.00 0.00 57.90 58.15 1fgt n TYR 700 Cb 0.50 -1.03 0.41 0.00 -0.31 0.00 0.00 39.34 38.91 1fgt n TYR 700 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fgt n GLY 701 N 2.12 -0.36 0.10 2.72 0.00 0.88 -4.07 105.19 106.58 1fgt n GLY 701 Ca -0.41 -0.43 0.09 0.00 0.00 0.00 0.00 46.02 45.27 1fgt n GLY 701 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fgt n GLY 702 N 1.29 -0.95 3.28 -0.02 0.00 0.12 -3.92 105.19 104.99 1fgt n GLY 702 Ca 0.14 0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 1fgt n GLY 702 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fgt s LEU 703 N -3.97 4.61 0.53 0.99 2.96 -1.26 -4.85 118.68 117.70 1fgt s LEU 703 Ca 0.02 -1.25 0.22 0.00 -0.22 0.00 0.00 54.13 52.89 1fgt s LEU 703 Cb 0.07 -1.91 1.37 0.00 0.50 0.00 0.00 46.19 46.22 1fgt s LEU 703 CO 0.23 -0.39 2.06 -0.29 -1.32 0.00 0.00 176.35 176.64 1fgt h ILE 704 N 6.13 0.81 0.00 6.68 6.09 -1.88 0.36 117.51 135.70 1fgt h ILE 704 Ca -0.23 0.00 -0.05 0.00 -1.37 0.00 0.00 64.86 63.21 1fgt h ILE 704 Cb 1.08 0.85 -0.01 0.00 0.47 0.00 0.00 36.82 39.21 1fgt h ILE 704 CO 0.65 0.00 -0.25 0.24 -3.07 0.00 0.00 178.15 175.72 1fgt h MET 705 N 0.00 0.00 0.08 2.19 2.86 -1.94 -1.76 114.93 116.36 1fgt h MET 705 Ca 0.14 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.52 1fgt h MET 705 Cb 0.58 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 1fgt h MET 705 CO -0.00 0.25 -1.20 -0.97 1.06 0.00 0.00 176.91 176.05 1fgt h ASN 706 N 0.00 0.28 -2.06 1.22 -1.24 -1.23 -3.39 115.58 109.16 1fgt h ASN 706 Ca -0.00 -0.31 -0.57 0.00 0.71 0.00 0.00 56.30 56.13 1fgt h ASN 706 Cb 0.55 -0.09 -0.40 0.00 0.73 0.00 0.00 38.32 39.11 1fgt h ASN 706 CO 0.03 1.24 -0.98 0.54 -1.29 0.00 0.00 177.43 176.97 1fgt n ARG 707 N -3.46 1.14 -1.93 6.67 5.12 -1.08 -4.99 116.66 118.12 1fgt n ARG 707 Ca -0.07 -3.57 -0.41 0.00 -1.93 0.00 0.00 57.85 51.88 1fgt n ARG 707 Cb 1.00 -1.47 -0.01 0.00 -1.16 0.00 0.00 32.46 30.82 1fgt n ARG 707 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1fgt s PRO 708 N -1.46 4.13 0.00 5.56 0.04 -0.68 -4.82 135.00 137.77 1fgt s PRO 708 Ca 0.36 2.39 0.22 0.00 0.04 0.00 0.00 61.00 64.02 1fgt s PRO 708 Cb 0.16 -2.94 0.03 0.00 0.04 0.00 0.00 34.50 31.79 1fgt s PRO 708 CO -0.09 -0.45 1.08 0.25 0.04 0.00 0.00 177.00 177.83 1fgt n THR 709 N 0.46 0.01 -3.53 1.26 -2.24 -1.26 -3.93 114.28 105.05 1fgt n THR 709 Ca 0.01 -0.02 -0.15 0.00 -2.27 0.00 0.00 64.05 61.62 1fgt n THR 709 Cb 0.41 0.69 -0.05 0.00 -2.10 0.00 0.00 70.33 69.28 1fgt n THR 709 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fgt s ALA 710 N -3.02 -1.54 0.03 6.98 0.00 -1.26 -1.42 121.76 121.53 1fgt s ALA 710 Ca 0.09 0.86 0.06 0.00 0.00 0.00 0.00 51.96 52.97 1fgt s ALA 710 Cb 0.16 0.32 -0.02 0.00 0.00 0.00 0.00 23.12 23.58 1fgt s ALA 710 CO 0.81 -0.50 -0.18 -1.54 0.00 0.00 0.00 175.76 174.36 1fgt s SER 711 N -1.79 2.08 0.00 0.00 1.04 -1.26 -2.02 113.70 111.75 1fgt s SER 711 Ca -0.07 -0.46 0.04 0.00 0.48 0.00 0.00 55.95 55.94 1fgt s SER 711 Cb -0.01 -0.17 -0.01 0.00 0.10 0.00 0.00 66.02 65.93 1fgt s SER 711 CO 0.01 0.12 0.34 0.54 0.98 0.00 0.00 173.24 175.23 1fgt n ARG 712 N 2.01 3.42 -3.59 4.02 1.74 0.10 -1.54 116.66 122.84 1fgt n ARG 712 Ca -0.17 -0.29 -0.13 0.00 -0.77 0.00 0.00 57.85 56.50 1fgt n ARG 712 Cb 0.54 -0.83 -0.05 0.00 -1.02 0.00 0.00 32.46 31.10 1fgt n ARG 712 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1fgt s ARG 713 N -0.97 1.05 0.80 5.56 1.70 -1.26 -4.25 118.95 121.59 1fgt s ARG 713 Ca 0.03 -0.40 -0.05 0.00 -0.47 0.00 0.00 55.73 54.84 1fgt s ARG 713 Cb 0.03 0.48 0.17 0.00 -0.57 0.00 0.00 34.95 35.05 1fgt s ARG 713 CO 0.11 -0.40 1.09 1.28 -1.08 0.00 0.00 175.30 176.31 1fgt n LEU 714 N 0.17 0.00 -4.77 -1.89 4.77 -1.26 -4.82 117.00 109.20 1fgt n LEU 714 Ca -0.18 -1.95 -0.41 0.00 -0.03 0.00 0.00 56.01 53.45 1fgt n LEU 714 Cb 0.62 -0.75 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 1fgt n LEU 714 CO 0.18 -1.11 1.01 -0.76 -1.33 0.00 0.00 177.39 175.37 1fgt s LEU 715 N 0.00 4.41 0.59 2.23 1.43 -1.26 -4.99 118.68 121.09 1fgt s LEU 715 Ca 0.69 2.75 -0.17 0.00 -1.03 0.00 0.00 54.13 56.37 1fgt s LEU 715 Cb -0.03 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.50 1fgt s LEU 715 CO 0.47 -0.59 1.08 -2.16 0.23 0.00 0.00 176.35 175.37 1fgt s PRO 716 N -1.80 3.26 0.25 1.29 0.04 -1.26 -5.04 135.00 131.74 1fgt s PRO 716 Ca 0.50 1.32 -0.18 0.00 0.04 0.00 0.00 61.00 62.67 1fgt s PRO 716 Cb -0.41 -2.02 -0.08 0.00 0.04 0.00 0.00 34.50 32.03 1fgt s PRO 716 CO 0.54 -0.87 0.72 -1.21 0.04 0.00 0.00 177.00 176.22 1fgt s GLU 717 N -3.88 4.16 0.78 4.56 0.41 -1.26 -4.87 118.70 118.60 1fgt s GLU 717 Ca 0.66 0.79 -0.14 0.00 -0.41 0.00 0.00 54.97 55.87 1fgt s GLU 717 Cb -0.18 -2.73 0.07 0.00 -1.78 0.00 0.00 34.13 29.51 1fgt s GLU 717 CO 0.35 0.32 1.22 0.15 -0.49 0.00 0.00 175.26 176.80 1fgt s LYS 718 N -2.31 1.79 -0.44 1.61 1.02 -1.26 -3.14 119.74 117.01 1fgt s LYS 718 Ca 0.47 1.80 0.00 0.00 0.02 0.00 0.00 55.97 58.25 1fgt s LYS 718 Cb -0.14 -1.79 0.00 0.00 -0.52 0.00 0.00 37.83 35.38 1fgt s LYS 718 CO 0.20 -2.11 0.00 0.41 -0.92 0.00 0.00 175.35 172.93 1fgt n GLY 719 N 0.53 0.70 3.39 -3.33 0.00 -1.26 -5.02 105.19 100.20 1fgt n GLY 719 Ca 0.14 -0.71 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1fgt n GLY 719 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fgt s THR 720 N -2.12 2.07 0.38 2.61 -4.23 -1.19 -5.03 115.64 108.13 1fgt s THR 720 Ca 0.00 -2.22 0.05 0.00 -1.18 0.00 0.00 61.69 58.35 1fgt s THR 720 Cb 0.00 -2.11 0.24 0.00 1.34 0.00 0.00 72.50 71.98 1fgt s THR 720 CO 0.00 -0.44 2.01 1.55 -0.54 0.00 0.00 174.62 177.20 1fgt h PRO 721 N 2.63 0.61 -0.87 3.99 0.13 -1.96 -1.58 132.00 134.97 1fgt h PRO 721 Ca -0.40 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1fgt h PRO 721 Cb 1.23 -0.13 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 1fgt h PRO 721 CO 0.58 0.45 0.55 0.93 -0.23 0.00 0.00 178.00 180.27 1fgt h GLU 722 N 0.62 1.16 -0.36 0.86 3.07 -1.96 0.72 114.58 118.69 1fgt h GLU 722 Ca 0.16 -0.09 -0.06 0.00 -0.50 0.00 0.00 59.36 58.87 1fgt h GLU 722 Cb 0.01 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 27.65 1fgt h GLU 722 CO -0.03 0.79 -0.00 -0.92 -1.40 0.00 0.00 179.01 177.45 1fgt h TYR 723 N 1.18 0.70 -0.20 4.33 5.03 -1.51 -2.59 116.97 123.91 1fgt h TYR 723 Ca 0.31 -0.12 -0.01 0.00 2.58 0.00 0.00 58.73 61.49 1fgt h TYR 723 Cb -0.09 -0.18 -0.01 0.00 1.55 0.00 0.00 36.73 38.00 1fgt h TYR 723 CO -0.01 0.75 0.10 0.93 -1.32 0.00 0.00 178.16 178.61 1fgt h GLU 724 N 0.46 0.27 -0.52 1.82 4.39 -0.64 -1.44 114.58 118.93 1fgt h GLU 724 Ca 0.10 -0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.71 1fgt h GLU 724 Cb 0.47 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.04 1fgt h GLU 724 CO 0.02 0.21 0.02 1.49 -1.16 0.00 0.00 179.01 179.59 1fgt h GLU 725 N 0.28 0.86 -0.34 2.33 4.81 -0.51 -0.40 114.58 121.61 1fgt h GLU 725 Ca 0.07 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1fgt h GLU 725 Cb 0.03 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1fgt h GLU 725 CO -0.01 0.85 0.23 0.52 -0.73 0.00 0.00 179.01 179.86 1fgt h MET 726 N 0.80 0.44 0.00 1.92 2.86 -0.93 0.37 114.93 120.39 1fgt h MET 726 Ca 0.16 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.73 1fgt h MET 726 Cb 0.45 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.02 1fgt h MET 726 CO 0.02 0.29 -0.14 0.82 1.06 0.00 0.00 176.91 178.96 1fgt h ILE 727 N 0.45 1.60 0.00 -1.22 2.04 -1.21 -3.33 117.51 115.84 1fgt h ILE 727 Ca 0.13 -1.95 -0.05 0.00 1.00 0.00 0.00 64.86 63.99 1fgt h ILE 727 Cb -0.04 2.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.90 1fgt h ILE 727 CO -0.03 0.52 -0.92 0.78 0.00 0.00 0.00 178.15 178.50 1fgt h ASN 728 N -0.65 0.00 -1.26 1.72 2.35 -0.87 -3.42 115.58 113.45 1fgt h ASN 728 Ca -0.02 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.35 1fgt h ASN 728 Cb 0.93 0.00 -0.27 0.00 0.05 0.00 0.00 38.32 39.03 1fgt h ASN 728 CO 0.03 0.18 -0.77 -3.20 -1.65 0.00 0.00 177.43 172.01 1fgt n ASN 729 N -2.83 -1.63 0.00 5.81 2.85 0.13 -5.00 115.26 114.59 1fgt n ASN 729 Ca -0.02 -2.86 0.02 0.00 -0.11 0.00 0.00 54.58 51.61 1fgt n ASN 729 Cb 0.63 0.62 0.35 0.00 1.24 0.00 0.00 39.78 42.62 1fgt n ASN 729 CO 0.00 0.00 0.00 1.12 -2.11 0.00 0.00 177.26 176.27 1fgt h HIS 730 N 4.52 0.52 -0.45 1.20 2.07 -1.67 -1.19 115.15 120.15 1fgt h HIS 730 Ca 0.04 -0.03 -0.10 0.00 -2.85 0.00 0.00 60.37 57.43 1fgt h HIS 730 Cb 0.98 -0.16 -0.02 0.00 2.57 0.00 0.00 27.41 30.78 1fgt h HIS 730 CO 0.18 0.44 -0.12 0.93 -3.07 0.00 0.00 177.93 176.30 1fgt h GLU 731 N 0.52 0.83 -0.29 5.12 5.08 -1.92 -0.82 114.58 123.09 1fgt h GLU 731 Ca 0.12 -0.29 -0.17 0.00 -1.00 0.00 0.00 59.36 58.03 1fgt h GLU 731 Cb 0.17 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1fgt h GLU 731 CO -0.01 0.90 -0.49 -0.22 -1.00 0.00 0.00 179.01 178.20 1fgt h LYS 732 N 0.74 0.81 -0.76 2.33 1.63 -1.59 -0.58 116.57 119.15 1fgt h LYS 732 Ca 0.12 -0.48 0.03 0.00 -0.85 0.00 0.00 60.65 59.48 1fgt h LYS 732 Cb 0.62 0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 32.24 1fgt h LYS 732 CO 0.04 1.11 0.48 0.00 -3.45 0.00 0.00 179.45 177.63 1fgt h ALA 733 N 0.81 1.00 -0.08 5.00 0.00 -0.91 -0.24 119.26 124.83 1fgt h ALA 733 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1fgt h ALA 733 Cb 1.07 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1fgt h ALA 733 CO 0.11 0.27 0.01 -0.92 0.00 0.00 0.00 179.25 178.71 1fgt h TYR 734 N 0.92 0.14 -0.09 0.00 3.20 -0.94 -2.67 116.97 117.52 1fgt h TYR 734 Ca 0.31 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.10 1fgt h TYR 734 Cb 0.03 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 1fgt h TYR 734 CO -0.04 0.36 -0.18 -0.07 -1.64 0.00 0.00 178.16 176.59 1fgt h LEU 735 N -0.12 0.14 -0.89 2.82 3.38 -0.76 -1.45 115.31 118.43 1fgt h LEU 735 Ca 0.02 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1fgt h LEU 735 Cb 0.30 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1fgt h LEU 735 CO 0.00 0.34 -0.18 0.03 0.09 0.00 0.00 178.44 178.73 1fgt h ARG 736 N 0.14 0.00 0.18 1.13 3.08 -0.98 -3.20 114.38 114.73 1fgt h ARG 736 Ca 0.03 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.80 1fgt h ARG 736 Cb 0.41 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.48 1fgt h ARG 736 CO 0.03 0.18 -1.29 1.15 -1.07 0.00 0.00 179.97 178.96 1fgt h THR 737 N 0.00 1.25 -4.86 2.04 2.02 -0.94 -3.42 112.91 108.99 1fgt h THR 737 Ca -0.00 -2.55 -0.45 0.00 0.77 0.00 0.00 66.41 64.17 1fgt h THR 737 Cb 0.81 2.99 0.12 0.00 -1.74 0.00 0.00 68.15 70.33 1fgt h THR 737 CO 0.02 0.77 0.24 2.30 0.37 0.00 0.00 175.52 179.22 1fgt n ILE 738 N -3.88 0.00 -1.47 3.11 -5.35 -0.71 0.03 119.36 111.09 1fgt n ILE 738 Ca -0.19 -1.34 -0.58 0.00 -0.27 0.00 0.00 62.75 60.38 1fgt n ILE 738 Cb 0.97 -1.14 -0.08 0.00 -1.74 0.00 0.00 39.64 37.64 1fgt n ILE 738 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1fgt n THR 739 N -3.27 0.00 -1.14 7.28 -1.04 -0.86 -4.70 114.28 110.55 1fgt n THR 739 Ca 0.17 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.87 1fgt n THR 739 Cb 0.59 -0.04 0.12 0.00 -1.82 0.00 0.00 70.33 69.18 1fgt n THR 739 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1fgt s SER 740 N 0.24 3.82 0.19 8.00 0.15 -1.26 -4.79 113.70 120.05 1fgt s SER 740 Ca 0.89 1.74 -0.12 0.00 0.70 0.00 0.00 55.95 59.16 1fgt s SER 740 Cb -1.24 -2.40 0.19 0.00 -1.71 0.00 0.00 66.02 60.86 1fgt s SER 740 CO 0.57 -2.46 1.74 0.50 1.20 0.00 0.00 173.24 174.79 1fgt h LYS 741 N -1.42 0.33 0.62 5.44 3.64 -1.92 -1.26 116.57 122.00 1fgt h LYS 741 Ca -0.46 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 58.87 1fgt h LYS 741 Cb 1.26 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1fgt h LYS 741 CO 0.51 0.22 -0.30 1.25 -2.27 0.00 0.00 179.45 178.86 1fgt h LEU 742 N 0.34 -0.70 -2.08 5.20 5.85 -1.93 -0.69 115.31 121.30 1fgt h LEU 742 Ca 0.25 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 1fgt h LEU 742 Cb 0.29 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 1fgt h LEU 742 CO -0.27 -0.48 -0.07 1.55 -0.34 0.00 0.00 178.44 178.83 1fgt h PRO 743 N -0.86 0.00 -0.41 5.25 0.13 -1.87 -1.48 132.00 132.75 1fgt h PRO 743 Ca -0.08 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.02 1fgt h PRO 743 Cb 0.65 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.76 1fgt h PRO 743 CO 0.14 0.07 0.15 1.15 -0.23 0.00 0.00 178.00 179.28 1fgt h THR 744 N 0.00 1.20 -0.89 1.56 2.02 -0.62 0.89 112.91 117.07 1fgt h THR 744 Ca -0.00 -0.65 0.03 0.00 0.77 0.00 0.00 66.41 66.56 1fgt h THR 744 Cb 0.17 0.87 -0.05 0.00 -1.74 0.00 0.00 68.15 67.39 1fgt h THR 744 CO 0.01 0.23 0.59 -0.07 0.37 0.00 0.00 175.52 176.65 1fgt h LEU 745 N 0.51 0.98 -0.06 2.58 3.38 -0.07 0.40 115.31 123.03 1fgt h LEU 745 Ca 0.13 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1fgt h LEU 745 Cb 0.22 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1fgt h LEU 745 CO -0.01 0.69 -0.07 0.40 0.09 0.00 0.00 178.44 179.54 1fgt h ILE 746 N 1.15 1.38 -0.73 1.22 1.08 -1.21 -2.76 117.51 117.63 1fgt h ILE 746 Ca 0.34 -1.26 -0.02 0.00 -0.39 0.00 0.00 64.86 63.53 1fgt h ILE 746 Cb -0.04 2.08 -0.03 0.00 -3.07 0.00 0.00 36.82 35.76 1fgt h ILE 746 CO -0.09 0.35 0.38 -1.28 -0.69 0.00 0.00 178.15 176.81 1fgt h SER 747 N -0.29 0.94 -0.69 1.72 0.87 -0.53 -1.47 113.55 114.10 1fgt h SER 747 Ca 0.01 -0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.43 1fgt h SER 747 Cb 0.60 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 1fgt h SER 747 CO 0.02 0.79 0.33 -0.07 -0.53 0.00 0.00 176.83 177.36 1fgt h LEU 748 N 1.02 0.92 -0.40 2.23 3.38 -0.97 -1.29 115.31 120.20 1fgt h LEU 748 Ca 0.26 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1fgt h LEU 748 Cb 0.08 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1fgt h LEU 748 CO -0.04 0.79 0.04 0.28 0.09 0.00 0.00 178.44 179.59 1fgt h SER 749 N 1.01 0.66 -0.40 -0.43 0.02 -1.12 -1.15 113.55 112.13 1fgt h SER 749 Ca 0.24 -0.28 -0.08 0.00 -0.84 0.00 0.00 61.79 60.83 1fgt h SER 749 Cb 0.12 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1fgt h SER 749 CO -0.03 0.78 -0.05 1.62 -1.14 0.00 0.00 176.83 178.01 1fgt h VAL 750 N 0.52 1.27 0.00 2.27 3.04 -0.76 -2.40 116.25 120.19 1fgt h VAL 750 Ca 0.12 -1.10 -0.04 0.00 -1.01 0.00 0.00 66.70 64.66 1fgt h VAL 750 Cb 0.42 1.17 -0.01 0.00 -2.01 0.00 0.00 31.29 30.86 1fgt h VAL 750 CO 0.01 0.37 -0.20 0.16 -1.01 0.00 0.00 177.57 176.90 1fgt h ILE 751 N 0.56 0.53 -0.33 3.17 3.07 -1.25 -1.33 117.51 121.93 1fgt h ILE 751 Ca 0.11 -1.02 -0.07 0.00 1.55 0.00 0.00 64.86 65.43 1fgt h ILE 751 Cb 0.55 1.70 -0.01 0.00 -0.27 0.00 0.00 36.82 38.79 1fgt h ILE 751 CO 0.03 0.20 -0.05 -0.08 -1.05 0.00 0.00 178.15 177.19 1fgt h GLU 752 N 0.00 0.63 -0.22 0.16 4.81 -0.94 -1.89 114.58 117.12 1fgt h GLU 752 Ca -0.00 -0.23 0.01 0.00 -0.13 0.00 0.00 59.36 59.01 1fgt h GLU 752 Cb 0.68 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1fgt h GLU 752 CO 0.03 0.78 0.13 0.82 -0.73 0.00 0.00 179.01 180.04 1fgt h ILE 753 N 0.41 1.04 0.00 2.32 2.04 -0.92 -2.84 117.51 119.56 1fgt h ILE 753 Ca 0.09 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1fgt h ILE 753 Cb 0.54 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1fgt h ILE 753 CO 0.03 0.05 -0.08 -0.07 0.00 0.00 0.00 178.15 178.08 1fgt h LEU 754 N 0.28 0.00 -1.20 1.44 3.38 -1.14 -2.18 115.31 115.89 1fgt h LEU 754 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1fgt h LEU 754 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1fgt h LEU 754 CO -0.03 0.08 0.00 -1.20 0.09 0.00 0.00 178.44 177.38 1fgt n SER 755 N -3.74 1.84 -4.78 -0.43 7.64 -0.72 -4.75 113.62 108.68 1fgt n SER 755 Ca -0.02 -1.64 -0.37 0.00 1.01 0.00 0.00 58.87 57.84 1fgt n SER 755 Cb 0.19 -0.04 -0.06 0.00 -1.01 0.00 0.00 64.21 63.28 1fgt n SER 755 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1fgt s THR 756 N -1.92 5.22 -0.21 0.44 2.01 -0.82 -4.39 115.64 115.97 1fgt s THR 756 Ca 0.35 0.67 -0.18 0.00 0.31 0.00 0.00 61.69 62.85 1fgt s THR 756 Cb 0.20 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 69.01 1fgt s THR 756 CO 0.31 0.46 0.50 -1.00 -0.69 0.00 0.00 174.62 174.20 1fgt s HIS 757 N -0.13 3.35 0.58 4.92 3.76 0.21 -4.90 115.29 123.08 1fgt s HIS 757 Ca 0.20 0.72 -0.19 0.00 -0.15 0.00 0.00 55.06 55.64 1fgt s HIS 757 Cb -0.14 -2.66 -0.04 0.00 1.11 0.00 0.00 32.58 30.85 1fgt s HIS 757 CO 0.08 -0.13 1.22 0.00 -0.85 0.00 0.00 174.74 175.06 1fgt s ALA 758 N 1.74 2.58 -0.25 -1.40 0.00 -1.26 -0.85 121.76 122.31 1fgt s ALA 758 Ca 0.23 1.04 0.28 0.00 0.00 0.00 0.00 51.96 53.51 1fgt s ALA 758 Cb -0.15 -3.46 1.12 0.00 0.00 0.00 0.00 23.12 20.63 1fgt s ALA 758 CO 0.09 -1.17 1.83 0.66 0.00 0.00 0.00 175.76 177.17 1fgt h SER 759 N 0.98 0.00 -0.60 0.00 4.64 -1.93 -2.69 113.55 113.95 1fgt h SER 759 Ca -0.50 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.79 1fgt h SER 759 Cb 1.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 1fgt h SER 759 CO 0.55 0.00 0.03 -0.90 -0.87 0.00 0.00 176.83 175.64 1fgt n ASP 760 N -2.61 5.69 -4.75 4.97 5.68 -1.26 -4.93 116.55 119.34 1fgt n ASP 760 Ca 0.02 -2.97 -0.35 0.00 -0.50 0.00 0.00 54.79 50.99 1fgt n ASP 760 Cb 0.27 -0.70 0.05 0.00 -1.14 0.00 0.00 41.12 39.61 1fgt n ASP 760 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 1fgt s GLU 761 N -2.80 2.77 -0.23 0.11 2.56 -1.02 -5.01 118.70 115.07 1fgt s GLU 761 Ca 0.55 1.68 0.00 0.00 0.00 0.00 0.00 54.97 57.20 1fgt s GLU 761 Cb 0.42 -1.92 0.03 0.00 2.00 0.00 0.00 34.13 34.66 1fgt s GLU 761 CO 0.16 -1.33 -0.12 0.08 -0.56 0.00 0.00 175.26 173.49 1fgt s VAL 762 N -1.89 2.47 0.51 3.70 1.01 -1.26 -5.09 120.40 119.85 1fgt s VAL 762 Ca 0.74 -1.13 -0.00 0.00 0.00 0.00 0.00 61.98 61.59 1fgt s VAL 762 Cb -0.27 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 33.89 1fgt s VAL 762 CO 0.37 0.26 0.74 -0.31 0.00 0.00 0.00 175.10 176.16 1fgt s TYR 763 N 1.27 3.07 0.19 5.22 2.02 -1.26 -1.53 117.35 126.33 1fgt s TYR 763 Ca -0.00 0.17 -0.33 0.00 -0.37 0.00 0.00 57.07 56.54 1fgt s TYR 763 Cb -0.16 -2.55 -0.13 0.00 -0.40 0.00 0.00 41.96 38.71 1fgt s TYR 763 CO -0.07 -0.64 1.60 -0.11 -1.57 0.00 0.00 175.55 174.76 1fgt n LEU 764 N -2.25 3.45 0.00 -1.29 7.94 0.16 -0.46 117.00 124.55 1fgt n LEU 764 Ca 0.04 1.09 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 1fgt n LEU 764 Cb 0.59 -1.48 0.00 0.00 0.53 0.00 0.00 43.42 43.05 1fgt n LEU 764 CO 0.47 -0.15 0.00 0.61 -1.11 0.00 0.00 177.39 177.22 1fgt n GLY 765 N 3.31 0.62 3.45 -3.96 0.00 -1.26 -4.93 105.19 102.42 1fgt n GLY 765 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 1fgt n GLY 765 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fgt s GLN 766 N -0.79 1.63 0.04 1.61 -0.21 0.39 -4.63 119.66 117.70 1fgt s GLN 766 Ca 0.00 -1.75 0.00 0.00 0.02 0.00 0.00 55.36 53.63 1fgt s GLN 766 Cb 0.00 -1.65 -0.03 0.00 1.00 0.00 0.00 33.01 32.33 1fgt s GLN 766 CO 0.00 0.29 -0.04 1.03 -2.12 0.00 0.00 175.29 174.45 1fgt s ARG 767 N -3.54 0.50 0.00 2.91 0.52 -1.26 -4.73 118.95 113.36 1fgt s ARG 767 Ca 0.29 -0.90 0.21 0.00 -0.52 0.00 0.00 55.73 54.80 1fgt s ARG 767 Cb -0.04 0.02 1.08 0.00 0.52 0.00 0.00 34.95 36.53 1fgt s ARG 767 CO 0.14 -0.04 1.65 -0.40 0.02 0.00 0.00 175.30 176.66 1fgt n ASP 768 N 0.94 0.00 -3.67 0.23 5.68 -1.26 -4.69 116.55 113.79 1fgt n ASP 768 Ca -0.19 -0.12 -0.08 0.00 -0.50 0.00 0.00 54.79 53.89 1fgt n ASP 768 Cb 0.57 -0.24 -0.09 0.00 -1.14 0.00 0.00 41.12 40.23 1fgt n ASP 768 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1fgt s ASN 769 N -2.47 -0.75 0.00 -1.12 3.84 -1.26 -5.03 114.94 108.15 1fgt s ASN 769 Ca 0.22 1.23 0.14 0.00 0.21 0.00 0.00 52.86 54.66 1fgt s ASN 769 Cb 0.14 1.12 0.72 0.00 -0.55 0.00 0.00 41.25 42.68 1fgt s ASN 769 CO 0.30 -0.22 1.39 -0.81 -2.79 0.00 0.00 177.10 174.97 1fgt n PRO 770 N 4.32 0.19 -0.64 0.43 -0.04 -1.26 -3.14 135.00 134.86 1fgt n PRO 770 Ca -0.21 0.16 0.01 0.00 -0.04 0.00 0.00 63.50 63.42 1fgt n PRO 770 Cb 0.57 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.73 1fgt n PRO 770 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1fgt n HIS 771 N -1.30 0.65 0.22 0.54 8.25 -1.26 -4.76 115.22 117.57 1fgt n HIS 771 Ca 0.07 -1.44 0.18 0.00 -0.26 0.00 0.00 57.72 56.26 1fgt n HIS 771 Cb 0.12 -0.37 0.86 0.00 1.12 0.00 0.00 29.99 31.71 1fgt n HIS 771 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 1fgt h TRP 772 N 0.98 0.00 -3.54 4.41 5.08 -1.91 -3.42 115.95 117.56 1fgt h TRP 772 Ca 0.11 0.00 -0.14 0.00 1.08 0.00 0.00 58.89 59.95 1fgt h TRP 772 Cb 1.38 0.00 -0.20 0.00 -3.00 0.00 0.00 29.16 27.35 1fgt h TRP 772 CO 0.80 0.00 -0.48 -0.08 -1.28 0.00 0.00 178.44 177.41 1fgt s THR 773 N -4.52 0.09 -1.10 0.12 -1.32 -1.26 -4.87 115.64 102.79 1fgt s THR 773 Ca -0.04 -0.76 0.26 0.00 -1.21 0.00 0.00 61.69 59.93 1fgt s THR 773 Cb 0.14 -0.55 0.07 0.00 -1.51 0.00 0.00 72.50 70.65 1fgt s THR 773 CO 0.50 -0.42 1.50 -1.54 -2.21 0.00 0.00 174.62 172.45 1fgt n SER 774 N 1.26 0.50 -4.58 8.08 3.41 -0.60 -4.83 113.62 116.86 1fgt n SER 774 Ca -0.22 -0.25 -0.42 0.00 -0.26 0.00 0.00 58.87 57.73 1fgt n SER 774 Cb 0.56 0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.64 1fgt n SER 774 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1fgt s ASP 775 N -2.93 5.99 0.44 4.04 1.01 -1.26 -4.87 116.67 119.08 1fgt s ASP 775 Ca 0.13 0.53 0.13 0.00 0.71 0.00 0.00 52.55 54.05 1fgt s ASP 775 Cb 0.18 -2.54 1.01 0.00 1.01 0.00 0.00 42.92 42.58 1fgt s ASP 775 CO 0.66 -1.77 2.01 0.77 0.21 0.00 0.00 175.17 177.05 1fgt h SER 776 N 11.87 0.36 -0.30 0.27 4.64 -1.99 -1.35 113.55 127.06 1fgt h SER 776 Ca -0.28 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 1fgt h SER 776 Cb 1.12 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 1fgt h SER 776 CO 1.15 0.23 0.14 0.07 -0.87 0.00 0.00 176.83 177.55 1fgt h LYS 777 N 0.41 0.43 -0.54 4.77 2.10 -1.99 0.21 116.57 121.96 1fgt h LYS 777 Ca 0.23 -0.07 -0.11 0.00 -2.00 0.00 0.00 60.65 58.70 1fgt h LYS 777 Cb 0.37 -0.08 -0.02 0.00 -0.90 0.00 0.00 32.23 31.60 1fgt h LYS 777 CO -0.06 0.41 -0.11 0.00 -2.00 0.00 0.00 179.45 177.69 1fgt h ALA 778 N 0.99 0.78 -0.66 0.07 0.00 -1.80 -2.02 119.26 116.62 1fgt h ALA 778 Ca 0.10 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1fgt h ALA 778 Cb 0.13 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1fgt h ALA 778 CO -0.01 0.67 0.11 -0.07 0.00 0.00 0.00 179.25 179.95 1fgt h LEU 779 N 0.91 1.04 -0.64 0.00 3.38 -1.00 -1.28 115.31 117.73 1fgt h LEU 779 Ca 0.14 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1fgt h LEU 779 Cb 0.68 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1fgt h LEU 779 CO 0.05 1.03 0.00 1.56 0.09 0.00 0.00 178.44 181.17 1fgt h GLN 780 N 1.02 1.07 -0.52 1.13 1.08 -0.37 -1.81 115.11 116.71 1fgt h GLN 780 Ca 0.20 -0.34 -0.06 0.00 -1.45 0.00 0.00 58.65 57.00 1fgt h GLN 780 Cb 0.43 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.74 1fgt h GLN 780 CO 0.01 1.04 0.07 0.00 -0.95 0.00 0.00 178.83 179.00 1fgt h ALA 781 N 1.01 1.14 -0.23 3.87 0.00 -1.13 -1.76 119.26 122.17 1fgt h ALA 781 Ca 0.17 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1fgt h ALA 781 Cb 0.56 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1fgt h ALA 781 CO 0.03 0.56 -0.41 0.35 0.00 0.00 0.00 179.25 179.79 1fgt h PHE 782 N 0.79 0.65 -0.62 0.00 3.57 -0.91 -2.12 116.94 118.29 1fgt h PHE 782 Ca 0.16 -0.19 -0.07 0.00 3.53 0.00 0.00 57.97 61.40 1fgt h PHE 782 Cb 0.38 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1fgt h PHE 782 CO 0.02 0.87 0.09 0.37 -2.23 0.00 0.00 178.31 177.43 1fgt h GLN 783 N 0.45 1.01 -0.49 1.11 5.75 -0.90 -1.64 115.11 120.40 1fgt h GLN 783 Ca 0.04 -0.26 -0.07 0.00 -0.15 0.00 0.00 58.65 58.21 1fgt h GLN 783 Cb 0.91 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 29.31 1fgt h GLN 783 CO 0.08 0.94 0.03 0.87 -2.65 0.00 0.00 178.83 178.10 1fgt h LYS 784 N 0.95 0.79 -0.35 1.69 1.57 -1.07 -1.50 116.57 118.66 1fgt h LYS 784 Ca 0.19 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1fgt h LYS 784 Cb 0.43 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1fgt h LYS 784 CO 0.01 0.78 0.14 0.35 -0.57 0.00 0.00 179.45 180.16 1fgt h PHE 785 N 0.75 0.53 -0.41 -1.35 3.57 -0.89 -0.51 116.94 118.63 1fgt h PHE 785 Ca 0.15 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.54 1fgt h PHE 785 Cb 0.41 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 1fgt h PHE 785 CO 0.02 0.50 -0.03 0.78 -2.23 0.00 0.00 178.31 177.35 1fgt h GLY 786 N 0.42 0.74 1.14 2.40 0.00 -1.07 -1.08 103.07 105.61 1fgt h GLY 786 Ca 0.12 -0.49 -0.11 0.00 0.00 0.00 0.00 47.33 46.84 1fgt h GLY 786 CO -0.01 0.45 -0.12 3.43 0.00 0.00 0.00 176.54 180.29 1fgt h ASN 787 N 0.64 1.01 -0.81 0.19 2.35 -0.99 -2.21 115.58 115.76 1fgt h ASN 787 Ca 0.12 -0.34 -0.04 0.00 -0.55 0.00 0.00 56.30 55.50 1fgt h ASN 787 Cb 0.45 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.51 1fgt h ASN 787 CO 0.02 1.12 0.36 0.50 -1.65 0.00 0.00 177.43 177.78 1fgt h LYS 788 N 0.89 1.19 -0.41 0.81 1.63 -0.68 -1.62 116.57 118.38 1fgt h LYS 788 Ca 0.14 -0.20 -0.06 0.00 -0.85 0.00 0.00 60.65 59.68 1fgt h LYS 788 Cb 0.69 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 32.09 1fgt h LYS 788 CO 0.05 0.94 -0.01 -0.07 -3.45 0.00 0.00 179.45 176.90 1fgt h LEU 789 N 1.16 0.63 -0.83 5.20 3.38 -0.88 0.21 115.31 124.18 1fgt h LEU 789 Ca 0.27 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 58.01 1fgt h LEU 789 Cb 0.17 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1fgt h LEU 789 CO -0.03 0.71 -0.16 0.11 0.09 0.00 0.00 178.44 179.16 1fgt h LYS 790 N 0.62 0.71 -0.56 1.13 1.57 -0.94 -0.86 116.57 118.23 1fgt h LYS 790 Ca 0.12 -0.25 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 1fgt h LYS 790 Cb 0.41 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 1fgt h LYS 790 CO 0.02 0.83 0.23 1.49 -0.57 0.00 0.00 179.45 181.45 1fgt h GLU 791 N 0.63 0.84 -0.55 3.15 4.81 -0.57 -2.57 114.58 120.33 1fgt h GLU 791 Ca 0.10 -0.15 -0.07 0.00 -0.13 0.00 0.00 59.36 59.12 1fgt h GLU 791 Cb 0.62 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1fgt h GLU 791 CO 0.04 0.72 0.08 0.82 -0.73 0.00 0.00 179.01 179.94 1fgt h ILE 792 N 0.77 1.25 -0.85 2.32 2.04 -0.57 -2.68 117.51 119.79 1fgt h ILE 792 Ca 0.19 -0.97 0.04 0.00 1.00 0.00 0.00 64.86 65.12 1fgt h ILE 792 Cb 0.18 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.03 1fgt h ILE 792 CO -0.02 0.35 0.54 -0.08 0.00 0.00 0.00 178.15 178.95 1fgt h GLU 793 N 0.80 1.00 -0.74 2.37 4.81 -0.91 0.14 114.58 122.06 1fgt h GLU 793 Ca 0.17 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1fgt h GLU 793 Cb 0.42 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.54 1fgt h GLU 793 CO 0.01 0.66 0.46 0.93 -0.73 0.00 0.00 179.01 180.35 1fgt h GLU 794 N 1.03 1.00 -0.47 1.92 5.08 -1.18 -0.86 114.58 121.09 1fgt h GLU 794 Ca 0.35 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.54 1fgt h GLU 794 Cb 0.05 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1fgt h GLU 794 CO -0.13 0.69 -0.04 -0.22 -1.00 0.00 0.00 179.01 178.30 1fgt h LYS 795 N 1.02 0.86 -0.19 2.33 3.64 -0.89 -1.79 116.57 121.55 1fgt h LYS 795 Ca 0.27 -0.30 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 1fgt h LYS 795 Cb -0.06 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1fgt h LYS 795 CO -0.05 0.93 -0.23 -0.07 -2.27 0.00 0.00 179.45 177.76 1fgt h LEU 796 N 0.71 0.33 -0.53 5.20 3.38 -0.38 -0.74 115.31 123.27 1fgt h LEU 796 Ca 0.13 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1fgt h LEU 796 Cb 0.57 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1fgt h LEU 796 CO 0.03 0.57 0.11 0.58 0.09 0.00 0.00 178.44 179.82 1fgt h VAL 797 N 0.30 1.25 -0.67 1.22 2.07 -0.93 -0.95 116.25 118.54 1fgt h VAL 797 Ca 0.05 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.63 1fgt h VAL 797 Cb 0.57 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1fgt h VAL 797 CO 0.04 0.33 0.25 0.03 0.02 0.00 0.00 177.57 178.24 1fgt h ARG 798 N 0.76 1.00 -0.32 1.57 3.08 -0.66 -1.13 114.38 118.67 1fgt h ARG 798 Ca 0.17 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1fgt h ARG 798 Cb 0.36 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1fgt h ARG 798 CO 0.00 0.83 0.16 0.00 -1.07 0.00 0.00 179.97 179.90 1fgt h ARG 799 N 0.98 0.46 0.00 0.04 3.08 -0.51 -1.40 114.38 117.03 1fgt h ARG 799 Ca 0.23 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 1fgt h ARG 799 Cb 0.21 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1fgt h ARG 799 CO -0.02 0.41 -0.18 -0.91 -1.07 0.00 0.00 179.97 178.21 1fgt h ASN 800 N 0.39 0.00 0.35 7.04 2.35 -0.77 -2.11 115.58 122.84 1fgt h ASN 800 Ca 0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1fgt h ASN 800 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1fgt h ASN 800 CO -0.02 0.18 -0.26 0.59 -1.65 0.00 0.00 177.43 176.28 1fgt n ASN 801 N -3.69 0.74 -4.60 5.81 3.02 -0.47 -4.81 115.26 111.26 1fgt n ASN 801 Ca -0.01 -0.62 -0.43 0.00 -0.03 0.00 0.00 54.58 53.48 1fgt n ASN 801 Cb 0.30 0.08 -0.02 0.00 -0.61 0.00 0.00 39.78 39.52 1fgt n ASN 801 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1fgt s ASP 802 N -2.61 6.48 0.55 6.41 -1.08 -0.57 -4.90 116.67 120.95 1fgt s ASP 802 Ca 0.22 0.63 0.27 0.00 -0.52 0.00 0.00 52.55 53.15 1fgt s ASP 802 Cb 0.19 -2.55 1.45 0.00 -1.46 0.00 0.00 42.92 40.56 1fgt s ASP 802 CO 0.54 -1.35 1.97 -0.65 0.52 0.00 0.00 175.17 176.20 1fgt h PRO 803 N 9.96 0.00 0.00 4.34 0.11 -1.87 -0.83 132.00 143.71 1fgt h PRO 803 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1fgt h PRO 803 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1fgt h PRO 803 CO 1.11 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.33 1fgt n SER 804 N -4.16 0.12 -0.55 -2.05 7.64 -1.26 -2.70 113.62 110.65 1fgt n SER 804 Ca 0.10 0.52 0.05 0.00 1.01 0.00 0.00 58.87 60.55 1fgt n SER 804 Cb 0.64 -0.55 0.12 0.00 -1.01 0.00 0.00 64.21 63.41 1fgt n SER 804 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1fgt n LEU 805 N -1.62 2.65 -0.33 -3.43 4.77 -0.32 -4.70 117.00 114.01 1fgt n LEU 805 Ca 0.04 -1.79 0.04 0.00 -0.03 0.00 0.00 56.01 54.27 1fgt n LEU 805 Cb 0.23 -0.17 0.22 0.00 -2.33 0.00 0.00 43.42 41.37 1fgt n LEU 805 CO 0.18 0.64 1.25 -0.61 -1.33 0.00 0.00 177.39 177.52 1fgt h GLN 806 N 1.90 1.04 -0.68 3.23 -0.00 -1.53 -1.21 115.11 117.87 1fgt h GLN 806 Ca 0.00 -0.06 0.10 0.00 -0.00 0.00 0.00 58.65 58.69 1fgt h GLN 806 Cb 0.65 -0.24 -0.08 0.00 0.00 0.00 0.00 27.48 27.82 1fgt h GLN 806 CO 0.00 0.69 0.29 0.78 0.00 0.00 0.00 178.83 180.59 1fgt h GLY 807 N 1.08 0.99 0.00 2.39 0.00 -1.84 -0.17 103.07 105.52 1fgt h GLY 807 Ca 0.41 -0.16 -0.27 0.00 0.00 0.00 0.00 47.33 47.31 1fgt h GLY 807 CO -0.16 -0.01 -2.24 0.70 0.00 0.00 0.00 176.54 174.84 1fgt n ASN 808 N -4.95 0.22 0.17 0.19 3.02 -1.14 -3.30 115.26 109.48 1fgt n ASN 808 Ca 0.11 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.78 1fgt n ASN 808 Cb 0.30 1.21 0.12 0.00 -0.61 0.00 0.00 39.78 40.81 1fgt n ASN 808 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1fgt h ARG 809 N 0.00 0.00 0.00 3.52 3.08 -1.22 -3.41 114.38 116.35 1fgt h ARG 809 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 1fgt h ARG 809 Cb 1.89 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.94 1fgt h ARG 809 CO 0.02 0.00 -0.72 1.28 -1.07 0.00 0.00 179.97 179.48 1fgt n LEU 810 N -2.90 1.45 0.00 3.04 4.32 -0.43 -0.88 117.00 121.60 1fgt n LEU 810 Ca 0.03 0.00 0.09 0.00 -0.02 0.00 0.00 56.01 56.10 1fgt n LEU 810 Cb 0.53 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.31 1fgt n LEU 810 CO 0.36 0.20 -0.11 0.61 -1.22 0.00 0.00 177.39 177.22 1fgt n GLY 811 N 2.82 -1.78 0.25 -0.72 0.00 -0.21 -1.61 105.19 103.94 1fgt n GLY 811 Ca 0.00 -1.23 0.17 0.00 0.00 0.00 0.00 46.02 44.96 1fgt n GLY 811 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fgt h PRO 812 N 0.00 0.00 -0.00 1.61 0.13 -1.90 0.07 132.00 131.91 1fgt h PRO 812 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1fgt h PRO 812 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 1fgt h PRO 812 CO 0.00 0.00 -0.04 1.33 -0.23 0.00 0.00 178.00 179.06 1fgt n VAL 813 N -2.81 0.00 -3.89 1.56 0.24 -1.25 -4.70 118.33 107.48 1fgt n VAL 813 Ca -0.00 -0.01 -0.28 0.00 -2.04 0.00 0.00 64.34 62.00 1fgt n VAL 813 Cb 0.19 -0.40 -0.00 0.00 -1.47 0.00 0.00 33.84 32.16 1fgt n VAL 813 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fgt n GLN 814 N -1.30 -2.53 -3.99 7.34 1.13 0.01 -4.41 117.38 113.64 1fgt n GLN 814 Ca 0.12 0.39 -0.31 0.00 -1.94 0.00 0.00 57.00 55.27 1fgt n GLN 814 Cb 0.28 -4.29 -0.14 0.00 0.11 0.00 0.00 30.24 26.19 1fgt n GLN 814 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1fgt s LEU 815 N -6.87 4.61 0.11 1.08 2.96 -0.64 -4.90 118.68 115.04 1fgt s LEU 815 Ca 0.16 -2.49 -0.35 0.00 -0.22 0.00 0.00 54.13 51.23 1fgt s LEU 815 Cb -0.06 -1.64 -0.15 0.00 0.50 0.00 0.00 46.19 44.84 1fgt s LEU 815 CO 0.89 -0.33 1.50 -2.65 -1.32 0.00 0.00 176.35 174.44 1fgt n PRO 816 N 3.81 1.73 -2.10 0.98 -0.02 -1.26 -4.23 135.00 133.91 1fgt n PRO 816 Ca 0.04 0.62 -0.37 0.00 -2.02 0.00 0.00 63.50 61.78 1fgt n PRO 816 Cb 0.38 -2.34 -0.03 0.00 -0.02 0.00 0.00 33.50 31.48 1fgt n PRO 816 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1fgt s TYR 817 N 0.96 1.76 -0.60 6.00 5.04 -0.06 -4.75 117.35 125.71 1fgt s TYR 817 Ca 0.82 0.64 0.06 0.00 -2.44 0.00 0.00 57.07 56.16 1fgt s TYR 817 Cb -0.80 -4.15 0.16 0.00 0.35 0.00 0.00 41.96 37.52 1fgt s TYR 817 CO 0.43 -2.19 1.06 0.25 -1.34 0.00 0.00 175.55 173.76 1fgt n THR 818 N 7.22 0.80 0.30 4.34 -2.24 -1.26 -4.71 114.28 118.73 1fgt n THR 818 Ca 0.22 -0.90 0.18 0.00 -2.27 0.00 0.00 64.05 61.28 1fgt n THR 818 Cb 0.51 0.63 1.01 0.00 -2.10 0.00 0.00 70.33 70.37 1fgt n THR 818 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1fgt h LEU 819 N 1.22 0.00 -2.98 3.22 3.38 -1.82 -1.41 115.31 116.93 1fgt h LEU 819 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1fgt h LEU 819 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1fgt h LEU 819 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 1fgt n LEU 820 N -3.46 3.74 -4.71 1.67 4.77 -1.26 -4.29 117.00 113.45 1fgt n LEU 820 Ca -0.02 -2.25 -0.42 0.00 -0.03 0.00 0.00 56.01 53.28 1fgt n LEU 820 Cb 0.15 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 40.80 1fgt n LEU 820 CO 0.23 0.80 1.26 -0.31 -1.33 0.00 0.00 177.39 178.04 1fgt s TYR 821 N -1.47 2.86 0.26 -1.77 1.51 -0.53 -4.91 117.35 113.30 1fgt s TYR 821 Ca 0.38 0.53 -0.04 0.00 -1.01 0.00 0.00 57.07 56.93 1fgt s TYR 821 Cb 0.23 -3.94 0.34 0.00 -0.11 0.00 0.00 41.96 38.48 1fgt s TYR 821 CO 0.21 -3.55 1.91 -1.35 -1.11 0.00 0.00 175.55 171.65 1fgt h PRO 822 N 7.30 1.24 -6.16 -1.71 0.11 -1.89 -0.92 132.00 129.96 1fgt h PRO 822 Ca -0.43 -0.07 -0.51 0.00 0.11 0.00 0.00 66.00 65.10 1fgt h PRO 822 Cb 1.20 -0.28 -0.03 0.00 0.11 0.00 0.00 31.00 32.00 1fgt h PRO 822 CO 0.92 0.82 -0.48 -1.54 -0.21 0.00 0.00 178.00 177.50 1fgt s SER 823 N -6.01 6.01 -0.07 -2.05 1.04 -1.26 -1.02 113.70 110.33 1fgt s SER 823 Ca -0.13 -0.01 -0.29 0.00 0.48 0.00 0.00 55.95 55.99 1fgt s SER 823 Cb 0.19 -1.70 0.10 0.00 0.10 0.00 0.00 66.02 64.72 1fgt s SER 823 CO 0.82 -0.01 0.86 -0.55 0.98 0.00 0.00 173.24 175.34 1fgt s SER 824 N -3.65 -0.45 0.80 7.02 0.15 -1.26 -3.44 113.70 112.87 1fgt s SER 824 Ca 0.33 0.35 -0.07 0.00 0.70 0.00 0.00 55.95 57.26 1fgt s SER 824 Cb -0.09 0.40 0.14 0.00 -1.71 0.00 0.00 66.02 64.76 1fgt s SER 824 CO 0.27 -0.52 1.10 -1.61 1.20 0.00 0.00 173.24 173.68 1fgt s GLU 825 N -1.84 1.41 0.84 5.44 0.41 -1.26 -5.02 118.70 118.69 1fgt s GLU 825 Ca -0.02 -0.76 -0.11 0.00 -0.41 0.00 0.00 54.97 53.67 1fgt s GLU 825 Cb -0.01 -2.15 0.10 0.00 -1.78 0.00 0.00 34.13 30.29 1fgt s GLU 825 CO -0.00 -1.73 1.09 -1.83 -0.49 0.00 0.00 175.26 172.30 1fgt s GLU 826 N -5.40 1.71 0.00 1.61 1.03 -1.26 -4.85 118.70 111.54 1fgt s GLU 826 Ca 0.68 1.04 0.00 0.00 0.03 0.00 0.00 54.97 56.72 1fgt s GLU 826 Cb -0.06 -1.84 0.00 0.00 -0.80 0.00 0.00 34.13 31.43 1fgt s GLU 826 CO 0.47 -1.99 0.00 0.41 -1.33 0.00 0.00 175.26 172.82 1fgt n GLY 827 N -1.05 -0.98 3.31 -3.83 0.00 -0.03 -4.75 105.19 97.86 1fgt n GLY 827 Ca 0.08 -2.14 -0.44 0.00 0.00 0.00 0.00 46.02 43.52 1fgt n GLY 827 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fgt n LEU 828 N 0.00 5.61 0.00 0.99 0.00 -1.26 -0.62 117.00 121.72 1fgt n LEU 828 Ca 0.00 -4.85 0.11 0.00 0.00 0.00 0.00 56.01 51.27 1fgt n LEU 828 Cb 0.00 -1.50 -0.02 0.00 0.00 0.00 0.00 43.42 41.90 1fgt n LEU 828 CO 0.00 1.20 0.01 0.35 0.00 0.00 0.00 177.39 178.95 1fgt n THR 829 N 3.17 0.03 -1.88 1.96 -2.24 -1.26 -4.98 114.28 109.08 1fgt n THR 829 Ca 0.29 -0.08 -0.19 0.00 -2.27 0.00 0.00 64.05 61.81 1fgt n THR 829 Cb 0.39 0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 69.21 1fgt n THR 829 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1fgt n PHE 830 N -1.63 -0.37 -3.89 4.78 7.35 -1.26 -4.95 117.46 117.49 1fgt n PHE 830 Ca 0.03 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.65 1fgt n PHE 830 Cb 0.37 -3.38 -0.03 0.00 0.35 0.00 0.00 39.48 36.78 1fgt n PHE 830 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 1fgt s ARG 831 N -4.14 1.72 0.00 -4.13 1.70 -1.26 -2.83 118.95 110.01 1fgt s ARG 831 Ca 0.00 -1.06 0.00 0.00 -0.47 0.00 0.00 55.73 54.20 1fgt s ARG 831 Cb 0.00 0.57 0.00 0.00 -0.57 0.00 0.00 34.95 34.95 1fgt s ARG 831 CO 0.00 -0.77 0.00 0.41 -1.08 0.00 0.00 175.30 173.86 1fgt n GLY 832 N -0.44 1.13 3.17 3.88 0.00 -0.36 -4.75 105.19 107.83 1fgt n GLY 832 Ca -0.04 -1.33 -0.37 0.00 0.00 0.00 0.00 46.02 44.28 1fgt n GLY 832 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fgt s ILE 833 N -0.11 3.47 0.83 -0.61 1.01 -0.19 -4.93 121.20 120.67 1fgt s ILE 833 Ca 0.00 -1.70 -0.11 0.00 0.00 0.00 0.00 60.65 58.84 1fgt s ILE 833 Cb 0.00 -3.21 0.09 0.00 0.01 0.00 0.00 42.46 39.35 1fgt s ILE 833 CO 0.00 -0.49 1.09 -2.84 0.00 0.00 0.00 174.94 172.70 1fgt s PRO 834 N 1.25 1.78 0.42 2.79 0.02 -1.26 -0.67 135.00 139.33 1fgt s PRO 834 Ca 0.03 1.05 0.19 0.00 0.02 0.00 0.00 61.00 62.30 1fgt s PRO 834 Cb -0.22 -1.85 0.95 0.00 0.02 0.00 0.00 34.50 33.40 1fgt s PRO 834 CO -0.02 -1.95 1.88 -0.91 -0.33 0.00 0.00 177.00 175.68 1fgt h ASN 835 N -1.35 0.00 -5.05 2.53 2.35 -1.50 -3.39 115.58 109.17 1fgt h ASN 835 Ca -0.46 0.00 -0.51 0.00 -0.55 0.00 0.00 56.30 54.78 1fgt h ASN 835 Cb 1.25 0.00 -0.13 0.00 0.05 0.00 0.00 38.32 39.49 1fgt h ASN 835 CO 0.52 0.28 -0.49 -0.94 -1.65 0.00 0.00 177.43 175.16 1fgt s SER 836 N -6.55 2.12 -0.93 5.81 1.04 -1.23 -3.59 113.70 110.36 1fgt s SER 836 Ca -0.02 -1.77 -0.20 0.00 0.48 0.00 0.00 55.95 54.44 1fgt s SER 836 Cb 0.13 0.58 0.11 0.00 0.10 0.00 0.00 66.02 66.94 1fgt s SER 836 CO 0.67 -1.05 1.19 -0.63 0.98 0.00 0.00 173.24 174.40 1fgt s ILE 837 N -3.34 4.50 -1.83 -1.02 1.01 -1.09 -4.72 121.20 114.72 1fgt s ILE 837 Ca 0.35 -1.28 0.15 0.00 0.00 0.00 0.00 60.65 59.86 1fgt s ILE 837 Cb 0.02 -4.84 0.12 0.00 0.01 0.00 0.00 42.46 37.77 1fgt s ILE 837 CO 0.24 -1.61 0.97 -1.54 0.00 0.00 0.00 174.94 173.01 1fgt n SER 838 N 7.20 2.25 0.00 3.58 3.41 -1.26 -2.92 113.62 125.89 1fgt n SER 838 Ca 0.24 -1.62 0.00 0.00 -0.26 0.00 0.00 58.87 57.23 1fgt n SER 838 Cb 0.49 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1fgt n SER 838 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88